smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name c1c2ccccc2[nH]c1C[NH+]1Cc2ccccc2C1 ZINC000000019205 537949929 /nfs/dbraw/zinc/94/99/29/537949929.db2.gz GPGZXVNMWHAXCO-UHFFFAOYSA-N 1 1 248.329 3.684 20 0 BHADMO Cc1ccccc1Nc1[nH+]c2ccccc2n1C ZINC000000512997 179308175 /nfs/dbraw/zinc/30/81/75/179308175.db2.gz JJRWGZYSAUYRSQ-UHFFFAOYSA-N 1 1 237.306 3.625 20 0 BHADMO Cc1cccc(Nc2[nH+]c3ccccc3n2C)c1 ZINC000000512998 179158503 /nfs/dbraw/zinc/15/85/03/179158503.db2.gz HJDPXMYMYVMGOR-UHFFFAOYSA-N 1 1 237.306 3.625 20 0 BHADMO Cc1ccc(Nc2[nH+]c3ccccc3n2C)cc1 ZINC000000512999 385352663 /nfs/dbraw/zinc/35/26/63/385352663.db2.gz FYESONDFHKCMRE-UHFFFAOYSA-N 1 1 237.306 3.625 20 0 BHADMO Clc1ccc(-c2c[nH+]c3n2CCCC3)cc1 ZINC000001509477 355924661 /nfs/dbraw/zinc/92/46/61/355924661.db2.gz KGFVQOKENDNMIS-UHFFFAOYSA-N 1 1 232.714 3.540 20 0 BHADMO C[N@@H+](CCCc1ccccc1)C1CCCCC1 ZINC000001887635 388443978 /nfs/dbraw/zinc/44/39/78/388443978.db2.gz MXCMHPQGTRDFIX-UHFFFAOYSA-N 1 1 231.383 3.884 20 0 BHADMO C[C@H]1CCCC[N@H+]1CCCC(=O)c1ccccc1 ZINC000002005537 177074941 /nfs/dbraw/zinc/07/49/41/177074941.db2.gz DYEKCERXJGJWKL-AWEZNQCLSA-N 1 1 245.366 3.524 20 0 BHADMO C[C@@H]1CCCC[N@H+]1CCCC(=O)c1ccccc1 ZINC000002005538 176071542 /nfs/dbraw/zinc/07/15/42/176071542.db2.gz DYEKCERXJGJWKL-CQSZACIVSA-N 1 1 245.366 3.524 20 0 BHADMO Cc1ccc(C[N@H+]2CCc3ccccc3C2)s1 ZINC000002389218 388455368 /nfs/dbraw/zinc/45/53/68/388455368.db2.gz QXVLCMKUOIWHIQ-UHFFFAOYSA-N 1 1 243.375 3.615 20 0 BHADMO C[N@@H+](CCC(=O)c1ccccc1)C1CCCCC1 ZINC000003176454 363084739 /nfs/dbraw/zinc/08/47/39/363084739.db2.gz KFHNKQLILJWXRB-UHFFFAOYSA-N 1 1 245.366 3.524 20 0 BHADMO CC(C)[N@@H+]1CC=C(c2c[nH]c3ccccc23)CC1 ZINC000004101348 342742169 /nfs/dbraw/zinc/74/21/69/342742169.db2.gz OCHVBLDZZMKZDS-UHFFFAOYSA-N 1 1 240.350 3.665 20 0 BHADMO CCCC[N@@H+](CC)Cc1c[nH]c2ccccc12 ZINC000005596345 350200431 /nfs/dbraw/zinc/20/04/31/350200431.db2.gz APLWFNOXASOISE-UHFFFAOYSA-N 1 1 230.355 3.790 20 0 BHADMO CC[C@@H]1CCCC[N@H+]1CCC(=O)c1ccccc1 ZINC000005655703 360491965 /nfs/dbraw/zinc/49/19/65/360491965.db2.gz ICWXHZPCNKKZNB-OAHLLOKOSA-N 1 1 245.366 3.524 20 0 BHADMO CC[C@H]1CCCC[N@H+]1CCC(=O)c1ccccc1 ZINC000005656810 360492017 /nfs/dbraw/zinc/49/20/17/360492017.db2.gz ICWXHZPCNKKZNB-HNNXBMFYSA-N 1 1 245.366 3.524 20 0 BHADMO c1ccc(C[N@H+]2CC[C@H](c3ccccc3)C2)cc1 ZINC000005683073 387506135 /nfs/dbraw/zinc/50/61/35/387506135.db2.gz XGEZXIRZOJOBFI-KRWDZBQOSA-N 1 1 237.346 3.676 20 0 BHADMO c1ccc(C[N@H+]2CC[C@@H](c3ccccc3)C2)cc1 ZINC000005683078 387505365 /nfs/dbraw/zinc/50/53/65/387505365.db2.gz XGEZXIRZOJOBFI-QGZVFWFLSA-N 1 1 237.346 3.676 20 0 BHADMO CCCC[N@H+]1CC[C@H](c2ccc(C)cc2)C1 ZINC000005712600 355388199 /nfs/dbraw/zinc/38/81/99/355388199.db2.gz PLYXLYULFKORQI-HNNXBMFYSA-N 1 1 217.356 3.584 20 0 BHADMO CCCC[N@H+]1CC[C@@H](c2ccc(C)cc2)C1 ZINC000005712614 355388265 /nfs/dbraw/zinc/38/82/65/355388265.db2.gz PLYXLYULFKORQI-OAHLLOKOSA-N 1 1 217.356 3.584 20 0 BHADMO Cc1ccc(C[N@H+]2CCc3ccccc3C2)cc1 ZINC000006204459 357162320 /nfs/dbraw/zinc/16/23/20/357162320.db2.gz WTMGISMFFAUECA-UHFFFAOYSA-N 1 1 237.346 3.553 20 0 BHADMO C(=C/c1ccccc1)\C[N@H+]1CCc2ccccc2C1 ZINC000006227407 357196088 /nfs/dbraw/zinc/19/60/88/357196088.db2.gz NGTBVPMVXAYHJZ-RMKNXTFCSA-N 1 1 249.357 3.758 20 0 BHADMO CCCCCC[N@H+]1CCc2ccc(OC)cc2C1 ZINC000006309946 588360163 /nfs/dbraw/zinc/36/01/63/588360163.db2.gz OZYFEQVQMBRJSF-UHFFFAOYSA-N 1 1 247.382 3.634 20 0 BHADMO Cc1ccc(C[N@@H+](C)CCc2ccccc2)s1 ZINC000008675637 355325328 /nfs/dbraw/zinc/32/53/28/355325328.db2.gz YNIYVJRZKAXMDV-UHFFFAOYSA-N 1 1 245.391 3.731 20 0 BHADMO CCC[N@@H+](C)CCOc1cccc2ccccc21 ZINC000013776470 169077361 /nfs/dbraw/zinc/07/73/61/169077361.db2.gz NNOQKMUYNWQAJH-UHFFFAOYSA-N 1 1 243.350 3.560 20 0 BHADMO Clc1cccc(Cl)c1C[NH+]1CCCC1 ZINC000014193455 350657881 /nfs/dbraw/zinc/65/78/81/350657881.db2.gz VHJVMGORXCRXKX-UHFFFAOYSA-N 1 1 230.138 3.589 20 0 BHADMO Clc1cccc(Cl)c1C[NH+]1CCCCC1 ZINC000014193499 344446363 /nfs/dbraw/zinc/44/63/63/344446363.db2.gz QITTYLBDRJYZCL-UHFFFAOYSA-N 1 1 244.165 3.979 20 0 BHADMO C[C@@H]1CCC[N@@H+](Cc2c(F)cccc2Cl)C1 ZINC000014193641 344446599 /nfs/dbraw/zinc/44/65/99/344446599.db2.gz ZFNJKLARVIRLAJ-SNVBAGLBSA-N 1 1 241.737 3.711 20 0 BHADMO C[C@H]1CCC[N@@H+](Cc2c(F)cccc2Cl)C1 ZINC000014193642 344446690 /nfs/dbraw/zinc/44/66/90/344446690.db2.gz ZFNJKLARVIRLAJ-JTQLQIEISA-N 1 1 241.737 3.711 20 0 BHADMO C[C@@H]1CCC[N@@H+](Cc2ccc(F)cc2Cl)C1 ZINC000014193647 344446476 /nfs/dbraw/zinc/44/64/76/344446476.db2.gz ARAJEEIXADICLN-SNVBAGLBSA-N 1 1 241.737 3.711 20 0 BHADMO C[C@H]1CCC[N@@H+](Cc2ccc(F)cc2Cl)C1 ZINC000014193648 344446642 /nfs/dbraw/zinc/44/66/42/344446642.db2.gz ARAJEEIXADICLN-JTQLQIEISA-N 1 1 241.737 3.711 20 0 BHADMO C[C@@H]1CCC[N@@H+](Cc2cccc(Cl)c2)C1 ZINC000014193663 344446319 /nfs/dbraw/zinc/44/63/19/344446319.db2.gz CTWBKYWRAIAHSW-LLVKDONJSA-N 1 1 223.747 3.572 20 0 BHADMO C[C@H]1CCC[N@@H+](Cc2cccc(Cl)c2)C1 ZINC000014193664 344446339 /nfs/dbraw/zinc/44/63/39/344446339.db2.gz CTWBKYWRAIAHSW-NSHDSACASA-N 1 1 223.747 3.572 20 0 BHADMO C[C@@H]1CCCC[N@H+]1Cc1c(F)cccc1Cl ZINC000014193780 344446971 /nfs/dbraw/zinc/44/69/71/344446971.db2.gz IINHFDVYXCUTOB-SNVBAGLBSA-N 1 1 241.737 3.854 20 0 BHADMO C[C@H]1CCCC[N@H+]1Cc1c(F)cccc1Cl ZINC000014193781 344447142 /nfs/dbraw/zinc/44/71/42/344447142.db2.gz IINHFDVYXCUTOB-JTQLQIEISA-N 1 1 241.737 3.854 20 0 BHADMO C[C@@H]1CCCC[N@H+]1Cc1ccc(F)cc1Cl ZINC000014193784 344447009 /nfs/dbraw/zinc/44/70/09/344447009.db2.gz JPURIZFYBCRRSC-SNVBAGLBSA-N 1 1 241.737 3.854 20 0 BHADMO C[C@H]1CCCC[N@H+]1Cc1ccc(F)cc1Cl ZINC000014193785 344447001 /nfs/dbraw/zinc/44/70/01/344447001.db2.gz JPURIZFYBCRRSC-JTQLQIEISA-N 1 1 241.737 3.854 20 0 BHADMO C[C@@H]1CCCC[N@H+]1Cc1cccc(Cl)c1 ZINC000014193800 344446981 /nfs/dbraw/zinc/44/69/81/344446981.db2.gz XZSGYYACXZVVJX-LLVKDONJSA-N 1 1 223.747 3.714 20 0 BHADMO C[C@H]1CCCC[N@H+]1Cc1cccc(Cl)c1 ZINC000014193801 344447027 /nfs/dbraw/zinc/44/70/27/344447027.db2.gz XZSGYYACXZVVJX-NSHDSACASA-N 1 1 223.747 3.714 20 0 BHADMO C[C@@H]1CCC[C@H](C)[N@@H+]1Cc1ccccc1F ZINC000014193914 177117062 /nfs/dbraw/zinc/11/70/62/177117062.db2.gz YSFZQVJCESVYPF-TXEJJXNPSA-N 1 1 221.319 3.589 20 0 BHADMO Cc1cccc(C[N@@H+]2[C@H](C)CCC[C@@H]2C)c1 ZINC000014193922 386584062 /nfs/dbraw/zinc/58/40/62/386584062.db2.gz GKVCHQIGVHXJCC-OKILXGFUSA-N 1 1 217.356 3.758 20 0 BHADMO C[C@@H]1CCC[C@H](C)[N@@H+]1Cc1ccc(F)cc1 ZINC000014193934 177117165 /nfs/dbraw/zinc/11/71/65/177117165.db2.gz DRCARXRIRVAEDE-TXEJJXNPSA-N 1 1 221.319 3.589 20 0 BHADMO Cc1ccc(C[N@@H+]2[C@H](C)CCC[C@@H]2C)cc1 ZINC000014193943 386585867 /nfs/dbraw/zinc/58/58/67/386585867.db2.gz GNYLJFBQZQJQQW-OKILXGFUSA-N 1 1 217.356 3.758 20 0 BHADMO C[C@@H]1CCC[C@H](C)[N@@H+]1Cc1cccc(F)c1 ZINC000014193947 177117849 /nfs/dbraw/zinc/11/78/49/177117849.db2.gz OJOZRKFUBFKFOP-TXEJJXNPSA-N 1 1 221.319 3.589 20 0 BHADMO Cc1ccccc1C[N@@H+]1[C@H](C)CCC[C@@H]1C ZINC000014193967 386584197 /nfs/dbraw/zinc/58/41/97/386584197.db2.gz ZKHVDXJCXMDPBF-OKILXGFUSA-N 1 1 217.356 3.758 20 0 BHADMO C[C@@H]1C[C@H](C)C[N@H+](Cc2ccc(Cl)cc2)C1 ZINC000014194354 344447044 /nfs/dbraw/zinc/44/70/44/344447044.db2.gz ZEVGFPBCOADJNT-TXEJJXNPSA-N 1 1 237.774 3.818 20 0 BHADMO C[C@@H]1C[C@H](C)C[N@H+](Cc2ccccc2Cl)C1 ZINC000014194366 344447153 /nfs/dbraw/zinc/44/71/53/344447153.db2.gz RQOPOSWRRZHNSD-TXEJJXNPSA-N 1 1 237.774 3.818 20 0 BHADMO C[C@@H]1C[C@H](C)C[N@H+](Cc2cccc(Cl)c2)C1 ZINC000014194395 344446946 /nfs/dbraw/zinc/44/69/46/344446946.db2.gz DELDPSHFJKYDOB-TXEJJXNPSA-N 1 1 237.774 3.818 20 0 BHADMO Cc1cccc(C[N@H+]2CCc3ccccc3C2)c1 ZINC000014217341 179082943 /nfs/dbraw/zinc/08/29/43/179082943.db2.gz XBIZMIUAWSRTOC-UHFFFAOYSA-N 1 1 237.346 3.553 20 0 BHADMO C[N@@H+](Cc1ccccc1F)C1CCCCC1 ZINC000014217951 344451825 /nfs/dbraw/zinc/45/18/25/344451825.db2.gz DXIJUTCIRYPRDJ-UHFFFAOYSA-N 1 1 221.319 3.590 20 0 BHADMO Cc1cccc(C[N@H+](C)C2CCCCC2)c1 ZINC000014217955 386585135 /nfs/dbraw/zinc/58/51/35/386585135.db2.gz YWZHQCSDCQWXQW-UHFFFAOYSA-N 1 1 217.356 3.760 20 0 BHADMO C[N@@H+](Cc1ccc(F)cc1)C1CCCCC1 ZINC000014217960 386585313 /nfs/dbraw/zinc/58/53/13/386585313.db2.gz NSLVWKDDSIVFJO-UHFFFAOYSA-N 1 1 221.319 3.590 20 0 BHADMO Cc1ccc(C[N@H+](C)C2CCCCC2)cc1 ZINC000014217966 386585619 /nfs/dbraw/zinc/58/56/19/386585619.db2.gz XIRMQVFWHQFCTG-UHFFFAOYSA-N 1 1 217.356 3.760 20 0 BHADMO C[N@@H+](Cc1cccc(F)c1)C1CCCCC1 ZINC000014217967 344451883 /nfs/dbraw/zinc/45/18/83/344451883.db2.gz XFDAETFWXUGDRE-UHFFFAOYSA-N 1 1 221.319 3.590 20 0 BHADMO Cc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000014217977 256664500 /nfs/dbraw/zinc/66/45/00/256664500.db2.gz QQZCHTNTLQYMGU-UHFFFAOYSA-N 1 1 217.356 3.760 20 0 BHADMO C[C@@H]([NH2+]Cc1ccco1)c1cc2ccccc2o1 ZINC000019274373 349004735 /nfs/dbraw/zinc/00/47/35/349004735.db2.gz GDUSARWPAZBVBR-LLVKDONJSA-N 1 1 241.290 3.877 20 0 BHADMO C[C@H]([NH2+]Cc1ccco1)c1cc2ccccc2o1 ZINC000019274375 398033771 /nfs/dbraw/zinc/03/37/71/398033771.db2.gz GDUSARWPAZBVBR-NSHDSACASA-N 1 1 241.290 3.877 20 0 BHADMO C[C@@H]([NH2+]Cc1c(F)cccc1F)c1ccccc1 ZINC000019878049 385162068 /nfs/dbraw/zinc/16/20/68/385162068.db2.gz BDJZPCDJJFHKOQ-LLVKDONJSA-N 1 1 247.288 3.816 20 0 BHADMO C[C@H]([NH2+]Cc1c(F)cccc1F)c1ccccc1 ZINC000019878050 385160310 /nfs/dbraw/zinc/16/03/10/385160310.db2.gz BDJZPCDJJFHKOQ-NSHDSACASA-N 1 1 247.288 3.816 20 0 BHADMO C[C@@H]([NH2+]Cc1ccccc1)c1c(F)cccc1F ZINC000019899496 347311659 /nfs/dbraw/zinc/31/16/59/347311659.db2.gz NYZWFNJOPRYZET-LLVKDONJSA-N 1 1 247.288 3.816 20 0 BHADMO C[C@H]([NH2+]Cc1ccccc1)c1c(F)cccc1F ZINC000019899497 385188683 /nfs/dbraw/zinc/18/86/83/385188683.db2.gz NYZWFNJOPRYZET-NSHDSACASA-N 1 1 247.288 3.816 20 0 BHADMO C[C@@H]([NH2+]Cc1ccccc1Cl)c1ccccn1 ZINC000019908217 356992231 /nfs/dbraw/zinc/99/22/31/356992231.db2.gz XOBADSQXHXVYCH-LLVKDONJSA-N 1 1 246.741 3.586 20 0 BHADMO C[C@H]([NH2+]Cc1ccccc1Cl)c1ccccn1 ZINC000019908218 387063302 /nfs/dbraw/zinc/06/33/02/387063302.db2.gz XOBADSQXHXVYCH-NSHDSACASA-N 1 1 246.741 3.586 20 0 BHADMO C[C@@H]([NH2+]Cc1ccccc1Cl)c1ccco1 ZINC000019908236 356992910 /nfs/dbraw/zinc/99/29/10/356992910.db2.gz RHTOSUAMZBGOLQ-SNVBAGLBSA-N 1 1 235.714 3.784 20 0 BHADMO C[C@H]([NH2+]Cc1ccccc1Cl)c1ccco1 ZINC000019908237 387063497 /nfs/dbraw/zinc/06/34/97/387063497.db2.gz RHTOSUAMZBGOLQ-JTQLQIEISA-N 1 1 235.714 3.784 20 0 BHADMO C[C@@H]([NH2+]Cc1ccccc1F)c1ccccc1F ZINC000019949992 347327519 /nfs/dbraw/zinc/32/75/19/347327519.db2.gz UWDYNHUOSPEKHK-LLVKDONJSA-N 1 1 247.288 3.816 20 0 BHADMO C[C@H]([NH2+]Cc1ccccc1F)c1ccccc1F ZINC000019949995 385228389 /nfs/dbraw/zinc/22/83/89/385228389.db2.gz UWDYNHUOSPEKHK-NSHDSACASA-N 1 1 247.288 3.816 20 0 BHADMO Cc1ccc([C@@H](C)[NH2+]Cc2ccccc2F)o1 ZINC000019950067 397962169 /nfs/dbraw/zinc/96/21/69/397962169.db2.gz VNNOGEFJJJUZPO-LLVKDONJSA-N 1 1 233.286 3.578 20 0 BHADMO Cc1ccc([C@H](C)[NH2+]Cc2ccccc2F)o1 ZINC000019950070 397962731 /nfs/dbraw/zinc/96/27/31/397962731.db2.gz VNNOGEFJJJUZPO-NSHDSACASA-N 1 1 233.286 3.578 20 0 BHADMO C[C@@H]([NH2+]Cc1ccccn1)c1ccccc1Cl ZINC000019957242 350915759 /nfs/dbraw/zinc/91/57/59/350915759.db2.gz HZIVDQOPYFLFCR-LLVKDONJSA-N 1 1 246.741 3.586 20 0 BHADMO C[C@H]([NH2+]Cc1ccccn1)c1ccccc1Cl ZINC000019957247 385659823 /nfs/dbraw/zinc/65/98/23/385659823.db2.gz HZIVDQOPYFLFCR-NSHDSACASA-N 1 1 246.741 3.586 20 0 BHADMO Cc1ccc(C[NH2+]Cc2c(F)cccc2F)cc1 ZINC000019962345 385236423 /nfs/dbraw/zinc/23/64/23/385236423.db2.gz IAZBGFUFIMPDAP-UHFFFAOYSA-N 1 1 247.288 3.563 20 0 BHADMO Cc1nc([C@@H](C)[NH2+]Cc2ccccc2)c(C)s1 ZINC000020086649 180037269 /nfs/dbraw/zinc/03/72/69/180037269.db2.gz ORYBKLJSXDNHRY-SNVBAGLBSA-N 1 1 246.379 3.611 20 0 BHADMO Cc1nc([C@H](C)[NH2+]Cc2ccccc2)c(C)s1 ZINC000020086651 180048596 /nfs/dbraw/zinc/04/85/96/180048596.db2.gz ORYBKLJSXDNHRY-JTQLQIEISA-N 1 1 246.379 3.611 20 0 BHADMO COc1ccccc1[C@@H](C)[NH2+][C@@H](C)c1ccco1 ZINC000020096812 175345611 /nfs/dbraw/zinc/34/56/11/175345611.db2.gz IXWWMJBODSOCOZ-NEPJUHHUSA-N 1 1 245.322 3.700 20 0 BHADMO COc1ccccc1[C@H](C)[NH2+][C@@H](C)c1ccco1 ZINC000020096814 175351946 /nfs/dbraw/zinc/35/19/46/175351946.db2.gz IXWWMJBODSOCOZ-RYUDHWBXSA-N 1 1 245.322 3.700 20 0 BHADMO COc1ccccc1[C@@H](C)[NH2+][C@H](C)c1ccco1 ZINC000020096815 175345620 /nfs/dbraw/zinc/34/56/20/175345620.db2.gz IXWWMJBODSOCOZ-VXGBXAGGSA-N 1 1 245.322 3.700 20 0 BHADMO COc1ccccc1[C@H](C)[NH2+][C@H](C)c1ccco1 ZINC000020096817 175352565 /nfs/dbraw/zinc/35/25/65/175352565.db2.gz IXWWMJBODSOCOZ-NWDGAFQWSA-N 1 1 245.322 3.700 20 0 BHADMO C[C@@H]([NH2+][C@@H](C)c1ccccc1F)c1ccccn1 ZINC000020123373 342970251 /nfs/dbraw/zinc/97/02/51/342970251.db2.gz VULMAAKATRUJRM-NWDGAFQWSA-N 1 1 244.313 3.633 20 0 BHADMO C[C@H]([NH2+][C@@H](C)c1ccccc1F)c1ccccn1 ZINC000020123374 384577962 /nfs/dbraw/zinc/57/79/62/384577962.db2.gz VULMAAKATRUJRM-RYUDHWBXSA-N 1 1 244.313 3.633 20 0 BHADMO C[C@@H]([NH2+][C@H](C)c1ccccc1F)c1ccccn1 ZINC000020123375 342970227 /nfs/dbraw/zinc/97/02/27/342970227.db2.gz VULMAAKATRUJRM-VXGBXAGGSA-N 1 1 244.313 3.633 20 0 BHADMO C[C@@H]([NH2+][C@@H](C)c1ccccn1)c1ccccc1F ZINC000020123376 342970247 /nfs/dbraw/zinc/97/02/47/342970247.db2.gz VULMAAKATRUJRM-NEPJUHHUSA-N 1 1 244.313 3.633 20 0 BHADMO Cc1cccc(C[NH2+]Cc2c(F)cccc2F)c1 ZINC000020133881 179093313 /nfs/dbraw/zinc/09/33/13/179093313.db2.gz JUQBBDJCNFBGPH-UHFFFAOYSA-N 1 1 247.288 3.563 20 0 BHADMO C[C@@H]([NH2+][C@@H]1CCCc2occc21)c1ccco1 ZINC000020204380 342976834 /nfs/dbraw/zinc/97/68/34/342976834.db2.gz RADXXXNEGHXASG-ZYHUDNBSSA-N 1 1 231.295 3.601 20 0 BHADMO C[C@H]([NH2+][C@@H]1CCCc2occc21)c1ccco1 ZINC000020204383 384600195 /nfs/dbraw/zinc/60/01/95/384600195.db2.gz RADXXXNEGHXASG-CMPLNLGQSA-N 1 1 231.295 3.601 20 0 BHADMO C[C@@H]([NH2+][C@H]1CCCc2occc21)c1ccco1 ZINC000020204385 342976796 /nfs/dbraw/zinc/97/67/96/342976796.db2.gz RADXXXNEGHXASG-PWSUYJOCSA-N 1 1 231.295 3.601 20 0 BHADMO C[C@H]([NH2+][C@H]1CCCc2occc21)c1ccco1 ZINC000020204388 342976716 /nfs/dbraw/zinc/97/67/16/342976716.db2.gz RADXXXNEGHXASG-JQWIXIFHSA-N 1 1 231.295 3.601 20 0 BHADMO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCCc3occc32)o1 ZINC000020204423 384599512 /nfs/dbraw/zinc/59/95/12/384599512.db2.gz QTVUJLLFFPENFV-DGCLKSJQSA-N 1 1 245.322 3.909 20 0 BHADMO Cc1ccc([C@H](C)[NH2+][C@@H]2CCCc3occc32)o1 ZINC000020204426 384599093 /nfs/dbraw/zinc/59/90/93/384599093.db2.gz QTVUJLLFFPENFV-WCQYABFASA-N 1 1 245.322 3.909 20 0 BHADMO Cc1ccc([C@@H](C)[NH2+][C@H]2CCCc3occc32)o1 ZINC000020204427 384598922 /nfs/dbraw/zinc/59/89/22/384598922.db2.gz QTVUJLLFFPENFV-YPMHNXCESA-N 1 1 245.322 3.909 20 0 BHADMO Cc1ccc([C@H](C)[NH2+][C@H]2CCCc3occc32)o1 ZINC000020204429 384599995 /nfs/dbraw/zinc/59/99/95/384599995.db2.gz QTVUJLLFFPENFV-AAEUAGOBSA-N 1 1 245.322 3.909 20 0 BHADMO Cc1nc(C[NH2+][C@H](C)c2ccccc2C)cs1 ZINC000020253214 342978582 /nfs/dbraw/zinc/97/85/82/342978582.db2.gz LUHWPBDSSVHHLB-LLVKDONJSA-N 1 1 246.379 3.611 20 0 BHADMO Cc1nc(C[NH2+][C@@H](C)c2ccccc2C)cs1 ZINC000020253215 342978482 /nfs/dbraw/zinc/97/84/82/342978482.db2.gz LUHWPBDSSVHHLB-NSHDSACASA-N 1 1 246.379 3.611 20 0 BHADMO Cc1cc([C@@H](C)[NH2+]Cc2ccccc2F)c(C)o1 ZINC000020438294 178228311 /nfs/dbraw/zinc/22/83/11/178228311.db2.gz WXKGDYFXWPELMB-LLVKDONJSA-N 1 1 247.313 3.886 20 0 BHADMO Cc1cc([C@H](C)[NH2+]Cc2ccccc2F)c(C)o1 ZINC000020438297 178251393 /nfs/dbraw/zinc/25/13/93/178251393.db2.gz WXKGDYFXWPELMB-NSHDSACASA-N 1 1 247.313 3.886 20 0 BHADMO Cc1cc([C@H](C)[NH2+][C@H](C)c2ccccn2)c(C)o1 ZINC000020438691 178258867 /nfs/dbraw/zinc/25/88/67/178258867.db2.gz XXUKKAHIQQQCEF-NWDGAFQWSA-N 1 1 244.338 3.703 20 0 BHADMO Cc1cc([C@H](C)[NH2+][C@@H](C)c2ccccn2)c(C)o1 ZINC000020438696 178254439 /nfs/dbraw/zinc/25/44/39/178254439.db2.gz XXUKKAHIQQQCEF-RYUDHWBXSA-N 1 1 244.338 3.703 20 0 BHADMO Cc1cc([C@@H](C)[NH2+][C@H](C)c2ccccn2)c(C)o1 ZINC000020438701 178233123 /nfs/dbraw/zinc/23/31/23/178233123.db2.gz XXUKKAHIQQQCEF-VXGBXAGGSA-N 1 1 244.338 3.703 20 0 BHADMO Cc1cc([C@@H](C)[NH2+][C@@H](C)c2ccccn2)c(C)o1 ZINC000020438705 178230548 /nfs/dbraw/zinc/23/05/48/178230548.db2.gz XXUKKAHIQQQCEF-NEPJUHHUSA-N 1 1 244.338 3.703 20 0 BHADMO CC(C)CNc1cc[nH+]c2cc(Cl)ccc12 ZINC000020546165 259399569 /nfs/dbraw/zinc/39/95/69/259399569.db2.gz PUKHJZYNAVYPOF-UHFFFAOYSA-N 1 1 234.730 3.956 20 0 BHADMO Cc1ccc(NCc2ccc(Cl)cc2)[nH+]c1 ZINC000020567231 357013691 /nfs/dbraw/zinc/01/36/91/357013691.db2.gz WIOXWXGNLDDWIJ-UHFFFAOYSA-N 1 1 232.714 3.656 20 0 BHADMO Clc1ccc2c(NCC3CC3)cc[nH+]c2c1 ZINC000021062723 356493290 /nfs/dbraw/zinc/49/32/90/356493290.db2.gz AAJSFWWETHEVAM-UHFFFAOYSA-N 1 1 232.714 3.710 20 0 BHADMO Cc1ccc(NCc2ccccc2Cl)[nH+]c1 ZINC000021817957 357051692 /nfs/dbraw/zinc/05/16/92/357051692.db2.gz QDWSMIOCSCZIJT-UHFFFAOYSA-N 1 1 232.714 3.656 20 0 BHADMO CCOc1ccccc1[C@@H](C)[NH2+]Cc1ccco1 ZINC000021963524 343030960 /nfs/dbraw/zinc/03/09/60/343030960.db2.gz KNWPAPVGYDGEGS-GFCCVEGCSA-N 1 1 245.322 3.529 20 0 BHADMO CCOc1ccccc1[C@H](C)[NH2+]Cc1ccco1 ZINC000021963529 343031169 /nfs/dbraw/zinc/03/11/69/343031169.db2.gz KNWPAPVGYDGEGS-LBPRGKRZSA-N 1 1 245.322 3.529 20 0 BHADMO C[C@@H]([NH2+]Cc1ccco1)c1ccccc1Cl ZINC000022219689 175902195 /nfs/dbraw/zinc/90/21/95/175902195.db2.gz PGGBRGZGCJULBM-SNVBAGLBSA-N 1 1 235.714 3.784 20 0 BHADMO C[C@H]([NH2+]Cc1ccco1)c1ccccc1Cl ZINC000022219692 387270619 /nfs/dbraw/zinc/27/06/19/387270619.db2.gz PGGBRGZGCJULBM-JTQLQIEISA-N 1 1 235.714 3.784 20 0 BHADMO c1ccc2[nH+]c(NC3CCCCCC3)[nH]c2c1 ZINC000026440233 387867982 /nfs/dbraw/zinc/86/79/82/387867982.db2.gz VRBDUURHXSMJJD-UHFFFAOYSA-N 1 1 229.327 3.698 20 0 BHADMO CCCC[N@@H+](CC)Cc1ccc(Cl)cc1 ZINC000028221840 541499830 /nfs/dbraw/zinc/49/98/30/541499830.db2.gz OECAWKWYHKAEMO-UHFFFAOYSA-N 1 1 225.763 3.962 20 0 BHADMO CCCC[N@@H+](CC)Cc1ccccc1Cl ZINC000028221857 368241575 /nfs/dbraw/zinc/24/15/75/368241575.db2.gz WQIBAWWCXPYMJR-UHFFFAOYSA-N 1 1 225.763 3.962 20 0 BHADMO C[C@@H]1Cc2ccccc2C[N@H+]1Cc1ccccc1 ZINC000028245506 387531228 /nfs/dbraw/zinc/53/12/28/387531228.db2.gz CSCFEDOGGKUFCG-CQSZACIVSA-N 1 1 237.346 3.633 20 0 BHADMO C[C@H]1Cc2ccccc2C[N@H+]1Cc1ccccc1 ZINC000028245512 177389487 /nfs/dbraw/zinc/38/94/87/177389487.db2.gz CSCFEDOGGKUFCG-AWEZNQCLSA-N 1 1 237.346 3.633 20 0 BHADMO C[C@@H]1CCC[N@H+]1CCc1ccc2ccccc2c1 ZINC000029130345 176109001 /nfs/dbraw/zinc/10/90/01/176109001.db2.gz PSTMOSWQMHZABO-CQSZACIVSA-N 1 1 239.362 3.867 20 0 BHADMO C[C@H]1CCC[N@H+]1CCc1ccc2ccccc2c1 ZINC000029130464 177109113 /nfs/dbraw/zinc/10/91/13/177109113.db2.gz PSTMOSWQMHZABO-AWEZNQCLSA-N 1 1 239.362 3.867 20 0 BHADMO CC[N@@H+]1Cc2ccccc2[C@H](c2ccccc2)C1 ZINC000029234240 170040928 /nfs/dbraw/zinc/04/09/28/170040928.db2.gz QKUVNSGJPHVOHY-KRWDZBQOSA-N 1 1 237.346 3.654 20 0 BHADMO CC[N@@H+]1Cc2ccccc2[C@@H](c2ccccc2)C1 ZINC000029234246 170040869 /nfs/dbraw/zinc/04/08/69/170040869.db2.gz QKUVNSGJPHVOHY-QGZVFWFLSA-N 1 1 237.346 3.654 20 0 BHADMO CC[C@@H](C)[N@H+]1CCc2[nH]c3ccc(C)cc3c2C1 ZINC000032192765 538950119 /nfs/dbraw/zinc/95/01/19/538950119.db2.gz OZALJKGFQHTUGN-GFCCVEGCSA-N 1 1 242.366 3.633 20 0 BHADMO CC[C@H](C)[N@H+]1CCc2[nH]c3ccc(C)cc3c2C1 ZINC000032192766 538950086 /nfs/dbraw/zinc/95/00/86/538950086.db2.gz OZALJKGFQHTUGN-LBPRGKRZSA-N 1 1 242.366 3.633 20 0 BHADMO CCCC[N@H+]1CCc2[nH]c3ccc(C)cc3c2C1 ZINC000032192860 350192549 /nfs/dbraw/zinc/19/25/49/350192549.db2.gz ZGEHJUDRCBHGTK-UHFFFAOYSA-N 1 1 242.366 3.635 20 0 BHADMO C[N@@H+](C/C=C\c1ccccc1)C1CCCCC1 ZINC000033404725 344477732 /nfs/dbraw/zinc/47/77/32/344477732.db2.gz JHSPLRHTXFMMHZ-FLIBITNWSA-N 1 1 229.367 3.964 20 0 BHADMO CCCCNc1ccc([NH+]2CCCCC2)cc1 ZINC000033464804 132336144 /nfs/dbraw/zinc/33/61/44/132336144.db2.gz QCDGDAQVZIMJFO-UHFFFAOYSA-N 1 1 232.371 3.889 20 0 BHADMO Cc1ccccc1C[N@H+]1CCc2sccc2C1 ZINC000033756565 360449823 /nfs/dbraw/zinc/44/98/23/360449823.db2.gz MQZTYXPSOUASNZ-UHFFFAOYSA-N 1 1 243.375 3.615 20 0 BHADMO Cc1cccc(C[N@H+]2CCc3sccc3C2)c1 ZINC000033756567 368262936 /nfs/dbraw/zinc/26/29/36/368262936.db2.gz CHWVJDVTYSBUEF-UHFFFAOYSA-N 1 1 243.375 3.615 20 0 BHADMO Cc1ccccc1OCC[N@H+](C)C1CCCCC1 ZINC000033809253 642371546 /nfs/dbraw/zinc/37/15/46/642371546.db2.gz QVFSZNVOXAXYRU-UHFFFAOYSA-N 1 1 247.382 3.638 20 0 BHADMO Cc1ccc(OCC[N@H+](C)C2CCCCC2)cc1 ZINC000033809254 642371924 /nfs/dbraw/zinc/37/19/24/642371924.db2.gz JRFRDMMRXIQVAY-UHFFFAOYSA-N 1 1 247.382 3.638 20 0 BHADMO Cc1cccc(OCC[N@H+](C)C2CCCCC2)c1 ZINC000033809255 344951083 /nfs/dbraw/zinc/95/10/83/344951083.db2.gz IBCDYZMMUXSXKA-UHFFFAOYSA-N 1 1 247.382 3.638 20 0 BHADMO C[N@@H+](CCCOc1ccccc1)C1CCCCC1 ZINC000033809376 386980927 /nfs/dbraw/zinc/98/09/27/386980927.db2.gz AFNXXRRAXKJLKO-UHFFFAOYSA-N 1 1 247.382 3.720 20 0 BHADMO Cc1ccc(C[N@H+]2CCc3sccc3C2)cc1 ZINC000033823580 368263040 /nfs/dbraw/zinc/26/30/40/368263040.db2.gz LPBHLADHFNDDTN-UHFFFAOYSA-N 1 1 243.375 3.615 20 0 BHADMO CCCC[N@H+]1CCC[C@@H]1c1ccccc1 ZINC000034076616 368263344 /nfs/dbraw/zinc/26/33/44/368263344.db2.gz ZJVAARUBQPEBDS-CQSZACIVSA-N 1 1 203.329 3.624 20 0 BHADMO CCCC[N@H+]1CCC[C@H]1c1ccccc1 ZINC000034076617 355783853 /nfs/dbraw/zinc/78/38/53/355783853.db2.gz ZJVAARUBQPEBDS-AWEZNQCLSA-N 1 1 203.329 3.624 20 0 BHADMO CCCC[N@@H+](CCC)Cc1ccc(OC)cc1 ZINC000034182236 346217285 /nfs/dbraw/zinc/21/72/85/346217285.db2.gz KLJLWOGJERHXMD-UHFFFAOYSA-N 1 1 235.371 3.707 20 0 BHADMO C[C@@H](c1ccccc1)[N@@H+](C)Cc1ccccc1 ZINC000034411112 350265307 /nfs/dbraw/zinc/26/53/07/350265307.db2.gz WKZKTYMPZABIEF-AWEZNQCLSA-N 1 1 225.335 3.880 20 0 BHADMO C[C@H](c1ccccc1)[N@@H+](C)Cc1ccccc1 ZINC000034411113 350264830 /nfs/dbraw/zinc/26/48/30/350264830.db2.gz WKZKTYMPZABIEF-CQSZACIVSA-N 1 1 225.335 3.880 20 0 BHADMO CCCCC[N@H+]1CCc2c3ccccc3[nH]c2C1 ZINC000034522311 357918962 /nfs/dbraw/zinc/91/89/62/357918962.db2.gz OMZMLWXQELNEIX-UHFFFAOYSA-N 1 1 242.366 3.716 20 0 BHADMO CCCCC[N@@H+]1CCc2c3ccccc3[nH]c2C1 ZINC000034522311 357918960 /nfs/dbraw/zinc/91/89/60/357918960.db2.gz OMZMLWXQELNEIX-UHFFFAOYSA-N 1 1 242.366 3.716 20 0 BHADMO C[N@@H+](CCCc1ccccc1)Cc1ccccc1 ZINC000034539983 566372713 /nfs/dbraw/zinc/37/27/13/566372713.db2.gz GPLZNRKHPRFRAR-UHFFFAOYSA-N 1 1 239.362 3.751 20 0 BHADMO Cc1ccc[nH+]c1NC/C=C/c1ccccc1 ZINC000034586458 387347399 /nfs/dbraw/zinc/34/73/99/387347399.db2.gz JZYVVVKZCBQSAN-UXBLZVDNSA-N 1 1 224.307 3.515 20 0 BHADMO CCCCNc1ccc([NH+]2CCCC2)cc1C ZINC000035037255 645874423 /nfs/dbraw/zinc/87/44/23/645874423.db2.gz IJIWUTRICIIIML-UHFFFAOYSA-N 1 1 232.371 3.807 20 0 BHADMO CCCC[N@@H+](CC)CCCC(=O)c1ccccc1 ZINC000035041160 323397076 /nfs/dbraw/zinc/39/70/76/323397076.db2.gz VSQOTJJXURZHGR-UHFFFAOYSA-N 1 1 247.382 3.772 20 0 BHADMO Nc1cccc(C[N@@H+](C2CC2)C2CCCCC2)c1 ZINC000035081153 398074175 /nfs/dbraw/zinc/07/41/75/398074175.db2.gz XTQJMJUFGYUPSV-UHFFFAOYSA-N 1 1 244.382 3.566 20 0 BHADMO CCCC[N@@H+](CC)C/C=C\c1ccccc1 ZINC000035105313 355809277 /nfs/dbraw/zinc/80/92/77/355809277.db2.gz LRMRYVILDDKJIT-XFXZXTDPSA-N 1 1 217.356 3.822 20 0 BHADMO CCOc1ccccc1C[NH2+][C@@H](C)c1ccco1 ZINC000035136898 343286066 /nfs/dbraw/zinc/28/60/66/343286066.db2.gz ALYCHKBHMDATQV-LBPRGKRZSA-N 1 1 245.322 3.529 20 0 BHADMO CCOc1ccccc1C[NH2+][C@H](C)c1ccco1 ZINC000035136900 343286041 /nfs/dbraw/zinc/28/60/41/343286041.db2.gz ALYCHKBHMDATQV-GFCCVEGCSA-N 1 1 245.322 3.529 20 0 BHADMO C[C@H]([NH2+]Cc1cc2ccccc2o1)c1ccco1 ZINC000035137006 387362932 /nfs/dbraw/zinc/36/29/32/387362932.db2.gz WHNVCZGOKAWWEE-NSHDSACASA-N 1 1 241.290 3.877 20 0 BHADMO C[C@@H]([NH2+]Cc1cc2ccccc2o1)c1ccco1 ZINC000035137008 387362166 /nfs/dbraw/zinc/36/21/66/387362166.db2.gz WHNVCZGOKAWWEE-LLVKDONJSA-N 1 1 241.290 3.877 20 0 BHADMO C[C@H]([NH2+]Cc1ccc([C@H]2C[C@H]2C)o1)c1ccco1 ZINC000035141634 357971094 /nfs/dbraw/zinc/97/10/94/357971094.db2.gz JFVSISGRQVJBKS-MDZLAQPJSA-N 1 1 245.322 3.847 20 0 BHADMO C[C@H]([NH2+]Cc1ccc([C@H]2C[C@@H]2C)o1)c1ccco1 ZINC000035141637 357971442 /nfs/dbraw/zinc/97/14/42/357971442.db2.gz JFVSISGRQVJBKS-GVXVVHGQSA-N 1 1 245.322 3.847 20 0 BHADMO C[C@H]([NH2+]Cc1ccc([C@@H]2C[C@H]2C)o1)c1ccco1 ZINC000035141640 357971245 /nfs/dbraw/zinc/97/12/45/357971245.db2.gz JFVSISGRQVJBKS-NTZNESFSSA-N 1 1 245.322 3.847 20 0 BHADMO C[C@H]([NH2+]Cc1ccc([C@@H]2C[C@@H]2C)o1)c1ccco1 ZINC000035141642 357971059 /nfs/dbraw/zinc/97/10/59/357971059.db2.gz JFVSISGRQVJBKS-GMXVVIOVSA-N 1 1 245.322 3.847 20 0 BHADMO CN(C)c1ccc([NH2+]CC2CCCCC2)cc1 ZINC000035164407 643596872 /nfs/dbraw/zinc/59/68/72/643596872.db2.gz HWUICURWMQJDLY-UHFFFAOYSA-N 1 1 232.371 3.745 20 0 BHADMO Cc1cc([NH2+]CC2CCCCC2)ccc1N ZINC000035278276 646180927 /nfs/dbraw/zinc/18/09/27/646180927.db2.gz KHZPOQLIHYJFPC-UHFFFAOYSA-N 1 1 218.344 3.569 20 0 BHADMO CCCCC[N@@H+](Cc1cccc(N)c1)C(C)C ZINC000035365593 358457973 /nfs/dbraw/zinc/45/79/73/358457973.db2.gz KNSNQNNRAWLVIP-UHFFFAOYSA-N 1 1 234.387 3.669 20 0 BHADMO CCC(CC)C[N@@H+](CC)Cc1cccc(N)c1 ZINC000036196525 168350739 /nfs/dbraw/zinc/35/07/39/168350739.db2.gz KAHYOWXZVFMUMQ-UHFFFAOYSA-N 1 1 234.387 3.527 20 0 BHADMO CCC[C@@H](C)C[NH2+]c1ccc(N(C)C)cc1 ZINC000036335097 169360909 /nfs/dbraw/zinc/36/09/09/169360909.db2.gz HPLZMHUSXQNGJM-GFCCVEGCSA-N 1 1 220.360 3.601 20 0 BHADMO CCC[C@H](C)C[NH2+]c1ccc(N(C)C)cc1 ZINC000036335098 643176166 /nfs/dbraw/zinc/17/61/66/643176166.db2.gz HPLZMHUSXQNGJM-LBPRGKRZSA-N 1 1 220.360 3.601 20 0 BHADMO CN(C)c1ccc([NH2+]C[C@H]2CC=CCC2)cc1 ZINC000036335131 643177567 /nfs/dbraw/zinc/17/75/67/643177567.db2.gz VWNHRZRLXXNMHI-ZDUSSCGKSA-N 1 1 230.355 3.521 20 0 BHADMO CN(C)c1ccc([NH2+]C[C@@H]2CC=CCC2)cc1 ZINC000036335132 643177163 /nfs/dbraw/zinc/17/71/63/643177163.db2.gz VWNHRZRLXXNMHI-CYBMUJFWSA-N 1 1 230.355 3.521 20 0 BHADMO CCC(CC)C[NH2+]c1ccc(N(C)C)cc1 ZINC000036335268 168366802 /nfs/dbraw/zinc/36/68/02/168366802.db2.gz XFRZLLOWCNWBOF-UHFFFAOYSA-N 1 1 220.360 3.601 20 0 BHADMO Cc1nc([C@@H](C)[NH2+][C@@H](C)c2ccccc2)cs1 ZINC000036914349 180036692 /nfs/dbraw/zinc/03/66/92/180036692.db2.gz JMKCEPBTEQUVSD-WDEREUQCSA-N 1 1 246.379 3.863 20 0 BHADMO Cc1nc([C@H](C)[NH2+][C@@H](C)c2ccccc2)cs1 ZINC000036914350 180051446 /nfs/dbraw/zinc/05/14/46/180051446.db2.gz JMKCEPBTEQUVSD-QWRGUYRKSA-N 1 1 246.379 3.863 20 0 BHADMO Cc1nc([C@@H](C)[NH2+][C@H](C)c2ccccc2)cs1 ZINC000036914351 180038247 /nfs/dbraw/zinc/03/82/47/180038247.db2.gz JMKCEPBTEQUVSD-GHMZBOCLSA-N 1 1 246.379 3.863 20 0 BHADMO Cc1nc([C@H](C)[NH2+][C@H](C)c2ccccc2)cs1 ZINC000036914352 180051295 /nfs/dbraw/zinc/05/12/95/180051295.db2.gz JMKCEPBTEQUVSD-MNOVXSKESA-N 1 1 246.379 3.863 20 0 BHADMO Cc1nc([C@H](C)[NH2+]Cc2cccc(C)c2)cs1 ZINC000036915331 179097515 /nfs/dbraw/zinc/09/75/15/179097515.db2.gz SFRXVZJWBHUCSG-NSHDSACASA-N 1 1 246.379 3.611 20 0 BHADMO Cc1nc([C@@H](C)[NH2+]Cc2cccc(C)c2)cs1 ZINC000036915332 179099901 /nfs/dbraw/zinc/09/99/01/179099901.db2.gz SFRXVZJWBHUCSG-LLVKDONJSA-N 1 1 246.379 3.611 20 0 BHADMO Cc1cc([NH+]2CCCC2)ccc1NC1CCCC1 ZINC000036955676 384522660 /nfs/dbraw/zinc/52/26/60/384522660.db2.gz KRYOHIARHLSPKB-UHFFFAOYSA-N 1 1 244.382 3.950 20 0 BHADMO Cc1cc([NH+]2CCCC2)ccc1N[C@@H](C)C1CC1 ZINC000036955739 384228886 /nfs/dbraw/zinc/22/88/86/384228886.db2.gz GAZJNYCWHCWJJN-ZDUSSCGKSA-N 1 1 244.382 3.806 20 0 BHADMO Cc1cc([NH+]2CCCC2)ccc1N[C@H](C)C1CC1 ZINC000036955740 384227235 /nfs/dbraw/zinc/22/72/35/384227235.db2.gz GAZJNYCWHCWJJN-CYBMUJFWSA-N 1 1 244.382 3.806 20 0 BHADMO CC[C@H]([NH2+]Cc1ccco1)c1ccccc1OC ZINC000036995039 358465367 /nfs/dbraw/zinc/46/53/67/358465367.db2.gz HBLSEKWFHUXCDO-AWEZNQCLSA-N 1 1 245.322 3.529 20 0 BHADMO CC[C@@H]([NH2+]Cc1ccco1)c1ccccc1OC ZINC000036995040 358465464 /nfs/dbraw/zinc/46/54/64/358465464.db2.gz HBLSEKWFHUXCDO-CQSZACIVSA-N 1 1 245.322 3.529 20 0 BHADMO C[N@@H+](CCCC(=O)c1ccccc1)C1CCCC1 ZINC000037323017 358473060 /nfs/dbraw/zinc/47/30/60/358473060.db2.gz XRMYJQWLQCMZCG-UHFFFAOYSA-N 1 1 245.366 3.524 20 0 BHADMO CCC[N@@H+](CCCC(=O)c1ccccc1)C1CC1 ZINC000037323096 169154125 /nfs/dbraw/zinc/15/41/25/169154125.db2.gz VHPODLPBMGFUGZ-UHFFFAOYSA-N 1 1 245.366 3.524 20 0 BHADMO CC(C)[C@@H](C)[N@@H+](C)CCCC(=O)c1ccccc1 ZINC000037328744 167368145 /nfs/dbraw/zinc/36/81/45/167368145.db2.gz GWCWRQRKIBDVCX-CQSZACIVSA-N 1 1 247.382 3.626 20 0 BHADMO CC(C)[C@H](C)[N@@H+](C)CCCC(=O)c1ccccc1 ZINC000037328746 387563124 /nfs/dbraw/zinc/56/31/24/387563124.db2.gz GWCWRQRKIBDVCX-AWEZNQCLSA-N 1 1 247.382 3.626 20 0 BHADMO Cc1ccc(NC2CCCCCC2)[nH+]c1 ZINC000037390344 384496344 /nfs/dbraw/zinc/49/63/44/384496344.db2.gz KVPGPBKADICTGM-UHFFFAOYSA-N 1 1 204.317 3.525 20 0 BHADMO Cc1ccccc1C[NH2+]Cc1c(F)cccc1F ZINC000037486703 179283546 /nfs/dbraw/zinc/28/35/46/179283546.db2.gz NZFQYQVBPOYFBW-UHFFFAOYSA-N 1 1 247.288 3.563 20 0 BHADMO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(Cl)o2)o1 ZINC000037487300 387564857 /nfs/dbraw/zinc/56/48/57/387564857.db2.gz PUGHMBAEQKIGMQ-SECBINFHSA-N 1 1 239.702 3.685 20 0 BHADMO Cc1ccc([C@H](C)[NH2+]Cc2ccc(Cl)o2)o1 ZINC000037487301 387566035 /nfs/dbraw/zinc/56/60/35/387566035.db2.gz PUGHMBAEQKIGMQ-VIFPVBQESA-N 1 1 239.702 3.685 20 0 BHADMO CN(C)c1ccc([NH2+]CCC(C)(C)C)cc1 ZINC000037488442 712651154 /nfs/dbraw/zinc/65/11/54/712651154.db2.gz QEFNSWJNWSVXPI-UHFFFAOYSA-N 1 1 220.360 3.601 20 0 BHADMO c1ccc2[nH+]c(NCC3CCCCC3)[nH]c2c1 ZINC000037493950 388644800 /nfs/dbraw/zinc/64/48/00/388644800.db2.gz ABNNIACEGFYOIA-UHFFFAOYSA-N 1 1 229.327 3.555 20 0 BHADMO Cc1ccc(C[NH2+][C@@H](C)c2ccccc2F)o1 ZINC000037494498 364080450 /nfs/dbraw/zinc/08/04/50/364080450.db2.gz RWKWMWDBKRDEOK-NSHDSACASA-N 1 1 233.286 3.578 20 0 BHADMO Cc1ccc(C[NH2+][C@H](C)c2ccccc2F)o1 ZINC000037494499 364080352 /nfs/dbraw/zinc/08/03/52/364080352.db2.gz RWKWMWDBKRDEOK-LLVKDONJSA-N 1 1 233.286 3.578 20 0 BHADMO C[C@H](Nc1[nH]c2ccccc2[nH+]1)c1ccccc1 ZINC000037498285 343347650 /nfs/dbraw/zinc/34/76/50/343347650.db2.gz WCWKLHIAOAHWQU-NSHDSACASA-N 1 1 237.306 3.736 20 0 BHADMO C[C@@H](Nc1[nH]c2ccccc2[nH+]1)c1ccccc1 ZINC000037498286 175936778 /nfs/dbraw/zinc/93/67/78/175936778.db2.gz WCWKLHIAOAHWQU-LLVKDONJSA-N 1 1 237.306 3.736 20 0 BHADMO Cc1cc(NC2CCCCCCC2)nc(C)[nH+]1 ZINC000037498420 712655834 /nfs/dbraw/zinc/65/58/34/712655834.db2.gz FUTYMZIZTURZDD-UHFFFAOYSA-N 1 1 233.359 3.618 20 0 BHADMO Cc1cccc(N[C@@H](C)c2ccccc2)[nH+]1 ZINC000037670501 179152921 /nfs/dbraw/zinc/15/29/21/179152921.db2.gz OARADQLVKVPBEH-LBPRGKRZSA-N 1 1 212.296 3.563 20 0 BHADMO Cc1cccc(N[C@H](C)c2ccccc2)[nH+]1 ZINC000037670503 179155893 /nfs/dbraw/zinc/15/58/93/179155893.db2.gz OARADQLVKVPBEH-GFCCVEGCSA-N 1 1 212.296 3.563 20 0 BHADMO Cc1cccc(NCc2ccccc2Cl)[nH+]1 ZINC000037670537 179149998 /nfs/dbraw/zinc/14/99/98/179149998.db2.gz RDOXDUZRSZKAEM-UHFFFAOYSA-N 1 1 232.714 3.656 20 0 BHADMO Cc1nc([C@H](C)[NH2+]Cc2ccccc2C)cs1 ZINC000037719028 180048899 /nfs/dbraw/zinc/04/88/99/180048899.db2.gz JOWLPRRWKLJMTO-NSHDSACASA-N 1 1 246.379 3.611 20 0 BHADMO Cc1nc([C@@H](C)[NH2+]Cc2ccccc2C)cs1 ZINC000037719029 180037370 /nfs/dbraw/zinc/03/73/70/180037370.db2.gz JOWLPRRWKLJMTO-LLVKDONJSA-N 1 1 246.379 3.611 20 0 BHADMO Cc1ccc(NCCC2CCCCC2)[nH+]c1 ZINC000037742011 711481335 /nfs/dbraw/zinc/48/13/35/711481335.db2.gz LEGBFSUSZCFVMH-UHFFFAOYSA-N 1 1 218.344 3.772 20 0 BHADMO CCC[N@@H+](C)Cc1cc2ccccc2nc1Cl ZINC000037758320 169081736 /nfs/dbraw/zinc/08/17/36/169081736.db2.gz WSSCTLVPHPFDQB-UHFFFAOYSA-N 1 1 248.757 3.730 20 0 BHADMO Cc1nc(C[NH2+][C@H](C)c2ccc(C)cc2)cs1 ZINC000037770749 384013563 /nfs/dbraw/zinc/01/35/63/384013563.db2.gz QDFKPXRUJMJUOS-LLVKDONJSA-N 1 1 246.379 3.611 20 0 BHADMO Cc1nc(C[NH2+][C@@H](C)c2ccc(C)cc2)cs1 ZINC000037770750 178894307 /nfs/dbraw/zinc/89/43/07/178894307.db2.gz QDFKPXRUJMJUOS-NSHDSACASA-N 1 1 246.379 3.611 20 0 BHADMO CC[C@@H]1CCC[N@H+]1CCCC(=O)c1ccccc1 ZINC000037914579 358480017 /nfs/dbraw/zinc/48/00/17/358480017.db2.gz FBNOTAJZKIGRIM-OAHLLOKOSA-N 1 1 245.366 3.524 20 0 BHADMO CC[C@H]1CCC[N@H+]1CCCC(=O)c1ccccc1 ZINC000037914580 358479944 /nfs/dbraw/zinc/47/99/44/358479944.db2.gz FBNOTAJZKIGRIM-HNNXBMFYSA-N 1 1 245.366 3.524 20 0 BHADMO Cc1ccc(NCC(C)(C)c2ccccc2)[nH+]c1 ZINC000037935123 712789387 /nfs/dbraw/zinc/78/93/87/712789387.db2.gz RCLIAHDARMSOMS-UHFFFAOYSA-N 1 1 240.350 3.780 20 0 BHADMO Cc1csc(C[NH2+][C@H](C)c2ccc(C)cc2)n1 ZINC000038090731 178844648 /nfs/dbraw/zinc/84/46/48/178844648.db2.gz BXDUKYGBVZHFKH-GFCCVEGCSA-N 1 1 246.379 3.611 20 0 BHADMO Cc1csc(C[NH2+][C@@H](C)c2ccc(C)cc2)n1 ZINC000038090732 384069582 /nfs/dbraw/zinc/06/95/82/384069582.db2.gz BXDUKYGBVZHFKH-LBPRGKRZSA-N 1 1 246.379 3.611 20 0 BHADMO Cc1csc(C[NH2+][C@H](C)c2cccc(C)c2)n1 ZINC000038091062 179183441 /nfs/dbraw/zinc/18/34/41/179183441.db2.gz BELQPAUZABCZDU-GFCCVEGCSA-N 1 1 246.379 3.611 20 0 BHADMO Cc1csc(C[NH2+][C@@H](C)c2cccc(C)c2)n1 ZINC000038091063 179196012 /nfs/dbraw/zinc/19/60/12/179196012.db2.gz BELQPAUZABCZDU-LBPRGKRZSA-N 1 1 246.379 3.611 20 0 BHADMO CCCCCC[N@H+]1CCc2ccccc2C1 ZINC000038587210 368327792 /nfs/dbraw/zinc/32/77/92/368327792.db2.gz JVSSNMDTBPAWBH-UHFFFAOYSA-N 1 1 217.356 3.625 20 0 BHADMO c1ccc(C[N@H+]2CCCc3ccccc3C2)cc1 ZINC000038886137 356493194 /nfs/dbraw/zinc/49/31/94/356493194.db2.gz NTKSCRDSGUPFJG-UHFFFAOYSA-N 1 1 237.346 3.635 20 0 BHADMO Cc1ccc(C)c(C[N@@H+](C)Cc2ccccc2)c1 ZINC000039077099 344752858 /nfs/dbraw/zinc/75/28/58/344752858.db2.gz BJVHYUMKSVIVEE-UHFFFAOYSA-N 1 1 239.362 3.935 20 0 BHADMO Cc1ccc(C[N@H+](C)Cc2ccccc2C)cc1 ZINC000039151111 352586697 /nfs/dbraw/zinc/58/66/97/352586697.db2.gz KHYHYFYCROGPIT-UHFFFAOYSA-N 1 1 239.362 3.935 20 0 BHADMO COc1ccc(CC[N@@H+]2[C@H](C)CCC[C@@H]2C)cc1 ZINC000039297357 368274422 /nfs/dbraw/zinc/27/44/22/368274422.db2.gz KLSDTMDSTRMUEU-OKILXGFUSA-N 1 1 247.382 3.501 20 0 BHADMO C[N@H+](Cc1ccccc1)CC1CCCCC1 ZINC000039320057 384536870 /nfs/dbraw/zinc/53/68/70/384536870.db2.gz ZYYTWJLRKWLJDV-UHFFFAOYSA-N 1 1 217.356 3.699 20 0 BHADMO C[C@@H](c1ccccc1)[N@H+]1CCc2sccc2C1 ZINC000039614462 343713407 /nfs/dbraw/zinc/71/34/07/343713407.db2.gz RHGBYUYSXHYOEQ-LBPRGKRZSA-N 1 1 243.375 3.867 20 0 BHADMO C[C@H](c1ccccc1)[N@H+]1CCc2sccc2C1 ZINC000039614463 343713461 /nfs/dbraw/zinc/71/34/61/343713461.db2.gz RHGBYUYSXHYOEQ-GFCCVEGCSA-N 1 1 243.375 3.867 20 0 BHADMO CCCC[N@@H+](Cc1ccccc1)C(C)C ZINC000039644483 384305005 /nfs/dbraw/zinc/30/50/05/384305005.db2.gz YNWRXNAXACIAAQ-UHFFFAOYSA-N 1 1 205.345 3.697 20 0 BHADMO CCc1ccc([C@@H](C)[NH2+]Cc2cscn2)cc1 ZINC000040420823 384152408 /nfs/dbraw/zinc/15/24/08/384152408.db2.gz LPOYEPTYJSZAEM-LLVKDONJSA-N 1 1 246.379 3.556 20 0 BHADMO CCc1ccc([C@H](C)[NH2+]Cc2cscn2)cc1 ZINC000040420824 384151422 /nfs/dbraw/zinc/15/14/22/384151422.db2.gz LPOYEPTYJSZAEM-NSHDSACASA-N 1 1 246.379 3.556 20 0 BHADMO Cc1ccc(C)c([C@@H](C)[NH2+]Cc2cscn2)c1 ZINC000040420845 387577865 /nfs/dbraw/zinc/57/78/65/387577865.db2.gz BGUPWYXXKSIVJY-GFCCVEGCSA-N 1 1 246.379 3.611 20 0 BHADMO Cc1ccc(C)c([C@H](C)[NH2+]Cc2cscn2)c1 ZINC000040420847 358491202 /nfs/dbraw/zinc/49/12/02/358491202.db2.gz BGUPWYXXKSIVJY-LBPRGKRZSA-N 1 1 246.379 3.611 20 0 BHADMO CCC[C@H]([NH2+]Cc1cscn1)c1ccccc1 ZINC000040421135 343402520 /nfs/dbraw/zinc/40/25/20/343402520.db2.gz SMFAYEOQHDJNGF-AWEZNQCLSA-N 1 1 246.379 3.774 20 0 BHADMO CCC[C@@H]([NH2+]Cc1cscn1)c1ccccc1 ZINC000040421137 384152333 /nfs/dbraw/zinc/15/23/33/384152333.db2.gz SMFAYEOQHDJNGF-CQSZACIVSA-N 1 1 246.379 3.774 20 0 BHADMO CC(C)[C@H]([NH2+]Cc1cscn1)c1ccccc1 ZINC000040421194 343402383 /nfs/dbraw/zinc/40/23/83/343402383.db2.gz OKUTYURZKWPQFF-AWEZNQCLSA-N 1 1 246.379 3.630 20 0 BHADMO CC(C)[C@@H]([NH2+]Cc1cscn1)c1ccccc1 ZINC000040421196 384152262 /nfs/dbraw/zinc/15/22/62/384152262.db2.gz OKUTYURZKWPQFF-CQSZACIVSA-N 1 1 246.379 3.630 20 0 BHADMO CC(C)c1ccc(C[NH2+]Cc2nccs2)cc1 ZINC000040443930 343403457 /nfs/dbraw/zinc/40/34/57/343403457.db2.gz LZTBYQOHVWRSEC-UHFFFAOYSA-N 1 1 246.379 3.556 20 0 BHADMO Cc1ccc([C@@H](C)[NH2+]Cc2cscn2)c(C)c1 ZINC000040505299 178845089 /nfs/dbraw/zinc/84/50/89/178845089.db2.gz YDQBYSRTFHYKKE-GFCCVEGCSA-N 1 1 246.379 3.611 20 0 BHADMO Cc1ccc([C@H](C)[NH2+]Cc2cscn2)c(C)c1 ZINC000040505302 409821203 /nfs/dbraw/zinc/82/12/03/409821203.db2.gz YDQBYSRTFHYKKE-LBPRGKRZSA-N 1 1 246.379 3.611 20 0 BHADMO CC[C@H]([NH2+]Cc1csc(C)n1)c1ccccc1 ZINC000041010310 343412465 /nfs/dbraw/zinc/41/24/65/343412465.db2.gz KGJGKXOQFVJDRN-AWEZNQCLSA-N 1 1 246.379 3.692 20 0 BHADMO CC[C@@H]([NH2+]Cc1csc(C)n1)c1ccccc1 ZINC000041010311 343412460 /nfs/dbraw/zinc/41/24/60/343412460.db2.gz KGJGKXOQFVJDRN-CQSZACIVSA-N 1 1 246.379 3.692 20 0 BHADMO Cc1nc(C[NH2+][C@H](C)c2cccc(C)c2)cs1 ZINC000041010593 179182017 /nfs/dbraw/zinc/18/20/17/179182017.db2.gz CGCUNQFFLWFCRL-LLVKDONJSA-N 1 1 246.379 3.611 20 0 BHADMO Cc1nc(C[NH2+][C@@H](C)c2cccc(C)c2)cs1 ZINC000041010594 179196635 /nfs/dbraw/zinc/19/66/35/179196635.db2.gz CGCUNQFFLWFCRL-NSHDSACASA-N 1 1 246.379 3.611 20 0 BHADMO Cc1ccc([C@@H](C)[NH2+]Cc2nccs2)c(C)c1 ZINC000041011943 384172785 /nfs/dbraw/zinc/17/27/85/384172785.db2.gz ADJVIMAGHWDXHM-GFCCVEGCSA-N 1 1 246.379 3.611 20 0 BHADMO Cc1ccc([C@H](C)[NH2+]Cc2nccs2)c(C)c1 ZINC000041011945 384173249 /nfs/dbraw/zinc/17/32/49/384173249.db2.gz ADJVIMAGHWDXHM-LBPRGKRZSA-N 1 1 246.379 3.611 20 0 BHADMO Cc1ccc(C)c([C@@H](C)[NH2+]Cc2nccs2)c1 ZINC000041011956 387588549 /nfs/dbraw/zinc/58/85/49/387588549.db2.gz FSIYKIQVWVGKCH-GFCCVEGCSA-N 1 1 246.379 3.611 20 0 BHADMO Cc1ccc(C)c([C@H](C)[NH2+]Cc2nccs2)c1 ZINC000041011958 358505480 /nfs/dbraw/zinc/50/54/80/358505480.db2.gz FSIYKIQVWVGKCH-LBPRGKRZSA-N 1 1 246.379 3.611 20 0 BHADMO CC[C@H]([NH2+]Cc1nccs1)c1ccc(C)cc1 ZINC000041011982 343412295 /nfs/dbraw/zinc/41/22/95/343412295.db2.gz TVEISQLTNHDESA-ZDUSSCGKSA-N 1 1 246.379 3.692 20 0 BHADMO CC[C@@H]([NH2+]Cc1nccs1)c1ccc(C)cc1 ZINC000041011984 343412273 /nfs/dbraw/zinc/41/22/73/343412273.db2.gz TVEISQLTNHDESA-CYBMUJFWSA-N 1 1 246.379 3.692 20 0 BHADMO Cc1ccc([C@@H](C)[NH2+]Cc2nccs2)cc1C ZINC000041012096 384172989 /nfs/dbraw/zinc/17/29/89/384172989.db2.gz MPWWPPNLVFTDII-GFCCVEGCSA-N 1 1 246.379 3.611 20 0 BHADMO Cc1ccc([C@H](C)[NH2+]Cc2nccs2)cc1C ZINC000041012098 384174236 /nfs/dbraw/zinc/17/42/36/384174236.db2.gz MPWWPPNLVFTDII-LBPRGKRZSA-N 1 1 246.379 3.611 20 0 BHADMO CCc1ccc([C@@H](C)[NH2+]Cc2nccs2)cc1 ZINC000041012110 384173146 /nfs/dbraw/zinc/17/31/46/384173146.db2.gz WRWBVXDZOTUSIA-LLVKDONJSA-N 1 1 246.379 3.556 20 0 BHADMO CCc1ccc([C@H](C)[NH2+]Cc2nccs2)cc1 ZINC000041012112 384174458 /nfs/dbraw/zinc/17/44/58/384174458.db2.gz WRWBVXDZOTUSIA-NSHDSACASA-N 1 1 246.379 3.556 20 0 BHADMO CCC[C@H]([NH2+]Cc1nccs1)c1ccccc1 ZINC000041012188 343412365 /nfs/dbraw/zinc/41/23/65/343412365.db2.gz GXFZJBWMZQPANE-ZDUSSCGKSA-N 1 1 246.379 3.774 20 0 BHADMO CCC[C@@H]([NH2+]Cc1nccs1)c1ccccc1 ZINC000041012190 384173604 /nfs/dbraw/zinc/17/36/04/384173604.db2.gz GXFZJBWMZQPANE-CYBMUJFWSA-N 1 1 246.379 3.774 20 0 BHADMO CC[N@@H+](Cc1ccccc1)CC(C)(C)C ZINC000041214274 323112530 /nfs/dbraw/zinc/11/25/30/323112530.db2.gz KHAQCQWRHMGYIB-UHFFFAOYSA-N 1 1 205.345 3.555 20 0 BHADMO CC[N@H+](Cc1ccccc1)CC1CCCC1 ZINC000041230501 410913431 /nfs/dbraw/zinc/91/34/31/410913431.db2.gz DHJYDBGOFCFFRB-UHFFFAOYSA-N 1 1 217.356 3.699 20 0 BHADMO Cc1[nH+]ccn1Cc1ccc(C(C)(C)C)cc1 ZINC000041250114 180270397 /nfs/dbraw/zinc/27/03/97/180270397.db2.gz JAINAZZVGGZAAL-UHFFFAOYSA-N 1 1 228.339 3.537 20 0 BHADMO c1ccc2c(c1)CC[N@H+](CC1CCCCC1)C2 ZINC000041251840 384635605 /nfs/dbraw/zinc/63/56/05/384635605.db2.gz UGVNTBVUSAJEOL-UHFFFAOYSA-N 1 1 229.367 3.625 20 0 BHADMO Cc1[nH+]ccn1Cc1ccc(Cl)c(Cl)c1 ZINC000041284557 180270313 /nfs/dbraw/zinc/27/03/13/180270313.db2.gz DNRXJZAVRZRRBN-UHFFFAOYSA-N 1 1 241.121 3.547 20 0 BHADMO C[N@@H+](Cc1cccs1)Cc1ccc(F)cc1 ZINC000041392504 384189385 /nfs/dbraw/zinc/18/93/85/384189385.db2.gz HSOMMEYJMFGORT-UHFFFAOYSA-N 1 1 235.327 3.519 20 0 BHADMO Cc1cccc(C[N@@H+](C)Cc2cccs2)c1 ZINC000041392508 357128936 /nfs/dbraw/zinc/12/89/36/357128936.db2.gz VPBBWCIMYGQWKQ-UHFFFAOYSA-N 1 1 231.364 3.689 20 0 BHADMO Cc1ccc(C[N@@H+](C)Cc2cccs2)cc1 ZINC000041392510 323208121 /nfs/dbraw/zinc/20/81/21/323208121.db2.gz IVECKKYSVLHUEA-UHFFFAOYSA-N 1 1 231.364 3.689 20 0 BHADMO Cc1ccccc1C[N@@H+](C)Cc1cccs1 ZINC000041392519 357128684 /nfs/dbraw/zinc/12/86/84/357128684.db2.gz YURPXIQKGVPZOO-UHFFFAOYSA-N 1 1 231.364 3.689 20 0 BHADMO C[N@@H+](Cc1cccs1)Cc1cccc(F)c1 ZINC000041392527 374137822 /nfs/dbraw/zinc/13/78/22/374137822.db2.gz XLPUINFFLFIHNN-UHFFFAOYSA-N 1 1 235.327 3.519 20 0 BHADMO CC(C)CNc1cc[nH+]c2ccc(Cl)cc12 ZINC000041474741 388458307 /nfs/dbraw/zinc/45/83/07/388458307.db2.gz HDQBWVMBAZNYIG-UHFFFAOYSA-N 1 1 234.730 3.956 20 0 BHADMO Clc1ccc2[nH+]ccc(N3CCCCC3)c2c1 ZINC000041479062 358313027 /nfs/dbraw/zinc/31/30/27/358313027.db2.gz DXQISZQOQBNRBH-UHFFFAOYSA-N 1 1 246.741 3.879 20 0 BHADMO CCCC[N@@H+](C)Cc1ccc(F)c2cccnc12 ZINC000042121807 343093424 /nfs/dbraw/zinc/09/34/24/343093424.db2.gz JSPBTHHOBUBFKY-UHFFFAOYSA-N 1 1 246.329 3.606 20 0 BHADMO C[C@@H](C1CC1)[N@@H+](Cc1ccc(F)cc1)C1CC1 ZINC000042123211 358518574 /nfs/dbraw/zinc/51/85/74/358518574.db2.gz DNVORRAPIJZGTK-NSHDSACASA-N 1 1 233.330 3.589 20 0 BHADMO C[C@H](C1CC1)[N@@H+](Cc1ccc(F)cc1)C1CC1 ZINC000042123212 358518509 /nfs/dbraw/zinc/51/85/09/358518509.db2.gz DNVORRAPIJZGTK-LLVKDONJSA-N 1 1 233.330 3.589 20 0 BHADMO C[C@@H](C1CC1)[N@@H+](Cc1ccccc1F)C1CC1 ZINC000042123233 358518104 /nfs/dbraw/zinc/51/81/04/358518104.db2.gz OAGZBSOSILYPJJ-NSHDSACASA-N 1 1 233.330 3.589 20 0 BHADMO C[C@H](C1CC1)[N@@H+](Cc1ccccc1F)C1CC1 ZINC000042123234 358518148 /nfs/dbraw/zinc/51/81/48/358518148.db2.gz OAGZBSOSILYPJJ-LLVKDONJSA-N 1 1 233.330 3.589 20 0 BHADMO C[C@@H](C1CC1)[N@@H+](Cc1cccc(F)c1)C1CC1 ZINC000042123324 358518073 /nfs/dbraw/zinc/51/80/73/358518073.db2.gz FGDZMJGCCFBJIO-NSHDSACASA-N 1 1 233.330 3.589 20 0 BHADMO C[C@H](C1CC1)[N@@H+](Cc1cccc(F)c1)C1CC1 ZINC000042123325 176594073 /nfs/dbraw/zinc/59/40/73/176594073.db2.gz FGDZMJGCCFBJIO-LLVKDONJSA-N 1 1 233.330 3.589 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)Cc1cccc2cccnc21 ZINC000042147557 343117692 /nfs/dbraw/zinc/11/76/92/343117692.db2.gz DTAJIUBCWPHFPE-CYBMUJFWSA-N 1 1 242.366 3.855 20 0 BHADMO CCC[C@H](C)[N@@H+](C)Cc1cccc2cccnc21 ZINC000042147558 343118044 /nfs/dbraw/zinc/11/80/44/343118044.db2.gz DTAJIUBCWPHFPE-ZDUSSCGKSA-N 1 1 242.366 3.855 20 0 BHADMO CC[N@@H+](Cc1ccco1)Cc1ccccc1Cl ZINC000042148221 368300311 /nfs/dbraw/zinc/30/03/11/368300311.db2.gz LKBRFFSKWZGQQC-UHFFFAOYSA-N 1 1 249.741 3.955 20 0 BHADMO CC[N@H+](Cc1ccco1)Cc1ccccc1Cl ZINC000042148221 368300307 /nfs/dbraw/zinc/30/03/07/368300307.db2.gz LKBRFFSKWZGQQC-UHFFFAOYSA-N 1 1 249.741 3.955 20 0 BHADMO CC[N@@H+](Cc1ccco1)Cc1cccc(Cl)c1 ZINC000042148223 368299779 /nfs/dbraw/zinc/29/97/79/368299779.db2.gz NANNBVVEMLWVPF-UHFFFAOYSA-N 1 1 249.741 3.955 20 0 BHADMO CC[N@@H+](Cc1ccco1)Cc1ccc(Cl)cc1 ZINC000042148236 368299657 /nfs/dbraw/zinc/29/96/57/368299657.db2.gz FTKURSALPZHGEY-UHFFFAOYSA-N 1 1 249.741 3.955 20 0 BHADMO CC[N@@H+](Cc1ccco1)Cc1ccc(C)cc1 ZINC000042148275 368299835 /nfs/dbraw/zinc/29/98/35/368299835.db2.gz FFUWQWGGLHVNGI-UHFFFAOYSA-N 1 1 229.323 3.610 20 0 BHADMO CC[N@@H+](Cc1ccco1)Cc1ccccc1C ZINC000042148356 323244077 /nfs/dbraw/zinc/24/40/77/323244077.db2.gz DUDRCEDBROFMFS-UHFFFAOYSA-N 1 1 229.323 3.610 20 0 BHADMO CC[N@@H+](Cc1ccco1)Cc1cccc(C)c1 ZINC000042148417 368300106 /nfs/dbraw/zinc/30/01/06/368300106.db2.gz ISLCPEOYNUICPT-UHFFFAOYSA-N 1 1 229.323 3.610 20 0 BHADMO Cc1cc[nH+]c(NC2CCCCCC2)c1 ZINC000042244061 344446630 /nfs/dbraw/zinc/44/66/30/344446630.db2.gz CEQLSIZWQDQUIF-UHFFFAOYSA-N 1 1 204.317 3.525 20 0 BHADMO Cc1ccc([C@@H](C)Nc2cc(C)[nH+]c(C)n2)cc1 ZINC000042338478 386689587 /nfs/dbraw/zinc/68/95/87/386689587.db2.gz ZOOQDZDORTXOPP-GFCCVEGCSA-N 1 1 241.338 3.575 20 0 BHADMO Cc1ccc([C@H](C)Nc2cc(C)[nH+]c(C)n2)cc1 ZINC000042338481 352626797 /nfs/dbraw/zinc/62/67/97/352626797.db2.gz ZOOQDZDORTXOPP-LBPRGKRZSA-N 1 1 241.338 3.575 20 0 BHADMO CSc1ccc(C[N@@H+](C)Cc2ccco2)cc1 ZINC000042366327 188119272 /nfs/dbraw/zinc/11/92/72/188119272.db2.gz APBVFBMXPLVIBN-UHFFFAOYSA-N 1 1 247.363 3.634 20 0 BHADMO C[N@@H+](Cc1ccco1)Cc1cccc(Cl)c1 ZINC000042366685 387628238 /nfs/dbraw/zinc/62/82/38/387628238.db2.gz KOWWPEQTLNOKHM-UHFFFAOYSA-N 1 1 235.714 3.565 20 0 BHADMO Cc1ccc(C)c(C[N@@H+](C)Cc2ccco2)c1 ZINC000042366715 323247071 /nfs/dbraw/zinc/24/70/71/323247071.db2.gz SMBCUIDFAZODAA-UHFFFAOYSA-N 1 1 229.323 3.528 20 0 BHADMO Cc1ccc([C@@H](C)Nc2cc(C)[nH+]c(C)n2)s1 ZINC000042375263 637210312 /nfs/dbraw/zinc/21/03/12/637210312.db2.gz AXWUXVXIYWZKQS-SNVBAGLBSA-N 1 1 247.367 3.636 20 0 BHADMO Cc1ccc([C@H](C)Nc2cc(C)[nH+]c(C)n2)s1 ZINC000042375264 637210450 /nfs/dbraw/zinc/21/04/50/637210450.db2.gz AXWUXVXIYWZKQS-JTQLQIEISA-N 1 1 247.367 3.636 20 0 BHADMO Cc1ccc(NCCc2ccc(Cl)cc2)[nH+]c1 ZINC000042396525 384637509 /nfs/dbraw/zinc/63/75/09/384637509.db2.gz HZMLNQPBZICFNA-UHFFFAOYSA-N 1 1 246.741 3.698 20 0 BHADMO CCC1CCC([N@@H+](C)Cc2cccc(N)c2)CC1 ZINC000042515132 352623246 /nfs/dbraw/zinc/62/32/46/352623246.db2.gz IIQINMOORRZSCI-UHFFFAOYSA-N 1 1 246.398 3.669 20 0 BHADMO CC(C)C[C@@H](C)[N@@H+](C)Cc1ccc(Cl)nc1 ZINC000042582213 637291022 /nfs/dbraw/zinc/29/10/22/637291022.db2.gz JRXQKAFFIDPMOD-LLVKDONJSA-N 1 1 240.778 3.601 20 0 BHADMO CC(C)C[C@H](C)[N@@H+](C)Cc1ccc(Cl)nc1 ZINC000042582216 637291391 /nfs/dbraw/zinc/29/13/91/637291391.db2.gz JRXQKAFFIDPMOD-NSHDSACASA-N 1 1 240.778 3.601 20 0 BHADMO CC(C)C[N@@H+](Cc1ccc(Cl)nc1)C(C)C ZINC000042582370 637291103 /nfs/dbraw/zinc/29/11/03/637291103.db2.gz PLDBZBMDPKKZIQ-UHFFFAOYSA-N 1 1 240.778 3.601 20 0 BHADMO CC(C)=CC[N@H+](C)[C@@H]1CCc2ccccc21 ZINC000042643861 362013913 /nfs/dbraw/zinc/01/39/13/362013913.db2.gz WMHVJVFMUJNWMU-OAHLLOKOSA-N 1 1 215.340 3.572 20 0 BHADMO CC(C)=CC[N@H+](C)[C@H]1CCc2ccccc21 ZINC000042643862 362013967 /nfs/dbraw/zinc/01/39/67/362013967.db2.gz WMHVJVFMUJNWMU-HNNXBMFYSA-N 1 1 215.340 3.572 20 0 BHADMO C[C@H]([N@@H+](C)Cc1ccc(Cl)nc1)C(C)(C)C ZINC000042763681 641558063 /nfs/dbraw/zinc/55/80/63/641558063.db2.gz UQMDDWFQRIYTAZ-JTQLQIEISA-N 1 1 240.778 3.601 20 0 BHADMO C[C@@H]([N@@H+](C)Cc1ccc(Cl)nc1)C(C)(C)C ZINC000042763685 641557405 /nfs/dbraw/zinc/55/74/05/641557405.db2.gz UQMDDWFQRIYTAZ-SNVBAGLBSA-N 1 1 240.778 3.601 20 0 BHADMO C[N@@H+](Cc1cccs1)Cc1ccccc1F ZINC000042977371 358532997 /nfs/dbraw/zinc/53/29/97/358532997.db2.gz SOXDSVUGIYKBEA-UHFFFAOYSA-N 1 1 235.327 3.519 20 0 BHADMO C[N@H+](Cc1cccs1)Cc1ccccc1F ZINC000042977371 358532993 /nfs/dbraw/zinc/53/29/93/358532993.db2.gz SOXDSVUGIYKBEA-UHFFFAOYSA-N 1 1 235.327 3.519 20 0 BHADMO Cc1ccc(C[N@H+](C)Cc2ccc(Cl)cc2)o1 ZINC000042978232 348988737 /nfs/dbraw/zinc/98/87/37/348988737.db2.gz CMLMRGRGMDSWPF-UHFFFAOYSA-N 1 1 249.741 3.873 20 0 BHADMO Cc1ccc(C[N@H+](C)Cc2cccc(Cl)c2)o1 ZINC000042978236 348988922 /nfs/dbraw/zinc/98/89/22/348988922.db2.gz VNDRYQRXSQAHKQ-UHFFFAOYSA-N 1 1 249.741 3.873 20 0 BHADMO Cc1ccc(C[N@H+](C)Cc2ccc(C)cc2)o1 ZINC000042978258 348988546 /nfs/dbraw/zinc/98/85/46/348988546.db2.gz HRNMIJQFFNXYEJ-UHFFFAOYSA-N 1 1 229.323 3.528 20 0 BHADMO Cc1cc[nH+]c(N[C@@H](C)c2cccs2)c1 ZINC000043561472 385167789 /nfs/dbraw/zinc/16/77/89/385167789.db2.gz NSMXRLVPRHBLII-JTQLQIEISA-N 1 1 218.325 3.625 20 0 BHADMO Cc1cc[nH+]c(N[C@H](C)c2cccs2)c1 ZINC000043561473 385167416 /nfs/dbraw/zinc/16/74/16/385167416.db2.gz NSMXRLVPRHBLII-SNVBAGLBSA-N 1 1 218.325 3.625 20 0 BHADMO Cc1nc(C)c([C@H](C)Nc2cc(C)cc[nH+]2)s1 ZINC000043561580 179454262 /nfs/dbraw/zinc/45/42/62/179454262.db2.gz PJYROUZCXHHUNU-JTQLQIEISA-N 1 1 247.367 3.636 20 0 BHADMO Cc1nc(C)c([C@@H](C)Nc2cc(C)cc[nH+]2)s1 ZINC000043561581 384285775 /nfs/dbraw/zinc/28/57/75/384285775.db2.gz PJYROUZCXHHUNU-SNVBAGLBSA-N 1 1 247.367 3.636 20 0 BHADMO Cc1ccc([C@H](C)Nc2cc(C)cc[nH+]2)s1 ZINC000043561639 387659357 /nfs/dbraw/zinc/65/93/57/387659357.db2.gz OUACAYIQVUXILC-NSHDSACASA-N 1 1 232.352 3.933 20 0 BHADMO Cc1ccc([C@@H](C)Nc2cc(C)cc[nH+]2)s1 ZINC000043561640 387658078 /nfs/dbraw/zinc/65/80/78/387658078.db2.gz OUACAYIQVUXILC-LLVKDONJSA-N 1 1 232.352 3.933 20 0 BHADMO Cc1cc[nH+]c(N[C@@H](C)c2ccc(F)cc2)c1 ZINC000043561656 387658411 /nfs/dbraw/zinc/65/84/11/387658411.db2.gz MLXXWAXADYQZLF-NSHDSACASA-N 1 1 230.286 3.702 20 0 BHADMO Cc1cc[nH+]c(N[C@H](C)c2ccc(F)cc2)c1 ZINC000043561657 387658931 /nfs/dbraw/zinc/65/89/31/387658931.db2.gz MLXXWAXADYQZLF-LLVKDONJSA-N 1 1 230.286 3.702 20 0 BHADMO Cc1cc[nH+]c(N[C@@H](C)c2ccccc2C)c1 ZINC000043561666 386710546 /nfs/dbraw/zinc/71/05/46/386710546.db2.gz JCJUTPSCSBOFGA-ZDUSSCGKSA-N 1 1 226.323 3.872 20 0 BHADMO Cc1cc[nH+]c(N[C@H](C)c2ccccc2C)c1 ZINC000043561667 386710361 /nfs/dbraw/zinc/71/03/61/386710361.db2.gz JCJUTPSCSBOFGA-CYBMUJFWSA-N 1 1 226.323 3.872 20 0 BHADMO Cc1cc[nH+]c(N[C@@H](C)c2ccccc2F)c1 ZINC000043561668 387658999 /nfs/dbraw/zinc/65/89/99/387658999.db2.gz TUZVTUAKQNVAIA-NSHDSACASA-N 1 1 230.286 3.702 20 0 BHADMO Cc1cc[nH+]c(N[C@H](C)c2ccccc2F)c1 ZINC000043561669 387658135 /nfs/dbraw/zinc/65/81/35/387658135.db2.gz TUZVTUAKQNVAIA-LLVKDONJSA-N 1 1 230.286 3.702 20 0 BHADMO Cc1cc[nH+]c(N[C@@H](C)c2cccc(F)c2)c1 ZINC000043561670 387658643 /nfs/dbraw/zinc/65/86/43/387658643.db2.gz HNAOGOFSMCDJQR-NSHDSACASA-N 1 1 230.286 3.702 20 0 BHADMO Cc1cc[nH+]c(N[C@H](C)c2cccc(F)c2)c1 ZINC000043561671 387659059 /nfs/dbraw/zinc/65/90/59/387659059.db2.gz HNAOGOFSMCDJQR-LLVKDONJSA-N 1 1 230.286 3.702 20 0 BHADMO Cc1ccc([C@@H](C)Nc2cc(C)cc[nH+]2)cc1 ZINC000043561682 386709258 /nfs/dbraw/zinc/70/92/58/386709258.db2.gz KCTNLSXULUYWJR-CYBMUJFWSA-N 1 1 226.323 3.872 20 0 BHADMO Cc1ccc([C@H](C)Nc2cc(C)cc[nH+]2)cc1 ZINC000043561683 386709757 /nfs/dbraw/zinc/70/97/57/386709757.db2.gz KCTNLSXULUYWJR-ZDUSSCGKSA-N 1 1 226.323 3.872 20 0 BHADMO C[N@@H+](Cc1ccccc1)Cc1ccc(F)cc1F ZINC000043626386 368405063 /nfs/dbraw/zinc/40/50/63/368405063.db2.gz ZWZYEVFMWAVUAD-UHFFFAOYSA-N 1 1 247.288 3.597 20 0 BHADMO C[N@H+](Cc1ccccc1)Cc1ccc(F)cc1F ZINC000043626386 368405058 /nfs/dbraw/zinc/40/50/58/368405058.db2.gz ZWZYEVFMWAVUAD-UHFFFAOYSA-N 1 1 247.288 3.597 20 0 BHADMO CC(C)=CC[N@@H+](Cc1ccccc1)C1CC1 ZINC000043643342 368405201 /nfs/dbraw/zinc/40/52/01/368405201.db2.gz HDRCWEMBVOMEIZ-UHFFFAOYSA-N 1 1 215.340 3.617 20 0 BHADMO CC[C@H]([NH2+]Cc1cc(C)on1)c1ccc(C)cc1 ZINC000044296386 322841143 /nfs/dbraw/zinc/84/11/43/322841143.db2.gz NPLSGOHHTVGESL-HNNXBMFYSA-N 1 1 244.338 3.532 20 0 BHADMO CC[C@@H]([NH2+]Cc1cc(C)on1)c1ccc(C)cc1 ZINC000044296391 384655394 /nfs/dbraw/zinc/65/53/94/384655394.db2.gz NPLSGOHHTVGESL-OAHLLOKOSA-N 1 1 244.338 3.532 20 0 BHADMO CCC[C@H]([NH2+]Cc1cc(C)on1)c1ccccc1 ZINC000044296634 343497682 /nfs/dbraw/zinc/49/76/82/343497682.db2.gz LECRLQWQCNWOPL-HNNXBMFYSA-N 1 1 244.338 3.614 20 0 BHADMO CCC[C@@H]([NH2+]Cc1cc(C)on1)c1ccccc1 ZINC000044296639 169402028 /nfs/dbraw/zinc/40/20/28/169402028.db2.gz LECRLQWQCNWOPL-OAHLLOKOSA-N 1 1 244.338 3.614 20 0 BHADMO CC(C)c1ccc(C[NH2+]Cc2cscn2)cc1 ZINC000044389795 322841834 /nfs/dbraw/zinc/84/18/34/322841834.db2.gz ZBQDGZHXLJADML-UHFFFAOYSA-N 1 1 246.379 3.556 20 0 BHADMO Cc1cccc(N[C@@H](C)CCc2ccccc2)[nH+]1 ZINC000044482787 179153774 /nfs/dbraw/zinc/15/37/74/179153774.db2.gz YZMSLVWKFJNKQU-AWEZNQCLSA-N 1 1 240.350 3.823 20 0 BHADMO Cc1cccc(N[C@H](C)CCc2ccccc2)[nH+]1 ZINC000044482788 179156669 /nfs/dbraw/zinc/15/66/69/179156669.db2.gz YZMSLVWKFJNKQU-CQSZACIVSA-N 1 1 240.350 3.823 20 0 BHADMO Cc1cc[nH+]c(N[C@@H](C)CCc2ccccc2)c1 ZINC000044482811 386724540 /nfs/dbraw/zinc/72/45/40/386724540.db2.gz RTSOMXVWHKUCRP-AWEZNQCLSA-N 1 1 240.350 3.823 20 0 BHADMO Cc1cc[nH+]c(N[C@H](C)CCc2ccccc2)c1 ZINC000044482812 386724372 /nfs/dbraw/zinc/72/43/72/386724372.db2.gz RTSOMXVWHKUCRP-CQSZACIVSA-N 1 1 240.350 3.823 20 0 BHADMO Cc1ccc(N[C@@H](C)CCc2ccccc2)[nH+]c1 ZINC000044482833 322841270 /nfs/dbraw/zinc/84/12/70/322841270.db2.gz MCEWHAZLZHXESY-AWEZNQCLSA-N 1 1 240.350 3.823 20 0 BHADMO Cc1ccc(N[C@H](C)CCc2ccccc2)[nH+]c1 ZINC000044482834 384654351 /nfs/dbraw/zinc/65/43/51/384654351.db2.gz MCEWHAZLZHXESY-CQSZACIVSA-N 1 1 240.350 3.823 20 0 BHADMO c1coc(C[N@H+](CC2CCCCC2)C2CC2)c1 ZINC000044648819 342692319 /nfs/dbraw/zinc/69/23/19/342692319.db2.gz HDKZGBKAUHOBFO-UHFFFAOYSA-N 1 1 233.355 3.824 20 0 BHADMO Cc1ccccc1C[N@@H+](Cc1ccco1)C1CC1 ZINC000044648827 343511134 /nfs/dbraw/zinc/51/11/34/343511134.db2.gz LJSPVWLRJWCUCZ-UHFFFAOYSA-N 1 1 241.334 3.753 20 0 BHADMO Cc1ccc(C[NH2+][C@@H](C)c2cc(C)oc2C)o1 ZINC000044729306 358553121 /nfs/dbraw/zinc/55/31/21/358553121.db2.gz OCIJRMXFVLJSQZ-NSHDSACASA-N 1 1 233.311 3.649 20 0 BHADMO Cc1ccc(C[NH2+][C@H](C)c2cc(C)oc2C)o1 ZINC000044729307 358553211 /nfs/dbraw/zinc/55/32/11/358553211.db2.gz OCIJRMXFVLJSQZ-LLVKDONJSA-N 1 1 233.311 3.649 20 0 BHADMO Cc1cc([C@H](C)Nc2cc(C)cc[nH+]2)c(C)o1 ZINC000044730821 386726878 /nfs/dbraw/zinc/72/68/78/386726878.db2.gz GGUFGUACWUMFFD-NSHDSACASA-N 1 1 230.311 3.773 20 0 BHADMO Cc1cc([C@@H](C)Nc2cc(C)cc[nH+]2)c(C)o1 ZINC000044730822 386727245 /nfs/dbraw/zinc/72/72/45/386727245.db2.gz GGUFGUACWUMFFD-LLVKDONJSA-N 1 1 230.311 3.773 20 0 BHADMO Cc1cc([C@H](C)Nc2cccc(C)[nH+]2)c(C)o1 ZINC000044730879 179152866 /nfs/dbraw/zinc/15/28/66/179152866.db2.gz WYMOLKYMSLLNAF-NSHDSACASA-N 1 1 230.311 3.773 20 0 BHADMO Cc1cc([C@@H](C)Nc2cccc(C)[nH+]2)c(C)o1 ZINC000044730880 179156015 /nfs/dbraw/zinc/15/60/15/179156015.db2.gz WYMOLKYMSLLNAF-LLVKDONJSA-N 1 1 230.311 3.773 20 0 BHADMO c1csc(C[N@@H+](Cc2ccccc2)C2CC2)c1 ZINC000044872960 342748381 /nfs/dbraw/zinc/74/83/81/342748381.db2.gz WHVDHYVCRLHZCD-UHFFFAOYSA-N 1 1 243.375 3.913 20 0 BHADMO CC[N@@H+](Cc1ccc(C(F)(F)F)cc1)C1CC1 ZINC000044893763 368423304 /nfs/dbraw/zinc/42/33/04/368423304.db2.gz PDQFOANUBHQUJB-UHFFFAOYSA-N 1 1 243.272 3.690 20 0 BHADMO CCCC[N@@H+](CC)Cc1csc(CCC)n1 ZINC000045003965 342770568 /nfs/dbraw/zinc/77/05/68/342770568.db2.gz XYLVNRXZPHEMHD-UHFFFAOYSA-N 1 1 240.416 3.718 20 0 BHADMO Fc1cccc(C[N@@H+](Cc2ccco2)C2CC2)c1 ZINC000045004703 387957149 /nfs/dbraw/zinc/95/71/49/387957149.db2.gz LAAYXHSTMQQGFA-UHFFFAOYSA-N 1 1 245.297 3.583 20 0 BHADMO Fc1cccc(C[N@H+](Cc2ccco2)C2CC2)c1 ZINC000045004703 387957145 /nfs/dbraw/zinc/95/71/45/387957145.db2.gz LAAYXHSTMQQGFA-UHFFFAOYSA-N 1 1 245.297 3.583 20 0 BHADMO Fc1ccc(C[N@@H+](Cc2ccco2)C2CC2)cc1 ZINC000045004741 342771002 /nfs/dbraw/zinc/77/10/02/342771002.db2.gz ZWNAOLSOYQWANR-UHFFFAOYSA-N 1 1 245.297 3.583 20 0 BHADMO CC(C)=CC[N@@H+](Cc1cccs1)C1CC1 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CCC[N@@H+](C)Cc1ccc(C(F)(F)F)cc1 ZINC000047698985 343015059 /nfs/dbraw/zinc/01/50/59/343015059.db2.gz KNBMELWUUSLMSE-UHFFFAOYSA-N 1 1 231.261 3.547 20 0 BHADMO CCC[N@@H+](C)Cc1ccccc1C(F)(F)F ZINC000047701248 343441406 /nfs/dbraw/zinc/44/14/06/343441406.db2.gz IRBPWHHDPBGETR-UHFFFAOYSA-N 1 1 231.261 3.547 20 0 BHADMO CCC[N@H+]1CCC[C@@H]1c1ccc(Cl)cc1 ZINC000047702194 411163168 /nfs/dbraw/zinc/16/31/68/411163168.db2.gz GNPISEDDTNVWDO-CYBMUJFWSA-N 1 1 223.747 3.887 20 0 BHADMO CCC[N@H+]1CCC[C@H]1c1ccc(Cl)cc1 ZINC000047702196 411163029 /nfs/dbraw/zinc/16/30/29/411163029.db2.gz GNPISEDDTNVWDO-ZDUSSCGKSA-N 1 1 223.747 3.887 20 0 BHADMO CCC[N@@H+](C)[C@@H](C)c1ccc(Cl)cc1 ZINC000047702532 411163072 /nfs/dbraw/zinc/16/30/72/411163072.db2.gz BHOZNTARJLJKGL-JTQLQIEISA-N 1 1 211.736 3.743 20 0 BHADMO CCC[N@@H+](C)[C@H](C)c1ccc(Cl)cc1 ZINC000047702534 411162882 /nfs/dbraw/zinc/16/28/82/411162882.db2.gz BHOZNTARJLJKGL-SNVBAGLBSA-N 1 1 211.736 3.743 20 0 BHADMO CCC[N@@H+](C)Cc1ccc2cc(OC)ccc2c1 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/nfs/dbraw/zinc/68/85/66/643688566.db2.gz BEYDJGUSUGQPML-RUDMXATFSA-N 1 1 213.752 3.536 20 0 BHADMO C=C(Cl)C[N@@H+](C1CC1)C1CCCCC1 ZINC000047904533 641668731 /nfs/dbraw/zinc/66/87/31/641668731.db2.gz AYBUABGUNFHKHD-UHFFFAOYSA-N 1 1 213.752 3.536 20 0 BHADMO CC(C)=CC[N@@H+](C1CC1)C1CCCCC1 ZINC000047904585 411167464 /nfs/dbraw/zinc/16/74/64/411167464.db2.gz JUQNBVMBXCJFNO-UHFFFAOYSA-N 1 1 207.361 3.750 20 0 BHADMO Cc1ccc([C@@H](C)[N@@H+](C)C/C=C/Cl)cc1 ZINC000047959707 643689750 /nfs/dbraw/zinc/68/97/50/643689750.db2.gz JHOCQRRYVYMAAP-OXFRDRNISA-N 1 1 223.747 3.740 20 0 BHADMO Cc1ccc([C@H](C)[N@@H+](C)C/C=C/Cl)cc1 ZINC000047959708 641671357 /nfs/dbraw/zinc/67/13/57/641671357.db2.gz JHOCQRRYVYMAAP-KFRNIWOLSA-N 1 1 223.747 3.740 20 0 BHADMO C=C(Cl)C[N@H+](C)[C@H](C)c1ccc(C)cc1 ZINC000047960157 711489513 /nfs/dbraw/zinc/48/95/13/711489513.db2.gz LEYPDYHPEJRYEO-GFCCVEGCSA-N 1 1 223.747 3.740 20 0 BHADMO C=C(Cl)C[N@@H+](C)[C@H](C)c1ccc(C)cc1 ZINC000047960157 711489511 /nfs/dbraw/zinc/48/95/11/711489511.db2.gz LEYPDYHPEJRYEO-GFCCVEGCSA-N 1 1 223.747 3.740 20 0 BHADMO C=C(Cl)C[N@H+](C)[C@@H](C)c1ccc(C)cc1 ZINC000047960158 711489744 /nfs/dbraw/zinc/48/97/44/711489744.db2.gz LEYPDYHPEJRYEO-LBPRGKRZSA-N 1 1 223.747 3.740 20 0 BHADMO C=C(Cl)C[N@@H+](C)[C@@H](C)c1ccc(C)cc1 ZINC000047960158 711489743 /nfs/dbraw/zinc/48/97/43/711489743.db2.gz LEYPDYHPEJRYEO-LBPRGKRZSA-N 1 1 223.747 3.740 20 0 BHADMO CC[N@@H+](Cc1cccc(F)c1)C1CCCC1 ZINC000047965404 350784527 /nfs/dbraw/zinc/78/45/27/350784527.db2.gz FIBLCZBGVVJFHQ-UHFFFAOYSA-N 1 1 221.319 3.590 20 0 BHADMO CC[N@@H+](Cc1ccc(F)cc1)C1CCCC1 ZINC000047967574 342930325 /nfs/dbraw/zinc/93/03/25/342930325.db2.gz PMXAYADDCHERGD-UHFFFAOYSA-N 1 1 221.319 3.590 20 0 BHADMO Cc1noc(C)c1C[N@@H+](C1CC1)C1CCCCC1 ZINC000048008920 411173851 /nfs/dbraw/zinc/17/38/51/411173851.db2.gz WVCXIZYCWINPOC-UHFFFAOYSA-N 1 1 248.370 3.589 20 0 BHADMO CCCCc1nc(C[N@H+](C)CCCC)cs1 ZINC000048056386 323114536 /nfs/dbraw/zinc/11/45/36/323114536.db2.gz AKAYEIJJIKLEMF-UHFFFAOYSA-N 1 1 240.416 3.718 20 0 BHADMO CCCCc1nc(C[N@@H+](C)CCCC)cs1 ZINC000048056386 323114535 /nfs/dbraw/zinc/11/45/35/323114535.db2.gz AKAYEIJJIKLEMF-UHFFFAOYSA-N 1 1 240.416 3.718 20 0 BHADMO CCCC[N@@H+](C)Cc1csc(C(C)(C)C)n1 ZINC000048056390 323114482 /nfs/dbraw/zinc/11/44/82/323114482.db2.gz AKYWKRSGJADJKJ-UHFFFAOYSA-N 1 1 240.416 3.673 20 0 BHADMO CCCC[N@H+](C)Cc1csc(C(C)(C)C)n1 ZINC000048056390 323114481 /nfs/dbraw/zinc/11/44/81/323114481.db2.gz AKYWKRSGJADJKJ-UHFFFAOYSA-N 1 1 240.416 3.673 20 0 BHADMO CC[N@@H+](C/C=C/Cl)Cc1ccccc1C ZINC000048059159 641674518 /nfs/dbraw/zinc/67/45/18/641674518.db2.gz OOXYJBLHFGOUAR-RMKNXTFCSA-N 1 1 223.747 3.569 20 0 BHADMO CCCc1nc(C[N@H+](C)[C@@H](C)CCC)cs1 ZINC000048070755 343708246 /nfs/dbraw/zinc/70/82/46/343708246.db2.gz LUSQMZKLAFNMSQ-NSHDSACASA-N 1 1 240.416 3.716 20 0 BHADMO CCCc1nc(C[N@H+](C)[C@H](C)CCC)cs1 ZINC000048070756 343708072 /nfs/dbraw/zinc/70/80/72/343708072.db2.gz LUSQMZKLAFNMSQ-LLVKDONJSA-N 1 1 240.416 3.716 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)Cc1cc(-c2ccco2)on1 ZINC000048070899 343708777 /nfs/dbraw/zinc/70/87/77/343708777.db2.gz NGSXXPFXYHDNTF-LLVKDONJSA-N 1 1 248.326 3.555 20 0 BHADMO CCC[C@H](C)[N@@H+](C)Cc1cc(-c2ccco2)on1 ZINC000048070900 343708512 /nfs/dbraw/zinc/70/85/12/343708512.db2.gz NGSXXPFXYHDNTF-NSHDSACASA-N 1 1 248.326 3.555 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)Cc1cccc(F)c1F ZINC000048071253 350792632 /nfs/dbraw/zinc/79/26/32/350792632.db2.gz MQAUCNDENNCKGO-SNVBAGLBSA-N 1 1 227.298 3.585 20 0 BHADMO CCC[C@H](C)[N@@H+](C)Cc1cccc(F)c1F ZINC000048071254 350792575 /nfs/dbraw/zinc/79/25/75/350792575.db2.gz MQAUCNDENNCKGO-JTQLQIEISA-N 1 1 227.298 3.585 20 0 BHADMO CC(C)[N@H+](Cc1ccccn1)CC1CCCCC1 ZINC000048273589 411183454 /nfs/dbraw/zinc/18/34/54/411183454.db2.gz CUQMHUCGWXOXCW-UHFFFAOYSA-N 1 1 246.398 3.872 20 0 BHADMO Cc1cccc(NCc2cccc(Cl)c2)[nH+]1 ZINC000048330174 179149830 /nfs/dbraw/zinc/14/98/30/179149830.db2.gz WVSSBNDNCJPFBX-UHFFFAOYSA-N 1 1 232.714 3.656 20 0 BHADMO Cc1c2ccccc2nc2c1[C@H](C)[N@H+](C)C[C@@H]2C ZINC000048607384 411206709 /nfs/dbraw/zinc/20/67/09/411206709.db2.gz NNDBSZOBJZSLJS-JQWIXIFHSA-N 1 1 240.350 3.653 20 0 BHADMO Cc1c2ccccc2nc2c1[C@H](C)[N@@H+](C)C[C@@H]2C ZINC000048607384 411206707 /nfs/dbraw/zinc/20/67/07/411206707.db2.gz NNDBSZOBJZSLJS-JQWIXIFHSA-N 1 1 240.350 3.653 20 0 BHADMO Cc1c2ccccc2nc2c1[C@@H](C)[N@H+](C)C[C@@H]2C ZINC000048607385 411206613 /nfs/dbraw/zinc/20/66/13/411206613.db2.gz NNDBSZOBJZSLJS-CMPLNLGQSA-N 1 1 240.350 3.653 20 0 BHADMO Cc1c2ccccc2nc2c1[C@@H](C)[N@@H+](C)C[C@@H]2C ZINC000048607385 411206609 /nfs/dbraw/zinc/20/66/09/411206609.db2.gz NNDBSZOBJZSLJS-CMPLNLGQSA-N 1 1 240.350 3.653 20 0 BHADMO CCCC[N@@H+](C)Cc1ncc(-c2ccccc2)o1 ZINC000048614925 384500804 /nfs/dbraw/zinc/50/08/04/384500804.db2.gz LOBPCXFGOIKAAQ-UHFFFAOYSA-N 1 1 244.338 3.574 20 0 BHADMO Cc1ccc([C@H](C)Nc2cccc(C)[nH+]2)s1 ZINC000049184435 179153105 /nfs/dbraw/zinc/15/31/05/179153105.db2.gz YZTGHMYCWHKWHI-NSHDSACASA-N 1 1 232.352 3.933 20 0 BHADMO Cc1ccc([C@@H](C)Nc2cccc(C)[nH+]2)s1 ZINC000049184436 179156256 /nfs/dbraw/zinc/15/62/56/179156256.db2.gz YZTGHMYCWHKWHI-LLVKDONJSA-N 1 1 232.352 3.933 20 0 BHADMO Cc1ccc([C@@H](C)Nc2cccc(C)[nH+]2)cc1 ZINC000049558457 386647439 /nfs/dbraw/zinc/64/74/39/386647439.db2.gz SATZOWKMHUUPQF-CYBMUJFWSA-N 1 1 226.323 3.872 20 0 BHADMO Cc1ccc([C@H](C)Nc2cccc(C)[nH+]2)cc1 ZINC000049558458 353168169 /nfs/dbraw/zinc/16/81/69/353168169.db2.gz SATZOWKMHUUPQF-ZDUSSCGKSA-N 1 1 226.323 3.872 20 0 BHADMO Cc1ccc(NCc2cccc(Cl)c2)[nH+]c1 ZINC000049942913 387790115 /nfs/dbraw/zinc/79/01/15/387790115.db2.gz GJSRNILPJABUMX-UHFFFAOYSA-N 1 1 232.714 3.656 20 0 BHADMO Cc1ccc[nH+]c1NCc1ccc(Cl)cc1 ZINC000049942928 387789255 /nfs/dbraw/zinc/78/92/55/387789255.db2.gz BKXKPCDKJSQPPX-UHFFFAOYSA-N 1 1 232.714 3.656 20 0 BHADMO Cc1ccc[nH+]c1NCc1ccccc1Cl ZINC000049942929 188086275 /nfs/dbraw/zinc/08/62/75/188086275.db2.gz XIWJBYMCHAGGDC-UHFFFAOYSA-N 1 1 232.714 3.656 20 0 BHADMO Cc1ccc[nH+]c1NCc1cccc(Cl)c1 ZINC000049942931 187395542 /nfs/dbraw/zinc/39/55/42/187395542.db2.gz BALNBBWRLWGTTP-UHFFFAOYSA-N 1 1 232.714 3.656 20 0 BHADMO COc1ccc(C[N@@H+](CC=C(C)C)C2CC2)cc1 ZINC000049975109 323165723 /nfs/dbraw/zinc/16/57/23/323165723.db2.gz WVALAZLEPHCDDQ-UHFFFAOYSA-N 1 1 245.366 3.626 20 0 BHADMO CC[C@H](Nc1cc(C)[nH+]c(C)n1)c1ccccc1 ZINC000050197595 344655594 /nfs/dbraw/zinc/65/55/94/344655594.db2.gz XNMXUDIYAGOMNI-AWEZNQCLSA-N 1 1 241.338 3.657 20 0 BHADMO CC[C@@H](Nc1cc(C)[nH+]c(C)n1)c1ccccc1 ZINC000050197597 344655982 /nfs/dbraw/zinc/65/59/82/344655982.db2.gz XNMXUDIYAGOMNI-CQSZACIVSA-N 1 1 241.338 3.657 20 0 BHADMO Cc1ccc(CNc2[nH]c3ccccc3[nH+]2)s1 ZINC000050225673 178641997 /nfs/dbraw/zinc/64/19/97/178641997.db2.gz CMUPQWQDLVCOLW-UHFFFAOYSA-N 1 1 243.335 3.545 20 0 BHADMO CC(C)=CC[N@H+](C)[C@@H](C)c1ccccc1 ZINC000050275352 357437026 /nfs/dbraw/zinc/43/70/26/357437026.db2.gz XGVPJRBSDSDNOA-ZDUSSCGKSA-N 1 1 203.329 3.646 20 0 BHADMO CC(C)=CC[N@H+](C)[C@H](C)c1ccccc1 ZINC000050275353 357437696 /nfs/dbraw/zinc/43/76/96/357437696.db2.gz XGVPJRBSDSDNOA-CYBMUJFWSA-N 1 1 203.329 3.646 20 0 BHADMO CCC[C@@H](CC)Nc1[nH]c2ccccc2[nH+]1 ZINC000050405858 384697440 /nfs/dbraw/zinc/69/74/40/384697440.db2.gz MDSKLVUQQKTJSG-SNVBAGLBSA-N 1 1 217.316 3.554 20 0 BHADMO CCC[C@H](CC)Nc1[nH]c2ccccc2[nH+]1 ZINC000050405860 322850054 /nfs/dbraw/zinc/85/00/54/322850054.db2.gz MDSKLVUQQKTJSG-JTQLQIEISA-N 1 1 217.316 3.554 20 0 BHADMO Cc1ccccc1C[N@H+](C)C(C1CC1)C1CC1 ZINC000050988986 350502456 /nfs/dbraw/zinc/50/24/56/350502456.db2.gz RSKKOADGQFAVDQ-UHFFFAOYSA-N 1 1 229.367 3.615 20 0 BHADMO Cc1ccc[nH+]c1NCCc1ccc(Cl)cc1 ZINC000051041063 384700435 /nfs/dbraw/zinc/70/04/35/384700435.db2.gz IKZNKCRKEALUBY-UHFFFAOYSA-N 1 1 246.741 3.698 20 0 BHADMO C[N@@H+](Cc1ccccc1)Cc1cc(F)ccc1F ZINC000051122473 350603763 /nfs/dbraw/zinc/60/37/63/350603763.db2.gz OBPAPYSTTOFMSM-UHFFFAOYSA-N 1 1 247.288 3.597 20 0 BHADMO C[N@H+](Cc1ccccc1)Cc1cc(F)ccc1F ZINC000051122473 350603762 /nfs/dbraw/zinc/60/37/62/350603762.db2.gz OBPAPYSTTOFMSM-UHFFFAOYSA-N 1 1 247.288 3.597 20 0 BHADMO C[C@@H](c1ccccc1F)[N@H+]1CCC[C@@H](C)C1 ZINC000051149625 346956959 /nfs/dbraw/zinc/95/69/59/346956959.db2.gz KEVZAHDNFNWHJO-NEPJUHHUSA-N 1 1 221.319 3.619 20 0 BHADMO C[C@@H](c1ccccc1F)[N@H+]1CCC[C@H](C)C1 ZINC000051149627 346956886 /nfs/dbraw/zinc/95/68/86/346956886.db2.gz KEVZAHDNFNWHJO-RYUDHWBXSA-N 1 1 221.319 3.619 20 0 BHADMO CC(C)c1nc(C[N@H+]2CCCC[C@H]2C)cs1 ZINC000051227627 350616427 /nfs/dbraw/zinc/61/64/27/350616427.db2.gz YASVCPWUOJIRGC-LLVKDONJSA-N 1 1 238.400 3.641 20 0 BHADMO CC(C)c1nc(C[N@@H+]2CCCC[C@H]2C)cs1 ZINC000051227627 350616425 /nfs/dbraw/zinc/61/64/25/350616425.db2.gz YASVCPWUOJIRGC-LLVKDONJSA-N 1 1 238.400 3.641 20 0 BHADMO CC(C)c1nc(C[N@H+]2CCCC[C@@H]2C)cs1 ZINC000051227628 350616470 /nfs/dbraw/zinc/61/64/70/350616470.db2.gz YASVCPWUOJIRGC-NSHDSACASA-N 1 1 238.400 3.641 20 0 BHADMO CC(C)c1nc(C[N@@H+]2CCCC[C@@H]2C)cs1 ZINC000051227628 350616468 /nfs/dbraw/zinc/61/64/68/350616468.db2.gz YASVCPWUOJIRGC-NSHDSACASA-N 1 1 238.400 3.641 20 0 BHADMO CCCC[N@@H+](CC)Cc1csc(C(C)C)n1 ZINC000051266735 343253777 /nfs/dbraw/zinc/25/37/77/343253777.db2.gz DPXXTTVFZGQTKT-UHFFFAOYSA-N 1 1 240.416 3.889 20 0 BHADMO C[C@@H](c1ccccc1F)[N@@H+](C)Cc1ccco1 ZINC000051563459 323189966 /nfs/dbraw/zinc/18/99/66/323189966.db2.gz SCCZXPXXQUFVRC-NSHDSACASA-N 1 1 233.286 3.612 20 0 BHADMO C[C@@H](c1ccccc1F)[N@H+](C)Cc1ccco1 ZINC000051563459 323189965 /nfs/dbraw/zinc/18/99/65/323189965.db2.gz SCCZXPXXQUFVRC-NSHDSACASA-N 1 1 233.286 3.612 20 0 BHADMO C[C@H](c1ccccc1F)[N@@H+](C)Cc1ccco1 ZINC000051563460 323189977 /nfs/dbraw/zinc/18/99/77/323189977.db2.gz SCCZXPXXQUFVRC-LLVKDONJSA-N 1 1 233.286 3.612 20 0 BHADMO C[C@H](c1ccccc1F)[N@H+](C)Cc1ccco1 ZINC000051563460 323189976 /nfs/dbraw/zinc/18/99/76/323189976.db2.gz SCCZXPXXQUFVRC-LLVKDONJSA-N 1 1 233.286 3.612 20 0 BHADMO C[C@H]([N@@H+](C)Cc1ccnc(Cl)c1)C(C)(C)C ZINC000051602978 631813929 /nfs/dbraw/zinc/81/39/29/631813929.db2.gz FHWGCZQEADPHLY-JTQLQIEISA-N 1 1 240.778 3.601 20 0 BHADMO C[C@@H]([N@@H+](C)Cc1ccnc(Cl)c1)C(C)(C)C ZINC000051602979 631814623 /nfs/dbraw/zinc/81/46/23/631814623.db2.gz FHWGCZQEADPHLY-SNVBAGLBSA-N 1 1 240.778 3.601 20 0 BHADMO CC[C@H]([NH2+]Cc1nc(C)c(C)o1)c1ccccc1 ZINC000051628184 384675498 /nfs/dbraw/zinc/67/54/98/384675498.db2.gz JSLMNMUXISQHPN-AWEZNQCLSA-N 1 1 244.338 3.532 20 0 BHADMO CC[C@@H]([NH2+]Cc1nc(C)c(C)o1)c1ccccc1 ZINC000051628185 343627529 /nfs/dbraw/zinc/62/75/29/343627529.db2.gz JSLMNMUXISQHPN-CQSZACIVSA-N 1 1 244.338 3.532 20 0 BHADMO CC[C@H](Nc1cccc(C)[nH+]1)c1ccccc1 ZINC000051628760 358757075 /nfs/dbraw/zinc/75/70/75/358757075.db2.gz PCZPWHPYFXRHNS-AWEZNQCLSA-N 1 1 226.323 3.953 20 0 BHADMO CC[C@@H](Nc1cccc(C)[nH+]1)c1ccccc1 ZINC000051628762 358757446 /nfs/dbraw/zinc/75/74/46/358757446.db2.gz PCZPWHPYFXRHNS-CQSZACIVSA-N 1 1 226.323 3.953 20 0 BHADMO CC[C@H](Nc1cc(C)cc[nH+]1)c1ccccc1 ZINC000051628824 384702505 /nfs/dbraw/zinc/70/25/05/384702505.db2.gz NQPWNMRVUWQEQS-AWEZNQCLSA-N 1 1 226.323 3.953 20 0 BHADMO CC[C@@H](Nc1cc(C)cc[nH+]1)c1ccccc1 ZINC000051628826 384702561 /nfs/dbraw/zinc/70/25/61/384702561.db2.gz NQPWNMRVUWQEQS-CQSZACIVSA-N 1 1 226.323 3.953 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)Cc1cc(F)ccc1F ZINC000051686171 355720490 /nfs/dbraw/zinc/72/04/90/355720490.db2.gz PHFDAPBZZDUVTG-SNVBAGLBSA-N 1 1 227.298 3.585 20 0 BHADMO CCC[C@H](C)[N@@H+](C)Cc1cc(F)ccc1F ZINC000051686173 350760976 /nfs/dbraw/zinc/76/09/76/350760976.db2.gz PHFDAPBZZDUVTG-JTQLQIEISA-N 1 1 227.298 3.585 20 0 BHADMO CCCCC[N@@H+](C/C=C/Cl)C(C)C ZINC000051709063 640598617 /nfs/dbraw/zinc/59/86/17/640598617.db2.gz FSNMEEUWIAQGKF-BQYQJAHWSA-N 1 1 203.757 3.640 20 0 BHADMO CCc1ccc(C[NH2+]Cc2ccccc2Cl)o1 ZINC000051721301 323190817 /nfs/dbraw/zinc/19/08/17/323190817.db2.gz KHEVDGRYTJFREI-UHFFFAOYSA-N 1 1 249.741 3.785 20 0 BHADMO CCc1ccc(C[NH2+][C@@H]2CCCc3occc32)o1 ZINC000051721970 171811160 /nfs/dbraw/zinc/81/11/60/171811160.db2.gz ZONCOSGCVCXWIX-CQSZACIVSA-N 1 1 245.322 3.602 20 0 BHADMO CCc1ccc(C[NH2+][C@H]2CCCc3occc32)o1 ZINC000051721973 398057553 /nfs/dbraw/zinc/05/75/53/398057553.db2.gz ZONCOSGCVCXWIX-AWEZNQCLSA-N 1 1 245.322 3.602 20 0 BHADMO CCc1ccc(C[NH2+][C@@H](C)c2cc(C)oc2C)o1 ZINC000051724997 358760725 /nfs/dbraw/zinc/76/07/25/358760725.db2.gz UJTBDFGJKBTLHY-NSHDSACASA-N 1 1 247.338 3.903 20 0 BHADMO CCc1ccc(C[NH2+][C@H](C)c2cc(C)oc2C)o1 ZINC000051724999 358760696 /nfs/dbraw/zinc/76/06/96/358760696.db2.gz UJTBDFGJKBTLHY-LLVKDONJSA-N 1 1 247.338 3.903 20 0 BHADMO CCC(CC)C[N@@H+](CC)Cc1c(C)noc1C ZINC000051824696 358764148 /nfs/dbraw/zinc/76/41/48/358764148.db2.gz ACNVZZPXOLYSKV-UHFFFAOYSA-N 1 1 238.375 3.550 20 0 BHADMO CC[N@@H+](Cc1nc2ccccc2o1)C1CCCC1 ZINC000051907427 343279011 /nfs/dbraw/zinc/27/90/11/343279011.db2.gz RWQCTQWSFRDYJD-UHFFFAOYSA-N 1 1 244.338 3.592 20 0 BHADMO Cc1ccc(C[N@@H+](Cc2ccccc2)C2CC2)o1 ZINC000051965756 350872457 /nfs/dbraw/zinc/87/24/57/350872457.db2.gz CCXKMLSTDBVGLS-UHFFFAOYSA-N 1 1 241.334 3.753 20 0 BHADMO CC(C)=CC[N@@H+](Cc1ccc(C)o1)C1CC1 ZINC000051967228 350831001 /nfs/dbraw/zinc/83/10/01/350831001.db2.gz BSQTWKZDDYZGLM-UHFFFAOYSA-N 1 1 219.328 3.519 20 0 BHADMO C[N@H+](C/C=C/Cl)CCCCc1ccccc1 ZINC000052037579 632051194 /nfs/dbraw/zinc/05/11/94/632051194.db2.gz JVSYWXOTQRDYAL-YRNVUSSQSA-N 1 1 237.774 3.694 20 0 BHADMO CCC[N@@H+](C)Cc1cccc(C(F)(F)F)c1 ZINC000052048844 358772485 /nfs/dbraw/zinc/77/24/85/358772485.db2.gz DJZOJAWAVGVKHU-UHFFFAOYSA-N 1 1 231.261 3.547 20 0 BHADMO C[C@@H](c1ccccc1F)[N@@H+](C)C/C=C/Cl ZINC000052073899 711603224 /nfs/dbraw/zinc/60/32/24/711603224.db2.gz SYPIZLCJBXZKJC-YVFTVSHDSA-N 1 1 227.710 3.571 20 0 BHADMO C[C@@H](c1ccccc1F)[N@H+](C)C/C=C/Cl ZINC000052073899 711603221 /nfs/dbraw/zinc/60/32/21/711603221.db2.gz SYPIZLCJBXZKJC-YVFTVSHDSA-N 1 1 227.710 3.571 20 0 BHADMO C[C@H](c1ccccc1F)[N@@H+](C)C/C=C/Cl ZINC000052073900 711603352 /nfs/dbraw/zinc/60/33/52/711603352.db2.gz SYPIZLCJBXZKJC-VHODGJRUSA-N 1 1 227.710 3.571 20 0 BHADMO C[C@H](c1ccccc1F)[N@H+](C)C/C=C/Cl ZINC000052073900 711603350 /nfs/dbraw/zinc/60/33/50/711603350.db2.gz SYPIZLCJBXZKJC-VHODGJRUSA-N 1 1 227.710 3.571 20 0 BHADMO CC(C)C[N@@H+](C)[C@@H](C)c1cc(F)ccc1F ZINC000052075295 350904757 /nfs/dbraw/zinc/90/47/57/350904757.db2.gz GYGFOBTYYKGQLZ-JTQLQIEISA-N 1 1 227.298 3.614 20 0 BHADMO CC(C)C[N@@H+](C)[C@H](C)c1cc(F)ccc1F ZINC000052075296 350904477 /nfs/dbraw/zinc/90/44/77/350904477.db2.gz GYGFOBTYYKGQLZ-SNVBAGLBSA-N 1 1 227.298 3.614 20 0 BHADMO Cl/C=C/C[N@@H+](Cc1ccco1)C1CCCC1 ZINC000052077057 632064321 /nfs/dbraw/zinc/06/43/21/632064321.db2.gz IPYQVOZKNDTYKH-XBXARRHUSA-N 1 1 239.746 3.777 20 0 BHADMO C=C(Cl)C[N@@H+](Cc1ccco1)C1CCCC1 ZINC000052077196 643644900 /nfs/dbraw/zinc/64/49/00/643644900.db2.gz IYIODPBZKNBVLD-UHFFFAOYSA-N 1 1 239.746 3.777 20 0 BHADMO C=C(Cl)C[N@H+](Cc1ccco1)C1CCCC1 ZINC000052077196 643644896 /nfs/dbraw/zinc/64/48/96/643644896.db2.gz IYIODPBZKNBVLD-UHFFFAOYSA-N 1 1 239.746 3.777 20 0 BHADMO CC(C)C[N@@H+](Cc1ccco1)C1CCCC1 ZINC000052077220 350908229 /nfs/dbraw/zinc/90/82/29/350908229.db2.gz IKEQSKNDMKMBIZ-UHFFFAOYSA-N 1 1 221.344 3.680 20 0 BHADMO CCC[N@H+]1CCC[C@@H]1c1cccc(Cl)c1 ZINC000052077910 350908159 /nfs/dbraw/zinc/90/81/59/350908159.db2.gz FWVKIBXQPWGOKN-CYBMUJFWSA-N 1 1 223.747 3.887 20 0 BHADMO CCC[N@H+]1CCC[C@H]1c1cccc(Cl)c1 ZINC000052077911 350908267 /nfs/dbraw/zinc/90/82/67/350908267.db2.gz FWVKIBXQPWGOKN-ZDUSSCGKSA-N 1 1 223.747 3.887 20 0 BHADMO Cc1cc(C[N@@H+](C2CC2)C2CCC(C)CC2)on1 ZINC000052104092 358773449 /nfs/dbraw/zinc/77/34/49/358773449.db2.gz HHCIKDTZFNWMIK-UHFFFAOYSA-N 1 1 248.370 3.526 20 0 BHADMO C[N@H+](Cc1ccccc1C(F)(F)F)CC1CC1 ZINC000052106389 358772989 /nfs/dbraw/zinc/77/29/89/358772989.db2.gz ADRLJRCRFPQMHD-UHFFFAOYSA-N 1 1 243.272 3.547 20 0 BHADMO C[N@H+](Cc1cccc(C(F)(F)F)c1)CC1CC1 ZINC000052128323 323192638 /nfs/dbraw/zinc/19/26/38/323192638.db2.gz FSINBNKIVIMQDN-UHFFFAOYSA-N 1 1 243.272 3.547 20 0 BHADMO Fc1cccc(C[N@@H+](C/C=C/Cl)C2CC2)c1 ZINC000052161616 643682670 /nfs/dbraw/zinc/68/26/70/643682670.db2.gz MEMLHWXTEUOCMW-FARCUNLSSA-N 1 1 239.721 3.543 20 0 BHADMO Fc1cccc(C[N@H+](C/C=C/Cl)C2CC2)c1 ZINC000052161616 643682668 /nfs/dbraw/zinc/68/26/68/643682668.db2.gz MEMLHWXTEUOCMW-FARCUNLSSA-N 1 1 239.721 3.543 20 0 BHADMO CCC[N@@H+](C)[C@@H](C)c1cccc(Cl)c1 ZINC000052162471 343455013 /nfs/dbraw/zinc/45/50/13/343455013.db2.gz HQFQLVQTLNVHFD-JTQLQIEISA-N 1 1 211.736 3.743 20 0 BHADMO CCC[N@@H+](C)[C@H](C)c1cccc(Cl)c1 ZINC000052162472 343455143 /nfs/dbraw/zinc/45/51/43/343455143.db2.gz HQFQLVQTLNVHFD-SNVBAGLBSA-N 1 1 211.736 3.743 20 0 BHADMO CCC[N@@H+](C)[C@@H](C)c1ccccc1Cl ZINC000052163223 350957811 /nfs/dbraw/zinc/95/78/11/350957811.db2.gz CPHMLVDZPAGKAA-JTQLQIEISA-N 1 1 211.736 3.743 20 0 BHADMO CCC[N@@H+](C)[C@H](C)c1ccccc1Cl ZINC000052163224 350958438 /nfs/dbraw/zinc/95/84/38/350958438.db2.gz CPHMLVDZPAGKAA-SNVBAGLBSA-N 1 1 211.736 3.743 20 0 BHADMO COc1ccccc1C[N@@H+](CC=C(C)C)C1CC1 ZINC000052183448 350960513 /nfs/dbraw/zinc/96/05/13/350960513.db2.gz PVEOAVVVDGYPFE-UHFFFAOYSA-N 1 1 245.366 3.626 20 0 BHADMO CCC[N@H+]1CCC[C@@H]1c1ccccc1Cl ZINC000052211462 350967676 /nfs/dbraw/zinc/96/76/76/350967676.db2.gz FSUXIXOQTSJKQS-CYBMUJFWSA-N 1 1 223.747 3.887 20 0 BHADMO CCC[N@H+]1CCC[C@H]1c1ccccc1Cl ZINC000052211465 350967593 /nfs/dbraw/zinc/96/75/93/350967593.db2.gz FSUXIXOQTSJKQS-ZDUSSCGKSA-N 1 1 223.747 3.887 20 0 BHADMO Clc1ccc2c(NC3CCC3)cc[nH+]c2c1 ZINC000052211629 384709895 /nfs/dbraw/zinc/70/98/95/384709895.db2.gz JAIFSFGNZNWBKJ-UHFFFAOYSA-N 1 1 232.714 3.853 20 0 BHADMO Cc1ccccc1[C@@H]1CCC[N@@H+]1CCOC(C)C ZINC000052212267 350939265 /nfs/dbraw/zinc/93/92/65/350939265.db2.gz LBMRGKBNPSASRO-INIZCTEOSA-N 1 1 247.382 3.557 20 0 BHADMO Cc1ccccc1[C@H]1CCC[N@@H+]1CCOC(C)C ZINC000052212270 350939247 /nfs/dbraw/zinc/93/92/47/350939247.db2.gz LBMRGKBNPSASRO-MRXNPFEDSA-N 1 1 247.382 3.557 20 0 BHADMO CCC[N@H+]1CCC[C@@H]1c1ccccc1C ZINC000052213107 350967479 /nfs/dbraw/zinc/96/74/79/350967479.db2.gz KPIDEFZLSCXVPY-CQSZACIVSA-N 1 1 203.329 3.542 20 0 BHADMO CCC[N@H+]1CCC[C@H]1c1ccccc1C ZINC000052213109 350968005 /nfs/dbraw/zinc/96/80/05/350968005.db2.gz KPIDEFZLSCXVPY-AWEZNQCLSA-N 1 1 203.329 3.542 20 0 BHADMO Cc1cc(C[N@@H+](CC2CCCCC2)C2CC2)no1 ZINC000052245017 358777200 /nfs/dbraw/zinc/77/72/00/358777200.db2.gz NIWAKJQTIDPRDM-UHFFFAOYSA-N 1 1 248.370 3.528 20 0 BHADMO Cc1cc(C[N@@H+](CC2CCCCC2)C2CC2)on1 ZINC000052245054 350940480 /nfs/dbraw/zinc/94/04/80/350940480.db2.gz MHYWPDZDEZYMSJ-UHFFFAOYSA-N 1 1 248.370 3.528 20 0 BHADMO CCCc1nc(C[N@@H+](C)CCC(C)C)cs1 ZINC000052246089 385711222 /nfs/dbraw/zinc/71/12/22/385711222.db2.gz XWKRYVINJZFKIO-UHFFFAOYSA-N 1 1 240.416 3.574 20 0 BHADMO CCCc1nc(C[N@H+](C)CCC(C)C)cs1 ZINC000052246089 385711220 /nfs/dbraw/zinc/71/12/20/385711220.db2.gz XWKRYVINJZFKIO-UHFFFAOYSA-N 1 1 240.416 3.574 20 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Cc1cc(C)cc(C[N@@H+](C)Cc2ccoc2)c1 ZINC000052442642 358782769 /nfs/dbraw/zinc/78/27/69/358782769.db2.gz XLUDRZRXMIIGKC-UHFFFAOYSA-N 1 1 229.323 3.528 20 0 BHADMO Fc1cccc([C@@H]2CCC[N@H+]2C/C=C/Cl)c1 ZINC000052455248 711619619 /nfs/dbraw/zinc/61/96/19/711619619.db2.gz UKSFRUAYYFHPRQ-MXPWBENCSA-N 1 1 239.721 3.715 20 0 BHADMO Fc1cccc([C@H]2CCC[N@H+]2C/C=C/Cl)c1 ZINC000052455250 711619482 /nfs/dbraw/zinc/61/94/82/711619482.db2.gz UKSFRUAYYFHPRQ-LPZVBRGNSA-N 1 1 239.721 3.715 20 0 BHADMO C=C(Cl)C[N@@H+]1CCC[C@@H]1c1cccc(F)c1 ZINC000052455743 632413407 /nfs/dbraw/zinc/41/34/07/632413407.db2.gz UKOLHQVQMJEISW-CYBMUJFWSA-N 1 1 239.721 3.715 20 0 BHADMO C=C(Cl)C[N@H+]1CCC[C@@H]1c1cccc(F)c1 ZINC000052455743 632413402 /nfs/dbraw/zinc/41/34/02/632413402.db2.gz UKOLHQVQMJEISW-CYBMUJFWSA-N 1 1 239.721 3.715 20 0 BHADMO C=C(Cl)C[N@@H+]1CCC[C@H]1c1cccc(F)c1 ZINC000052455745 632413990 /nfs/dbraw/zinc/41/39/90/632413990.db2.gz UKOLHQVQMJEISW-ZDUSSCGKSA-N 1 1 239.721 3.715 20 0 BHADMO C=C(Cl)C[N@H+]1CCC[C@H]1c1cccc(F)c1 ZINC000052455745 632413986 /nfs/dbraw/zinc/41/39/86/632413986.db2.gz UKOLHQVQMJEISW-ZDUSSCGKSA-N 1 1 239.721 3.715 20 0 BHADMO CC(C)C[N@H+]1CCC[C@@H]1c1cccc(F)c1 ZINC000052455807 323193326 /nfs/dbraw/zinc/19/33/26/323193326.db2.gz ZXWNWVLGPGKWEA-CQSZACIVSA-N 1 1 221.319 3.619 20 0 BHADMO CC(C)C[N@H+]1CCC[C@H]1c1cccc(F)c1 ZINC000052455810 323193392 /nfs/dbraw/zinc/19/33/92/323193392.db2.gz ZXWNWVLGPGKWEA-AWEZNQCLSA-N 1 1 221.319 3.619 20 0 BHADMO CC[N@@H+](CC(C)C)[C@@H](C)c1cccc(OC)c1 ZINC000052706173 351067092 /nfs/dbraw/zinc/06/70/92/351067092.db2.gz LASDPUPZVSSADJ-ZDUSSCGKSA-N 1 1 235.371 3.734 20 0 BHADMO CC[N@@H+](CC(C)C)[C@H](C)c1cccc(OC)c1 ZINC000052706176 351066830 /nfs/dbraw/zinc/06/68/30/351066830.db2.gz LASDPUPZVSSADJ-CYBMUJFWSA-N 1 1 235.371 3.734 20 0 BHADMO CC(C)C[N@@H+](Cc1cccnc1Cl)C(C)C ZINC000052716741 632882251 /nfs/dbraw/zinc/88/22/51/632882251.db2.gz OTKAJEGXHKSDEF-UHFFFAOYSA-N 1 1 240.778 3.601 20 0 BHADMO C[C@H]([N@@H+](C)Cc1cccnc1Cl)C(C)(C)C ZINC000052717005 632465800 /nfs/dbraw/zinc/46/58/00/632465800.db2.gz GMCOMDVEIHYCMS-JTQLQIEISA-N 1 1 240.778 3.601 20 0 BHADMO C[C@@H]([N@@H+](C)Cc1cccnc1Cl)C(C)(C)C ZINC000052717008 632465942 /nfs/dbraw/zinc/46/59/42/632465942.db2.gz GMCOMDVEIHYCMS-SNVBAGLBSA-N 1 1 240.778 3.601 20 0 BHADMO C[C@@H](c1ccc(F)cc1)[N@H+]1CCC[C@@H](C)C1 ZINC000052804356 487935453 /nfs/dbraw/zinc/93/54/53/487935453.db2.gz RBHAOVHKQDCRQW-NEPJUHHUSA-N 1 1 221.319 3.619 20 0 BHADMO C[C@@H](c1ccc(F)cc1)[N@H+]1CCC[C@H](C)C1 ZINC000052804358 487935390 /nfs/dbraw/zinc/93/53/90/487935390.db2.gz RBHAOVHKQDCRQW-RYUDHWBXSA-N 1 1 221.319 3.619 20 0 BHADMO C=C(Cl)C[N@@H+](Cc1ccccc1)C(C)C ZINC000052877124 643686834 /nfs/dbraw/zinc/68/68/34/643686834.db2.gz ABTFSYLNVABXNH-UHFFFAOYSA-N 1 1 223.747 3.650 20 0 BHADMO CCCC[N@@H+](CC)Cc1cc(-c2ccco2)on1 ZINC000052889686 323195768 /nfs/dbraw/zinc/19/57/68/323195768.db2.gz MLCPPSJDAVUEQS-UHFFFAOYSA-N 1 1 248.326 3.557 20 0 BHADMO CC(C)=CC[N@H+](C)Cc1ccc(Cl)s1 ZINC000052892509 487945773 /nfs/dbraw/zinc/94/57/73/487945773.db2.gz XMBFFNHTWFBELW-UHFFFAOYSA-N 1 1 229.776 3.800 20 0 BHADMO CCCC[N@@H+](C)Cc1ccc(OC(F)F)cc1 ZINC000052896915 487947037 /nfs/dbraw/zinc/94/70/37/487947037.db2.gz HDHRVKROSBDJKK-UHFFFAOYSA-N 1 1 243.297 3.520 20 0 BHADMO C[N@@H+](Cc1ccccc1)Cc1cccc(F)c1F ZINC000052916641 351078621 /nfs/dbraw/zinc/07/86/21/351078621.db2.gz SVZIWLIEFTUYBO-UHFFFAOYSA-N 1 1 247.288 3.597 20 0 BHADMO C[N@H+](Cc1ccccc1)Cc1cccc(F)c1F ZINC000052916641 351078618 /nfs/dbraw/zinc/07/86/18/351078618.db2.gz SVZIWLIEFTUYBO-UHFFFAOYSA-N 1 1 247.288 3.597 20 0 BHADMO Cc1ccc(C[N@@H+](C)CCCc2ccccc2)o1 ZINC000052922145 487952879 /nfs/dbraw/zinc/95/28/79/487952879.db2.gz KYORHJVDAKRINI-UHFFFAOYSA-N 1 1 243.350 3.653 20 0 BHADMO C[N@@H+](CCCc1ccccc1)Cc1cccs1 ZINC000052922370 487952401 /nfs/dbraw/zinc/95/24/01/487952401.db2.gz UCEBHGLRPJELRZ-UHFFFAOYSA-N 1 1 245.391 3.813 20 0 BHADMO CCC[N@@H+](CC)[C@@H](C)c1ccc(F)cc1 ZINC000053088716 353605457 /nfs/dbraw/zinc/60/54/57/353605457.db2.gz HJPCNCIGAWQECH-NSHDSACASA-N 1 1 209.308 3.619 20 0 BHADMO CCC[N@@H+](CC)[C@H](C)c1ccc(F)cc1 ZINC000053088718 353605579 /nfs/dbraw/zinc/60/55/79/353605579.db2.gz HJPCNCIGAWQECH-LLVKDONJSA-N 1 1 209.308 3.619 20 0 BHADMO CC(C)=CC[N@H+]1CCC[C@@H]1c1cccs1 ZINC000053096110 353814683 /nfs/dbraw/zinc/81/46/83/353814683.db2.gz BYOYRNVRQJVPBH-GFCCVEGCSA-N 1 1 221.369 3.851 20 0 BHADMO CC(C)=CC[N@H+]1CCC[C@H]1c1cccs1 ZINC000053096112 353814842 /nfs/dbraw/zinc/81/48/42/353814842.db2.gz BYOYRNVRQJVPBH-LBPRGKRZSA-N 1 1 221.369 3.851 20 0 BHADMO CC(C)=CC[N@H+](C)Cc1nc2ccccc2s1 ZINC000053098764 487996240 /nfs/dbraw/zinc/99/62/40/487996240.db2.gz JJOOUYNHBJCZEG-UHFFFAOYSA-N 1 1 246.379 3.694 20 0 BHADMO CC(C)=CC[N@@H+](C)Cc1nc2ccccc2s1 ZINC000053098764 487996237 /nfs/dbraw/zinc/99/62/37/487996237.db2.gz JJOOUYNHBJCZEG-UHFFFAOYSA-N 1 1 246.379 3.694 20 0 BHADMO C[N@@H+](CCCc1ccccc1)Cc1ccsc1 ZINC000053134417 358102626 /nfs/dbraw/zinc/10/26/26/358102626.db2.gz JAPKYIOYUPIDCA-UHFFFAOYSA-N 1 1 245.391 3.813 20 0 BHADMO C[C@@H]1c2ccsc2CC[N@@H+]1Cc1ccccc1 ZINC000053150559 355837943 /nfs/dbraw/zinc/83/79/43/355837943.db2.gz YVJIFNCBRVVUOD-GFCCVEGCSA-N 1 1 243.375 3.867 20 0 BHADMO C[C@H]1c2ccsc2CC[N@@H+]1Cc1ccccc1 ZINC000053150561 358106282 /nfs/dbraw/zinc/10/62/82/358106282.db2.gz YVJIFNCBRVVUOD-LBPRGKRZSA-N 1 1 243.375 3.867 20 0 BHADMO CC(C)=CC[N@H+]1CCc2sccc2[C@H]1C ZINC000053150796 488006286 /nfs/dbraw/zinc/00/62/86/488006286.db2.gz VLEHZVOZOSZULS-LLVKDONJSA-N 1 1 221.369 3.633 20 0 BHADMO CC(C)=CC[N@H+]1CCc2sccc2[C@@H]1C ZINC000053150798 488005746 /nfs/dbraw/zinc/00/57/46/488005746.db2.gz VLEHZVOZOSZULS-NSHDSACASA-N 1 1 221.369 3.633 20 0 BHADMO CC(C)CC[N@@H+](C)Cc1cccc2cccnc21 ZINC000053365290 356701455 /nfs/dbraw/zinc/70/14/55/356701455.db2.gz HDWDQLZYRCHXDX-UHFFFAOYSA-N 1 1 242.366 3.713 20 0 BHADMO CC(C)=CC[N@H+](C)[C@@H](C)c1ccc(F)cc1 ZINC000053422518 487597483 /nfs/dbraw/zinc/59/74/83/487597483.db2.gz NORDTFKICXGFLV-LBPRGKRZSA-N 1 1 221.319 3.785 20 0 BHADMO CC(C)=CC[N@H+](C)[C@H](C)c1ccc(F)cc1 ZINC000053422520 487597560 /nfs/dbraw/zinc/59/75/60/487597560.db2.gz NORDTFKICXGFLV-GFCCVEGCSA-N 1 1 221.319 3.785 20 0 BHADMO C=C(Cl)C[N@H+](C)[C@@H](C)c1ccc(F)cc1 ZINC000053422522 643688454 /nfs/dbraw/zinc/68/84/54/643688454.db2.gz JQEOFYPQHWKAFD-JTQLQIEISA-N 1 1 227.710 3.571 20 0 BHADMO C=C(Cl)C[N@@H+](C)[C@@H](C)c1ccc(F)cc1 ZINC000053422522 643688448 /nfs/dbraw/zinc/68/84/48/643688448.db2.gz JQEOFYPQHWKAFD-JTQLQIEISA-N 1 1 227.710 3.571 20 0 BHADMO C=C(Cl)C[N@H+](C)[C@H](C)c1ccc(F)cc1 ZINC000053422524 643689305 /nfs/dbraw/zinc/68/93/05/643689305.db2.gz JQEOFYPQHWKAFD-SNVBAGLBSA-N 1 1 227.710 3.571 20 0 BHADMO C=C(Cl)C[N@@H+](C)[C@H](C)c1ccc(F)cc1 ZINC000053422524 643689303 /nfs/dbraw/zinc/68/93/03/643689303.db2.gz JQEOFYPQHWKAFD-SNVBAGLBSA-N 1 1 227.710 3.571 20 0 BHADMO C[C@@H](c1cccs1)[N@@H+](C)Cc1ccccc1 ZINC000053428374 491083051 /nfs/dbraw/zinc/08/30/51/491083051.db2.gz RSQSAULTYDFHKC-LBPRGKRZSA-N 1 1 231.364 3.941 20 0 BHADMO CC(C)=CC[N@H+](C)[C@@H](C)c1cccs1 ZINC000053429459 348562214 /nfs/dbraw/zinc/56/22/14/348562214.db2.gz WEITWXHAFGEPBC-NSHDSACASA-N 1 1 209.358 3.707 20 0 BHADMO CC(C)=CC[N@H+](C)[C@H](C)c1cccs1 ZINC000053429463 348562129 /nfs/dbraw/zinc/56/21/29/348562129.db2.gz WEITWXHAFGEPBC-LLVKDONJSA-N 1 1 209.358 3.707 20 0 BHADMO CSc1ccc(C[N@@H+](C)C2CCCC2)cc1 ZINC000053435271 344464775 /nfs/dbraw/zinc/46/47/75/344464775.db2.gz ZGBZYDLCTVTIHX-UHFFFAOYSA-N 1 1 235.396 3.783 20 0 BHADMO C[N@@H+](Cc1cccc(Cl)c1)C1CCCC1 ZINC000053435430 363287781 /nfs/dbraw/zinc/28/77/81/363287781.db2.gz BYEQMHMTZYONGE-UHFFFAOYSA-N 1 1 223.747 3.714 20 0 BHADMO C[N@@H+](Cc1ccc(Cl)s1)C1CCCC1 ZINC000053435487 384859872 /nfs/dbraw/zinc/85/98/72/384859872.db2.gz HJUZFDUMICYVIN-UHFFFAOYSA-N 1 1 229.776 3.776 20 0 BHADMO C[N@@H+](Cc1ccc(Cl)cc1)C1CCCC1 ZINC000053435529 344465465 /nfs/dbraw/zinc/46/54/65/344465465.db2.gz RYXSXNXJCDSPTF-UHFFFAOYSA-N 1 1 223.747 3.714 20 0 BHADMO C[N@@H+](Cc1ccccc1Cl)C1CCCC1 ZINC000053435541 363287585 /nfs/dbraw/zinc/28/75/85/363287585.db2.gz YYPIDJVCQMKRMY-UHFFFAOYSA-N 1 1 223.747 3.714 20 0 BHADMO CC(C)C[N@@H+](Cc1ccco1)Cc1cccs1 ZINC000053906582 363556263 /nfs/dbraw/zinc/55/62/63/363556263.db2.gz LSQUQZQFASVRDE-UHFFFAOYSA-N 1 1 249.379 3.999 20 0 BHADMO CC[N@@H+](CCC(=O)c1ccccc1)C1CCCC1 ZINC000053931638 384728219 /nfs/dbraw/zinc/72/82/19/384728219.db2.gz VGATXWUQMXSQKY-UHFFFAOYSA-N 1 1 245.366 3.524 20 0 BHADMO C[C@H]([N@@H+](C)CCC(=O)c1ccccc1)C(C)(C)C ZINC000053931734 348795669 /nfs/dbraw/zinc/79/56/69/348795669.db2.gz QMBLTQLRVNLCFQ-ZDUSSCGKSA-N 1 1 247.382 3.626 20 0 BHADMO C[C@@H]([N@@H+](C)CCC(=O)c1ccccc1)C(C)(C)C ZINC000053931737 348795370 /nfs/dbraw/zinc/79/53/70/348795370.db2.gz QMBLTQLRVNLCFQ-CYBMUJFWSA-N 1 1 247.382 3.626 20 0 BHADMO CCCC[N@@H+](CC)CCC(=O)c1ccc(C)cc1 ZINC000053934930 384726265 /nfs/dbraw/zinc/72/62/65/384726265.db2.gz URPWVUDCZVIPBP-UHFFFAOYSA-N 1 1 247.382 3.690 20 0 BHADMO CC[N@@H+](CCC(=O)c1ccc(C)cc1)CC(C)C ZINC000053935078 384726121 /nfs/dbraw/zinc/72/61/21/384726121.db2.gz FGAYKRNEDSWRSP-UHFFFAOYSA-N 1 1 247.382 3.546 20 0 BHADMO CC[C@@H](C)C[N@@H+](C)CCC(=O)c1ccc(C)cc1 ZINC000053935211 384725610 /nfs/dbraw/zinc/72/56/10/384725610.db2.gz ASEQXVLFZGHPNK-CYBMUJFWSA-N 1 1 247.382 3.546 20 0 BHADMO CC[C@H](C)C[N@@H+](C)CCC(=O)c1ccc(C)cc1 ZINC000053935213 384728198 /nfs/dbraw/zinc/72/81/98/384728198.db2.gz ASEQXVLFZGHPNK-ZDUSSCGKSA-N 1 1 247.382 3.546 20 0 BHADMO Cc1ccc(C(=O)CC[N@H+](C)[C@@H](C)C(C)C)cc1 ZINC000053935386 384727821 /nfs/dbraw/zinc/72/78/21/384727821.db2.gz YLMPOHWULSCVBT-AWEZNQCLSA-N 1 1 247.382 3.544 20 0 BHADMO Cc1ccc(C(=O)CC[N@H+](C)[C@H](C)C(C)C)cc1 ZINC000053935389 384727719 /nfs/dbraw/zinc/72/77/19/384727719.db2.gz YLMPOHWULSCVBT-CQSZACIVSA-N 1 1 247.382 3.544 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)CCC(=O)c1ccc(C)cc1 ZINC000053935473 384726221 /nfs/dbraw/zinc/72/62/21/384726221.db2.gz AGAPJMXKMSUBJG-CQSZACIVSA-N 1 1 247.382 3.688 20 0 BHADMO CCC[C@H](C)[N@@H+](C)CCC(=O)c1ccc(C)cc1 ZINC000053935474 384727736 /nfs/dbraw/zinc/72/77/36/384727736.db2.gz AGAPJMXKMSUBJG-AWEZNQCLSA-N 1 1 247.382 3.688 20 0 BHADMO Cc1ccc(C(=O)CC[N@H+](C)CC(C)(C)C)cc1 ZINC000053936381 384726146 /nfs/dbraw/zinc/72/61/46/384726146.db2.gz HKKCOJCYUJUVLI-UHFFFAOYSA-N 1 1 247.382 3.546 20 0 BHADMO Cc1ccc(C(=O)CC[N@H+](C)CCC(C)C)cc1 ZINC000053936533 487666697 /nfs/dbraw/zinc/66/66/97/487666697.db2.gz GIJBDNJNEFFUMJ-UHFFFAOYSA-N 1 1 247.382 3.546 20 0 BHADMO CC[N@@H+](CCC(=O)C(C)(C)C)C1CCCCC1 ZINC000054026271 635329673 /nfs/dbraw/zinc/32/96/73/635329673.db2.gz JDKLOTZEQAOJQH-UHFFFAOYSA-N 1 1 239.403 3.646 20 0 BHADMO CC[N@@H+](CCC(=O)C(C)(C)C)Cc1ccccc1 ZINC000054026381 635329616 /nfs/dbraw/zinc/32/96/16/635329616.db2.gz GOQFZKOBAASJKL-UHFFFAOYSA-N 1 1 247.382 3.514 20 0 BHADMO C[N@@H+](CCC(=O)C(C)(C)C)C1CCCCCC1 ZINC000054026484 635328583 /nfs/dbraw/zinc/32/85/83/635328583.db2.gz WRPTZWRLAQMYLS-UHFFFAOYSA-N 1 1 239.403 3.646 20 0 BHADMO C[C@@H]1CCC[C@H]([N@@H+](C)CCC(=O)C(C)(C)C)C1 ZINC000054026578 635326240 /nfs/dbraw/zinc/32/62/40/635326240.db2.gz RJVJAVRSZSSCPN-OLZOCXBDSA-N 1 1 239.403 3.502 20 0 BHADMO C[C@H]1CCC[C@H]([N@@H+](C)CCC(=O)C(C)(C)C)C1 ZINC000054026580 635329325 /nfs/dbraw/zinc/32/93/25/635329325.db2.gz RJVJAVRSZSSCPN-STQMWFEESA-N 1 1 239.403 3.502 20 0 BHADMO C[C@@H]1CCC[C@@H]([N@@H+](C)CCC(=O)C(C)(C)C)C1 ZINC000054026581 635327566 /nfs/dbraw/zinc/32/75/66/635327566.db2.gz RJVJAVRSZSSCPN-CHWSQXEVSA-N 1 1 239.403 3.502 20 0 BHADMO C[C@H]1CCC[C@@H]([N@@H+](C)CCC(=O)C(C)(C)C)C1 ZINC000054026583 635328561 /nfs/dbraw/zinc/32/85/61/635328561.db2.gz RJVJAVRSZSSCPN-QWHCGFSZSA-N 1 1 239.403 3.502 20 0 BHADMO CC1CCC([N@@H+](C)CCC(=O)C(C)(C)C)CC1 ZINC000054026726 635328595 /nfs/dbraw/zinc/32/85/95/635328595.db2.gz GSCSWJCPOPRAAN-UHFFFAOYSA-N 1 1 239.403 3.502 20 0 BHADMO C[N@@H+](CCC(=O)C(C)(C)C)CC1CCCCC1 ZINC000054026741 635329248 /nfs/dbraw/zinc/32/92/48/635329248.db2.gz UTQGIWUIRHHBIR-UHFFFAOYSA-N 1 1 239.403 3.504 20 0 BHADMO C[N@@H+](C/C=C/Cl)Cc1ccc(Cl)cc1 ZINC000054105363 635358186 /nfs/dbraw/zinc/35/81/86/635358186.db2.gz IJPXGBHQUMVFQK-FARCUNLSSA-N 1 1 230.138 3.524 20 0 BHADMO C[N@H+](C/C=C/Cl)Cc1ccc(Cl)cc1 ZINC000054105363 635358178 /nfs/dbraw/zinc/35/81/78/635358178.db2.gz IJPXGBHQUMVFQK-FARCUNLSSA-N 1 1 230.138 3.524 20 0 BHADMO CCCC[N@@H+](C)Cc1cc(-c2ccccc2)no1 ZINC000054115210 487687831 /nfs/dbraw/zinc/68/78/31/487687831.db2.gz SFYKEBJAXDSTPR-UHFFFAOYSA-N 1 1 244.338 3.574 20 0 BHADMO C[N@@H+](C/C=C/Cl)Cc1ccc(Cl)s1 ZINC000054115546 636034865 /nfs/dbraw/zinc/03/48/65/636034865.db2.gz KBQUURPSLCZKGB-GORDUTHDSA-N 1 1 236.167 3.586 20 0 BHADMO C[N@H+](C/C=C/Cl)Cc1ccc(Cl)s1 ZINC000054115546 636034863 /nfs/dbraw/zinc/03/48/63/636034863.db2.gz KBQUURPSLCZKGB-GORDUTHDSA-N 1 1 236.167 3.586 20 0 BHADMO Cl/C=C/C[N@H+]1CCC[C@H]1c1cccs1 ZINC000054115702 363561358 /nfs/dbraw/zinc/56/13/58/363561358.db2.gz FDGOMFZGAYTXFD-YVGDHZEHSA-N 1 1 227.760 3.638 20 0 BHADMO Cl/C=C/C[N@H+]1CCC[C@@H]1c1cccs1 ZINC000054115704 363561671 /nfs/dbraw/zinc/56/16/71/363561671.db2.gz FDGOMFZGAYTXFD-QLCVYAKKSA-N 1 1 227.760 3.638 20 0 BHADMO CC[C@@H]1c2ccsc2CC[N@@H+]1C/C=C/Cl ZINC000054117129 635398304 /nfs/dbraw/zinc/39/83/04/635398304.db2.gz STYGXEWZGQQMEJ-ZXCPCRMDSA-N 1 1 241.787 3.810 20 0 BHADMO CC[C@H]1c2ccsc2CC[N@@H+]1C/C=C/Cl ZINC000054117131 635399379 /nfs/dbraw/zinc/39/93/79/635399379.db2.gz STYGXEWZGQQMEJ-GQOHGMTASA-N 1 1 241.787 3.810 20 0 BHADMO C[C@@H](c1ccc(F)cc1)[N@@H+](C)C/C=C/Cl ZINC000054117315 635398495 /nfs/dbraw/zinc/39/84/95/635398495.db2.gz NNASSNQFROGLJO-ANRVEHPFSA-N 1 1 227.710 3.571 20 0 BHADMO C[C@H](c1ccc(F)cc1)[N@@H+](C)C/C=C/Cl ZINC000054117317 643695379 /nfs/dbraw/zinc/69/53/79/643695379.db2.gz NNASSNQFROGLJO-SIUBYYJGSA-N 1 1 227.710 3.571 20 0 BHADMO Cc1ccc(C2=CC[N@@H+](C/C=C/Cl)CC2)cc1 ZINC000054145961 635742844 /nfs/dbraw/zinc/74/28/44/635742844.db2.gz QVENCFVKRBCOOS-XNWCZRBMSA-N 1 1 247.769 3.837 20 0 BHADMO CC[N@H+](Cc1cccc2cccnc21)CC(C)C ZINC000054316779 323204066 /nfs/dbraw/zinc/20/40/66/323204066.db2.gz IQRATQSTCKWRKB-UHFFFAOYSA-N 1 1 242.366 3.713 20 0 BHADMO CC[N@@H+](C/C=C/Cl)[C@@H](C)c1ccc(F)cc1 ZINC000054341041 636426233 /nfs/dbraw/zinc/42/62/33/636426233.db2.gz VUHWPCSZXGASAH-VKJYCEFSSA-N 1 1 241.737 3.961 20 0 BHADMO CC[N@@H+](C/C=C/Cl)[C@H](C)c1ccc(F)cc1 ZINC000054341043 636426833 /nfs/dbraw/zinc/42/68/33/636426833.db2.gz VUHWPCSZXGASAH-VCFDLTMXSA-N 1 1 241.737 3.961 20 0 BHADMO CCc1nc(C[NH2+][C@@H](C)c2ccccc2)cs1 ZINC000054917934 343663541 /nfs/dbraw/zinc/66/35/41/343663541.db2.gz FAJAMYAJFSBPGP-NSHDSACASA-N 1 1 246.379 3.556 20 0 BHADMO CCc1nc(C[NH2+][C@H](C)c2ccccc2)cs1 ZINC000054917935 343663240 /nfs/dbraw/zinc/66/32/40/343663240.db2.gz FAJAMYAJFSBPGP-LLVKDONJSA-N 1 1 246.379 3.556 20 0 BHADMO CC(C)=CC[N@H+]1CCC[C@@H]1c1ccccc1 ZINC000054993511 488336825 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/nfs/dbraw/zinc/58/46/95/363584695.db2.gz HSPPUVOIDNXHRA-UHFFFAOYSA-N 1 1 249.741 3.873 20 0 BHADMO Cc1occc1C[N@H+](C)Cc1ccccc1Cl ZINC000055052936 363584223 /nfs/dbraw/zinc/58/42/23/363584223.db2.gz AKTCPHFHWRIPGD-UHFFFAOYSA-N 1 1 249.741 3.873 20 0 BHADMO Cc1occc1C[N@@H+](C)Cc1ccccc1Cl ZINC000055052936 363584216 /nfs/dbraw/zinc/58/42/16/363584216.db2.gz AKTCPHFHWRIPGD-UHFFFAOYSA-N 1 1 249.741 3.873 20 0 BHADMO Cc1occc1C[N@@H+](C)CCCc1ccccc1 ZINC000055054460 363584869 /nfs/dbraw/zinc/58/48/69/363584869.db2.gz CICPWYOBLSLPQG-UHFFFAOYSA-N 1 1 243.350 3.653 20 0 BHADMO Cc1occc1C[N@H+](C)[C@@H](C)c1ccccc1F ZINC000055057687 358880692 /nfs/dbraw/zinc/88/06/92/358880692.db2.gz GXMOWYOMDXQFAV-NSHDSACASA-N 1 1 247.313 3.920 20 0 BHADMO Cc1occc1C[N@@H+](C)[C@@H](C)c1ccccc1F ZINC000055057687 358880689 /nfs/dbraw/zinc/88/06/89/358880689.db2.gz GXMOWYOMDXQFAV-NSHDSACASA-N 1 1 247.313 3.920 20 0 BHADMO Cc1occc1C[N@H+](C)[C@H](C)c1ccccc1F ZINC000055057688 358880383 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ZINC000058723258 640736429 /nfs/dbraw/zinc/73/64/29/640736429.db2.gz SKJLFCRFSROBEZ-UHFFFAOYSA-N 1 1 247.382 3.629 20 0 BHADMO CC[C@@H]1CCC[N@@H+](Cc2cc(C)ccc2OC)C1 ZINC000058773471 368520891 /nfs/dbraw/zinc/52/08/91/368520891.db2.gz XZQZTWDTISQHFB-CQSZACIVSA-N 1 1 247.382 3.626 20 0 BHADMO CC[C@H]1CCC[N@@H+](Cc2cc(C)ccc2OC)C1 ZINC000058773472 368520686 /nfs/dbraw/zinc/52/06/86/368520686.db2.gz XZQZTWDTISQHFB-AWEZNQCLSA-N 1 1 247.382 3.626 20 0 BHADMO CC[C@@H]1CCC[N@@H+](Cc2cccc(Cl)c2)C1 ZINC000058773473 411265422 /nfs/dbraw/zinc/26/54/22/411265422.db2.gz QCVISHPOFVBGOJ-GFCCVEGCSA-N 1 1 237.774 3.962 20 0 BHADMO CC[C@H]1CCC[N@@H+](Cc2cccc(Cl)c2)C1 ZINC000058773474 411265388 /nfs/dbraw/zinc/26/53/88/411265388.db2.gz QCVISHPOFVBGOJ-LBPRGKRZSA-N 1 1 237.774 3.962 20 0 BHADMO CC[C@@H]1CCC[N@@H+](Cc2ccc(Cl)cc2)C1 ZINC000058773477 368521267 /nfs/dbraw/zinc/52/12/67/368521267.db2.gz FPLJLHFIMIIYFQ-GFCCVEGCSA-N 1 1 237.774 3.962 20 0 BHADMO CC[C@H]1CCC[N@@H+](Cc2ccc(Cl)cc2)C1 ZINC000058773478 368521569 /nfs/dbraw/zinc/52/15/69/368521569.db2.gz FPLJLHFIMIIYFQ-LBPRGKRZSA-N 1 1 237.774 3.962 20 0 BHADMO CC[C@@H]1CCC[N@@H+](Cc2ccccc2C)C1 ZINC000058773483 368520725 /nfs/dbraw/zinc/52/07/25/368520725.db2.gz WSOVIJCLWUUSGU-CQSZACIVSA-N 1 1 217.356 3.617 20 0 BHADMO CC[C@H]1CCC[N@@H+](Cc2ccccc2C)C1 ZINC000058773484 368521427 /nfs/dbraw/zinc/52/14/27/368521427.db2.gz WSOVIJCLWUUSGU-AWEZNQCLSA-N 1 1 217.356 3.617 20 0 BHADMO CC[N@@H+](CC=C(C)C)Cc1ccccc1C ZINC000058773510 411265968 /nfs/dbraw/zinc/26/59/68/411265968.db2.gz OEWOFKADTYFPDQ-UHFFFAOYSA-N 1 1 217.356 3.783 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)Cc1cc(C)ccc1OC ZINC000058773593 368520845 /nfs/dbraw/zinc/52/08/45/368520845.db2.gz AOAKQQBITZRRTB-CYBMUJFWSA-N 1 1 235.371 3.624 20 0 BHADMO CCC[C@H](C)[N@@H+](C)Cc1cc(C)ccc1OC ZINC000058773594 368520738 /nfs/dbraw/zinc/52/07/38/368520738.db2.gz AOAKQQBITZRRTB-ZDUSSCGKSA-N 1 1 235.371 3.624 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)Cc1cccc(Cl)c1 ZINC000058773595 368521135 /nfs/dbraw/zinc/52/11/35/368521135.db2.gz AAJILVIWUDXPEH-LLVKDONJSA-N 1 1 225.763 3.960 20 0 BHADMO CCC[C@H](C)[N@@H+](C)Cc1cccc(Cl)c1 ZINC000058773596 368521512 /nfs/dbraw/zinc/52/15/12/368521512.db2.gz AAJILVIWUDXPEH-NSHDSACASA-N 1 1 225.763 3.960 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)Cc1ccc(Cl)cc1 ZINC000058773598 411265555 /nfs/dbraw/zinc/26/55/55/411265555.db2.gz DTLUETQAXNRFCH-LLVKDONJSA-N 1 1 225.763 3.960 20 0 BHADMO CCC[C@H](C)[N@@H+](C)Cc1ccc(Cl)cc1 ZINC000058773600 411265988 /nfs/dbraw/zinc/26/59/88/411265988.db2.gz DTLUETQAXNRFCH-NSHDSACASA-N 1 1 225.763 3.960 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)Cc1ccccc1C ZINC000058773606 368521243 /nfs/dbraw/zinc/52/12/43/368521243.db2.gz RTAHNRXSNXJVBY-CYBMUJFWSA-N 1 1 205.345 3.615 20 0 BHADMO CCC[C@H](C)[N@@H+](C)Cc1ccccc1C ZINC000058773607 368521416 /nfs/dbraw/zinc/52/14/16/368521416.db2.gz RTAHNRXSNXJVBY-ZDUSSCGKSA-N 1 1 205.345 3.615 20 0 BHADMO CC[C@@H]1CCC[N@@H+](CCCc2ccccc2)C1 ZINC000058790657 411277756 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/nfs/dbraw/zinc/75/12/04/384751204.db2.gz JHIIJHILZBJEAX-UHFFFAOYSA-N 1 1 245.753 3.972 20 0 BHADMO C[N@H+](Cc1ccccc1)Cc1ccccc1Cl ZINC000058873975 384751192 /nfs/dbraw/zinc/75/11/92/384751192.db2.gz JHIIJHILZBJEAX-UHFFFAOYSA-N 1 1 245.753 3.972 20 0 BHADMO Cc1ccc(C[N@@H+](C)Cc2ccccc2)cc1 ZINC000058873984 384750425 /nfs/dbraw/zinc/75/04/25/384750425.db2.gz RYSNNTUJVGIRAL-UHFFFAOYSA-N 1 1 225.335 3.627 20 0 BHADMO CC[C@@H]1CCCC[N@H+]1Cc1ccc(C)cc1 ZINC000058874044 351859393 /nfs/dbraw/zinc/85/93/93/351859393.db2.gz IMFUPSDSIIASKV-OAHLLOKOSA-N 1 1 217.356 3.760 20 0 BHADMO CC[C@H]1CCCC[N@H+]1CCOc1ccc(C)cc1 ZINC000058874056 640753513 /nfs/dbraw/zinc/75/35/13/640753513.db2.gz VLYDPLPWVSGSBZ-HNNXBMFYSA-N 1 1 247.382 3.638 20 0 BHADMO CC[C@H]1CCCC[N@H+]1CCOc1ccccc1C ZINC000058874057 640754591 /nfs/dbraw/zinc/75/45/91/640754591.db2.gz CGSGCMHDEJHDNA-HNNXBMFYSA-N 1 1 247.382 3.638 20 0 BHADMO CC[C@@H]1CCCC[N@H+]1Cc1ccc(F)cc1 ZINC000058874218 372107938 /nfs/dbraw/zinc/10/79/38/372107938.db2.gz XDOJPYNMECJMJR-CQSZACIVSA-N 1 1 221.319 3.590 20 0 BHADMO CC[C@H]1CCCC[N@H+]1C/C=C/c1ccccc1 ZINC000058874265 372107800 /nfs/dbraw/zinc/10/78/00/372107800.db2.gz PRYAXGJSOODIES-KXKDPZRNSA-N 1 1 229.367 3.964 20 0 BHADMO Cc1ccc(C)c(C[N@@H+]2CCC[C@H](C)C2)c1 ZINC000058874497 372107579 /nfs/dbraw/zinc/10/75/79/372107579.db2.gz FRSOUMDHIXIXQS-ZDUSSCGKSA-N 1 1 217.356 3.535 20 0 BHADMO CSc1ccc(C[N@H+]2CCC[C@@H](C)C2)cc1 ZINC000058874507 368523157 /nfs/dbraw/zinc/52/31/57/368523157.db2.gz GHPTYCMCZGBONH-GFCCVEGCSA-N 1 1 235.396 3.640 20 0 BHADMO C[C@@H]1C[C@H](C)C[N@H+](C/C=C/c2ccccc2)C1 ZINC000058874695 368524007 /nfs/dbraw/zinc/52/40/07/368524007.db2.gz ZCIKVXANNUXWRW-QHLGLPELSA-N 1 1 229.367 3.678 20 0 BHADMO CCCC[N@@H+](C)Cc1cccc(C(F)(F)F)c1 ZINC000058874739 388389329 /nfs/dbraw/zinc/38/93/29/388389329.db2.gz NSALSNYQPVBJTD-UHFFFAOYSA-N 1 1 245.288 3.937 20 0 BHADMO CCCC[N@@H+](C)Cc1c(F)cccc1Cl ZINC000058874863 351861020 /nfs/dbraw/zinc/86/10/20/351861020.db2.gz XDMFCTBMLBXDNE-UHFFFAOYSA-N 1 1 229.726 3.711 20 0 BHADMO CCCC[N@H+](C)Cc1c(F)cccc1Cl ZINC000058874863 351861015 /nfs/dbraw/zinc/86/10/15/351861015.db2.gz XDMFCTBMLBXDNE-UHFFFAOYSA-N 1 1 229.726 3.711 20 0 BHADMO CCCC[N@@H+](C)Cc1nc2ccccc2s1 ZINC000058874885 387839924 /nfs/dbraw/zinc/83/99/24/387839924.db2.gz UNJDOBZRVZZSAN-UHFFFAOYSA-N 1 1 234.368 3.528 20 0 BHADMO CCCC[N@@H+](C)Cc1cc(C)ccc1C ZINC000058874924 350360606 /nfs/dbraw/zinc/36/06/06/350360606.db2.gz DYNRJYZYBJPPHA-UHFFFAOYSA-N 1 1 205.345 3.535 20 0 BHADMO CSc1ccc(C[N@H+]2CCCC[C@H]2C)cc1 ZINC000058875205 368523605 /nfs/dbraw/zinc/52/36/05/368523605.db2.gz MMEDWDAHYQUSJZ-GFCCVEGCSA-N 1 1 235.396 3.783 20 0 BHADMO Cc1ccc(C)c(C[N@@H+]2CCCC[C@H]2C)c1 ZINC000058875304 372104797 /nfs/dbraw/zinc/10/47/97/372104797.db2.gz RNEBXTVXNJUEMK-CQSZACIVSA-N 1 1 217.356 3.678 20 0 BHADMO C[C@H]1CCCC[N@H+]1C/C=C/c1ccccc1 ZINC000058875306 353422620 /nfs/dbraw/zinc/42/26/20/353422620.db2.gz RNGWPMMLFFDXJJ-OIOXUXFSSA-N 1 1 215.340 3.574 20 0 BHADMO C[C@@H]1CCCC[N@H+]1Cc1nc2ccccc2s1 ZINC000058875445 351865062 /nfs/dbraw/zinc/86/50/62/351865062.db2.gz BNZVOEGKOGMJLM-LLVKDONJSA-N 1 1 246.379 3.671 20 0 BHADMO Cc1ccccc1C[N@@H+](C)Cc1ccc(F)cc1 ZINC000058876689 368523921 /nfs/dbraw/zinc/52/39/21/368523921.db2.gz OOFGEGJVYIZOAA-UHFFFAOYSA-N 1 1 243.325 3.766 20 0 BHADMO Cc1ccc(C)c(C[N@@H+](C)Cc2cccs2)c1 ZINC000058886642 372110229 /nfs/dbraw/zinc/11/02/29/372110229.db2.gz SKLFEWKKXLVUPK-UHFFFAOYSA-N 1 1 245.391 3.997 20 0 BHADMO C[N@@H+](C/C=C/c1ccccc1)Cc1cccs1 ZINC000058886649 398202205 /nfs/dbraw/zinc/20/22/05/398202205.db2.gz LIUSBRCZEHUEFC-WEVVVXLNSA-N 1 1 243.375 3.893 20 0 BHADMO Cc1ccc(C[N@H+](C)Cc2ccc(F)cc2)cc1 ZINC000058887156 368524861 /nfs/dbraw/zinc/52/48/61/368524861.db2.gz HJKXPPROSVFBDG-UHFFFAOYSA-N 1 1 243.325 3.766 20 0 BHADMO Cc1ccc(C[N@H+](C)Cc2cc(C)ccc2C)o1 ZINC000058888774 368524598 /nfs/dbraw/zinc/52/45/98/368524598.db2.gz QTJQPOHZISOZHE-UHFFFAOYSA-N 1 1 243.350 3.837 20 0 BHADMO C[C@@H]1CCC[N@@H+](CCc2ccccc2Cl)C1 ZINC000058905653 368525069 /nfs/dbraw/zinc/52/50/69/368525069.db2.gz QZQOCTVZOMQBOM-GFCCVEGCSA-N 1 1 237.774 3.614 20 0 BHADMO C[C@H]1CCCC[N@H+]1CCc1ccccc1Cl ZINC000058905711 368524671 /nfs/dbraw/zinc/52/46/71/368524671.db2.gz QYFIXNULRPEXRR-LBPRGKRZSA-N 1 1 237.774 3.757 20 0 BHADMO CCCC[N@@H+](C)CCc1ccccc1Cl ZINC000058906342 368525156 /nfs/dbraw/zinc/52/51/56/368525156.db2.gz SSGHDZHVOVKRLU-UHFFFAOYSA-N 1 1 225.763 3.614 20 0 BHADMO CC(C)[N@@H+](CCc1ccccc1Cl)C1CC1 ZINC000058907252 372113002 /nfs/dbraw/zinc/11/30/02/372113002.db2.gz KSSFJYLJLFLQFN-UHFFFAOYSA-N 1 1 237.774 3.755 20 0 BHADMO CC(C)CC[N@@H+](C)CCc1ccccc1Cl ZINC000058908441 369018507 /nfs/dbraw/zinc/01/85/07/369018507.db2.gz BBERVJKXCZGJPL-UHFFFAOYSA-N 1 1 239.790 3.860 20 0 BHADMO C[C@@H](C1CC1)[N@@H+](C)CCc1ccccc1Cl ZINC000058922753 368525532 /nfs/dbraw/zinc/52/55/32/368525532.db2.gz MCIUZLAHGOFEAU-NSHDSACASA-N 1 1 237.774 3.613 20 0 BHADMO CC[N@@H+](Cc1cccc(C)c1)C1CCCC1 ZINC000059038281 368530148 /nfs/dbraw/zinc/53/01/48/368530148.db2.gz SVPADNLHDCVXEU-UHFFFAOYSA-N 1 1 217.356 3.760 20 0 BHADMO Cc1cc([NH2+]C[C@@H]2CCCC[C@@H]2C)ccc1N ZINC000059040739 178164179 /nfs/dbraw/zinc/16/41/79/178164179.db2.gz MAKRIKBOYAAVLJ-AAEUAGOBSA-N 1 1 232.371 3.815 20 0 BHADMO Cc1cc([NH2+]C[C@H]2CCCC[C@@H]2C)ccc1N ZINC000059040741 178168669 /nfs/dbraw/zinc/16/86/69/178168669.db2.gz MAKRIKBOYAAVLJ-WCQYABFASA-N 1 1 232.371 3.815 20 0 BHADMO Cc1cc([NH2+]C[C@@H]2CCCC[C@H]2C)ccc1N ZINC000059040742 178164832 /nfs/dbraw/zinc/16/48/32/178164832.db2.gz MAKRIKBOYAAVLJ-YPMHNXCESA-N 1 1 232.371 3.815 20 0 BHADMO Cc1cc([NH2+]C[C@H]2CCCC[C@H]2C)ccc1N ZINC000059040744 178168254 /nfs/dbraw/zinc/16/82/54/178168254.db2.gz MAKRIKBOYAAVLJ-DGCLKSJQSA-N 1 1 232.371 3.815 20 0 BHADMO CCCCC[N@@H+](CC)Cc1ccccc1 ZINC000059654346 488169640 /nfs/dbraw/zinc/16/96/40/488169640.db2.gz KTPFRNPPJARMEA-UHFFFAOYSA-N 1 1 205.345 3.699 20 0 BHADMO Cc1ccc(C[N@H+]2CCc3ccsc3C2)cc1 ZINC000060194051 349512620 /nfs/dbraw/zinc/51/26/20/349512620.db2.gz PKFQAMHYMPDQEQ-UHFFFAOYSA-N 1 1 243.375 3.615 20 0 BHADMO CC[N@@H+](Cc1cccc(O)c1)C1CCCCC1 ZINC000060201668 360175024 /nfs/dbraw/zinc/17/50/24/360175024.db2.gz SPJNTBXYHQDPGH-UHFFFAOYSA-N 1 1 233.355 3.547 20 0 BHADMO CC[N@@H+](Cc1ccc(O)cc1)C1CCCCC1 ZINC000060201829 369467133 /nfs/dbraw/zinc/46/71/33/369467133.db2.gz QNLKGIRMRGKOBA-UHFFFAOYSA-N 1 1 233.355 3.547 20 0 BHADMO CCCC[N@@H+]1CC=C(c2ccc(F)cc2)CC1 ZINC000060217769 411434314 /nfs/dbraw/zinc/43/43/14/411434314.db2.gz VJERDDSTLLSQIF-UHFFFAOYSA-N 1 1 233.330 3.715 20 0 BHADMO CC[C@@H](c1ccccc1)[N@H+]1CCC[C@H](C)C1 ZINC000060218168 343095199 /nfs/dbraw/zinc/09/51/99/343095199.db2.gz GYFLAYWBAXMINE-ZFWWWQNUSA-N 1 1 217.356 3.870 20 0 BHADMO CC[C@H](c1ccccc1)[N@H+]1CCC[C@H](C)C1 ZINC000060218170 343095119 /nfs/dbraw/zinc/09/51/19/343095119.db2.gz GYFLAYWBAXMINE-DZGCQCFKSA-N 1 1 217.356 3.870 20 0 BHADMO C[C@H](c1ccc(F)c(F)c1)[N@H+]1CCC[C@@H](C)C1 ZINC000060460134 368543679 /nfs/dbraw/zinc/54/36/79/368543679.db2.gz QLCDFYXQVOAWJC-GHMZBOCLSA-N 1 1 239.309 3.758 20 0 BHADMO CCC[N@@H+](CCOC(C)C)CC1CCCCC1 ZINC000060495553 360477678 /nfs/dbraw/zinc/47/76/78/360477678.db2.gz UALUZFBQVDGUOG-UHFFFAOYSA-N 1 1 241.419 3.704 20 0 BHADMO Fc1ccccc1C[N@@H+](C1CC1)C1CCCC1 ZINC000060562497 369494183 /nfs/dbraw/zinc/49/41/83/369494183.db2.gz JFLVUXRVTVXYHD-UHFFFAOYSA-N 1 1 233.330 3.733 20 0 BHADMO Cc1cccc(C[N@@H+](C2CC2)C2CCCC2)c1 ZINC000060562598 368547467 /nfs/dbraw/zinc/54/74/67/368547467.db2.gz CDJVHYPWWLCGIZ-UHFFFAOYSA-N 1 1 229.367 3.902 20 0 BHADMO C(C1CCCCC1)[N@@H+](C1CC1)C1CCCC1 ZINC000060562675 369494286 /nfs/dbraw/zinc/49/42/86/369494286.db2.gz CQTBMEVCDGEUST-UHFFFAOYSA-N 1 1 221.388 3.974 20 0 BHADMO Cc1ccccc1C[N@@H+](C1CC1)C1CCCC1 ZINC000060562678 369493486 /nfs/dbraw/zinc/49/34/86/369493486.db2.gz NNRUHJIHAXSNNR-UHFFFAOYSA-N 1 1 229.367 3.902 20 0 BHADMO Fc1cccc(C[N@@H+](C2CC2)C2CCCC2)c1 ZINC000060562749 387509555 /nfs/dbraw/zinc/50/95/55/387509555.db2.gz ZANUYASNNDVNQX-UHFFFAOYSA-N 1 1 233.330 3.733 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1ncc(-c2ccccc2)o1 ZINC000060575193 368547005 /nfs/dbraw/zinc/54/70/05/368547005.db2.gz QJAMBQCQFQFZAG-LBPRGKRZSA-N 1 1 244.338 3.572 20 0 BHADMO CC[C@@H](C)[N@@H+](C)Cc1cc(-c2ccccc2)no1 ZINC000060575357 368547592 /nfs/dbraw/zinc/54/75/92/368547592.db2.gz QYOVLLJMPQIWBR-GFCCVEGCSA-N 1 1 244.338 3.572 20 0 BHADMO C[C@H]1CCC[N@H+]([C@H]2CCCc3ccccc32)C1 ZINC000060755251 369525807 /nfs/dbraw/zinc/52/58/07/369525807.db2.gz PBIMSZKHFCHKJN-BBRMVZONSA-N 1 1 229.367 3.796 20 0 BHADMO C[N@@H+](Cc1ccco1)[C@@H]1CCCc2ccccc21 ZINC000060755324 324047519 /nfs/dbraw/zinc/04/75/19/324047519.db2.gz NTBTWKISDMPBNO-MRXNPFEDSA-N 1 1 241.334 3.789 20 0 BHADMO CC[C@@H](c1ccccc1)[N@@H+](C)Cc1cscn1 ZINC000060876768 324051762 /nfs/dbraw/zinc/05/17/62/324051762.db2.gz PXSUQFPTCDNRBY-AWEZNQCLSA-N 1 1 246.379 3.726 20 0 BHADMO CC[C@@H](c1ccccc1)[N@H+](C)Cc1cscn1 ZINC000060876768 324051760 /nfs/dbraw/zinc/05/17/60/324051760.db2.gz PXSUQFPTCDNRBY-AWEZNQCLSA-N 1 1 246.379 3.726 20 0 BHADMO CC[C@@H](c1ccccc1)[N@H+]1C[C@@H](C)OC(C)(C)C1 ZINC000060876784 344461738 /nfs/dbraw/zinc/46/17/38/344461738.db2.gz XTPORUWDGMFMBL-HIFRSBDPSA-N 1 1 247.382 3.637 20 0 BHADMO CC(C)(C)C[C@@H]1CCC[N@H+]1CCOC(C)(C)C ZINC000060876913 368555216 /nfs/dbraw/zinc/55/52/16/368555216.db2.gz VFLNYPDWTWARCB-ZDUSSCGKSA-N 1 1 241.419 3.702 20 0 BHADMO CC(C)=CC[N@H+]1CCC[C@H]1CC(C)(C)C ZINC000060877287 368555222 /nfs/dbraw/zinc/55/52/22/368555222.db2.gz BLYJEUCGGUULDM-ZDUSSCGKSA-N 1 1 209.377 3.853 20 0 BHADMO CCC[N@H+]1CCC[C@H]1c1ccc(C)cc1 ZINC000060958600 411439869 /nfs/dbraw/zinc/43/98/69/411439869.db2.gz FVLRKBDRXBBHJO-AWEZNQCLSA-N 1 1 203.329 3.542 20 0 BHADMO CCCC[N@H+]1CCC[C@H]1c1ccc(C)cc1 ZINC000060958895 368556818 /nfs/dbraw/zinc/55/68/18/368556818.db2.gz JXPMPEZNQVZPTD-HNNXBMFYSA-N 1 1 217.356 3.932 20 0 BHADMO CCCC[N@H+]1CCC[C@@H]1c1cccc(OC)c1 ZINC000060960384 368557343 /nfs/dbraw/zinc/55/73/43/368557343.db2.gz STSOEHYOZRJBLY-OAHLLOKOSA-N 1 1 233.355 3.632 20 0 BHADMO C[N@@H+](CC1CCCC1)CC1CCCCC1 ZINC000060960986 411439736 /nfs/dbraw/zinc/43/97/36/411439736.db2.gz YUHKVBWEDSFLJK-UHFFFAOYSA-N 1 1 209.377 3.689 20 0 BHADMO CCC[N@@H+](C)Cc1cccc(Cl)c1Cl ZINC000060961071 411439740 /nfs/dbraw/zinc/43/97/40/411439740.db2.gz APOOJIGMVVAFDU-UHFFFAOYSA-N 1 1 232.154 3.835 20 0 BHADMO C[N@H+](Cc1ccccc1Cl)CC1CCCC1 ZINC000060961091 411439781 /nfs/dbraw/zinc/43/97/81/411439781.db2.gz UDPGRUJSXJCWJU-UHFFFAOYSA-N 1 1 237.774 3.962 20 0 BHADMO Cc1ccccc1C[N@@H+](C)CC1CCCC1 ZINC000060961355 343721821 /nfs/dbraw/zinc/72/18/21/343721821.db2.gz CQENAZAVXXXPJU-UHFFFAOYSA-N 1 1 217.356 3.617 20 0 BHADMO CC[N@H+](Cc1cccs1)CC1CCCC1 ZINC000060961730 368557117 /nfs/dbraw/zinc/55/71/17/368557117.db2.gz KIRMHKOEYLFRHQ-UHFFFAOYSA-N 1 1 223.385 3.760 20 0 BHADMO CCC[N@@H+](C)Cc1ccc(Cl)cc1Cl ZINC000060972553 368556741 /nfs/dbraw/zinc/55/67/41/368556741.db2.gz FTSXYIKVUQBCCY-UHFFFAOYSA-N 1 1 232.154 3.835 20 0 BHADMO c1ccc(C[C@@H]2CCC[N@@H+]2CC2CCCC2)cc1 ZINC000060974458 368557065 /nfs/dbraw/zinc/55/70/65/368557065.db2.gz VFKJNSRAPHYZKH-KRWDZBQOSA-N 1 1 243.394 3.884 20 0 BHADMO CCC[N@@H+](C)Cc1ccc2ccccc2c1 ZINC000060975894 368557392 /nfs/dbraw/zinc/55/73/92/368557392.db2.gz TWGOKLSGRWXFEV-UHFFFAOYSA-N 1 1 213.324 3.682 20 0 BHADMO COc1ccc(C)cc1C[N@@H+](C)CC1CCCC1 ZINC000060975939 368556900 /nfs/dbraw/zinc/55/69/00/368556900.db2.gz JOSBYCFLZBFHCQ-UHFFFAOYSA-N 1 1 247.382 3.626 20 0 BHADMO CCC[N@@H+](Cc1c(F)cccc1Cl)C1CC1 ZINC000060976044 368557283 /nfs/dbraw/zinc/55/72/83/368557283.db2.gz ZPDQGXOAUDQXMO-UHFFFAOYSA-N 1 1 241.737 3.854 20 0 BHADMO CCC[N@H+](Cc1c(F)cccc1Cl)C1CC1 ZINC000060976044 368557279 /nfs/dbraw/zinc/55/72/79/368557279.db2.gz ZPDQGXOAUDQXMO-UHFFFAOYSA-N 1 1 241.737 3.854 20 0 BHADMO C[N@@H+](CCCOc1ccccc1)CC1CCCC1 ZINC000060976358 368556795 /nfs/dbraw/zinc/55/67/95/368556795.db2.gz YNPGCELRYXKREN-UHFFFAOYSA-N 1 1 247.382 3.578 20 0 BHADMO CCC[N@@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000060976537 640906729 /nfs/dbraw/zinc/90/67/29/640906729.db2.gz YVRLZQRAJJEVSB-UHFFFAOYSA-N 1 1 246.398 3.519 20 0 BHADMO Cc1ccc(C[N@@H+](C)CC2CCCC2)cc1 ZINC000060977180 368556995 /nfs/dbraw/zinc/55/69/95/368556995.db2.gz SRFVELFKEOIYQG-UHFFFAOYSA-N 1 1 217.356 3.617 20 0 BHADMO CCC[N@@H+](C)Cc1ccc(C(C)(C)C)cc1 ZINC000060977323 368557202 /nfs/dbraw/zinc/55/72/02/368557202.db2.gz BGFUCVLUBCVGJN-UHFFFAOYSA-N 1 1 219.372 3.826 20 0 BHADMO CCC[N@@H+](Cc1ccccc1)[C@H](C)CC ZINC000060977814 368557303 /nfs/dbraw/zinc/55/73/03/368557303.db2.gz RLSHUGJOTXIMSU-CYBMUJFWSA-N 1 1 205.345 3.697 20 0 BHADMO C[N@H+](Cc1cccc(Cl)c1)CC1CCCC1 ZINC000060977891 411441282 /nfs/dbraw/zinc/44/12/82/411441282.db2.gz VJUSWKSTKAJANU-UHFFFAOYSA-N 1 1 237.774 3.962 20 0 BHADMO CCC[N@@H+](C)Cc1ccc(Cl)c(Cl)c1 ZINC000060977893 368556589 /nfs/dbraw/zinc/55/65/89/368556589.db2.gz KKHXCJSKDKRVDC-UHFFFAOYSA-N 1 1 232.154 3.835 20 0 BHADMO C[N@H+](Cc1ccc(Cl)cc1)CC1CCCC1 ZINC000060978310 411440769 /nfs/dbraw/zinc/44/07/69/411440769.db2.gz SHGCKPSMWDTBBK-UHFFFAOYSA-N 1 1 237.774 3.962 20 0 BHADMO CCC[N@@H+](C)Cc1ccc(C(C)C)cc1 ZINC000060978313 368557126 /nfs/dbraw/zinc/55/71/26/368557126.db2.gz JTYUBYOYRRZXFW-UHFFFAOYSA-N 1 1 205.345 3.652 20 0 BHADMO CCC[N@@H+](CC)Cc1ccccc1Cl ZINC000060979414 368556937 /nfs/dbraw/zinc/55/69/37/368556937.db2.gz NKLXEBDJAHKNQU-UHFFFAOYSA-N 1 1 211.736 3.572 20 0 BHADMO CCC[N@@H+](Cc1ccc(CC)cc1)C1CC1 ZINC000060979533 411504310 /nfs/dbraw/zinc/50/43/10/411504310.db2.gz TVCUAGFULGARLQ-UHFFFAOYSA-N 1 1 217.356 3.623 20 0 BHADMO C[N@@H+](CCCc1ccccc1)CC1CCCC1 ZINC000060997084 368557737 /nfs/dbraw/zinc/55/77/37/368557737.db2.gz KGTPSUSARFTFFZ-UHFFFAOYSA-N 1 1 231.383 3.741 20 0 BHADMO CCCCOCC[N@H+]1CCC[C@H]1CC(C)(C)C ZINC000061039954 368557778 /nfs/dbraw/zinc/55/77/78/368557778.db2.gz JHHBDTVCWGNOCX-AWEZNQCLSA-N 1 1 241.419 3.704 20 0 BHADMO C=C(Cl)C[N@@H+]1CCC[C@H]1CC(C)(C)C ZINC000061039975 640911963 /nfs/dbraw/zinc/91/19/63/640911963.db2.gz NFXUEVCSDFQNRS-NSHDSACASA-N 1 1 215.768 3.640 20 0 BHADMO CC(C)(C)C[C@H]1CCC[N@H+]1C/C=C/Cl ZINC000061040031 640912087 /nfs/dbraw/zinc/91/20/87/640912087.db2.gz PEVVAVHSJUPMTE-OKPNEXGHSA-N 1 1 215.768 3.640 20 0 BHADMO CCC[N@@H+](Cc1ccccc1)[C@@H](C)C1CC1 ZINC000061110630 411505562 /nfs/dbraw/zinc/50/55/62/411505562.db2.gz TVFZDBAKBMBANG-ZDUSSCGKSA-N 1 1 217.356 3.697 20 0 BHADMO CC(C)C[N@@H+](Cc1ccccc1)[C@@H](C)C1CC1 ZINC000061111405 411151490 /nfs/dbraw/zinc/15/14/90/411151490.db2.gz WJOVNOPCPZFSHL-AWEZNQCLSA-N 1 1 231.383 3.943 20 0 BHADMO c1ccc(C[N@@H+](C2CC2)C2CCCCC2)cc1 ZINC000061163071 411153574 /nfs/dbraw/zinc/15/35/74/411153574.db2.gz SSHHZBNKAUJMAW-UHFFFAOYSA-N 1 1 229.367 3.984 20 0 BHADMO Cc1cccc(C)c1OCC[N@H+](C(C)C)C1CC1 ZINC000061164727 360596029 /nfs/dbraw/zinc/59/60/29/360596029.db2.gz BCHICSTYZMJORY-UHFFFAOYSA-N 1 1 247.382 3.555 20 0 BHADMO Cc1cc(C)cc(C[N@H+](C(C)C)C2CC2)c1 ZINC000061165849 368559859 /nfs/dbraw/zinc/55/98/59/368559859.db2.gz PKTUYBNZMIFTHM-UHFFFAOYSA-N 1 1 217.356 3.676 20 0 BHADMO CC(C)c1nc(C[N@H+](C(C)C)C2CC2)cs1 ZINC000061165944 324059606 /nfs/dbraw/zinc/05/96/06/324059606.db2.gz UVJXJCNWQAPGSW-UHFFFAOYSA-N 1 1 238.400 3.639 20 0 BHADMO CC(C)c1nc(C[N@@H+](C(C)C)C2CC2)cs1 ZINC000061165944 324059602 /nfs/dbraw/zinc/05/96/02/324059602.db2.gz UVJXJCNWQAPGSW-UHFFFAOYSA-N 1 1 238.400 3.639 20 0 BHADMO CC(C)[N@@H+](C/C=C/c1ccccc1)C1CC1 ZINC000061166339 324059356 /nfs/dbraw/zinc/05/93/56/324059356.db2.gz PLJIESQHUGDEGS-RMKNXTFCSA-N 1 1 215.340 3.573 20 0 BHADMO COc1cccc(C[N@@H+]([C@H](C)C(C)C)C2CC2)c1 ZINC000061185455 368560772 /nfs/dbraw/zinc/56/07/72/368560772.db2.gz SXXVNRQUQHADQH-CYBMUJFWSA-N 1 1 247.382 3.704 20 0 BHADMO CCC[N@@H+](CC)Cc1cccc(Cl)c1 ZINC000061253789 368560500 /nfs/dbraw/zinc/56/05/00/368560500.db2.gz RTGMXQRILQVEPU-UHFFFAOYSA-N 1 1 211.736 3.572 20 0 BHADMO CC[N@@H+](C/C=C/Cl)Cc1cccc(Cl)c1 ZINC000061254165 640943283 /nfs/dbraw/zinc/94/32/83/640943283.db2.gz MAHWVPGOCLGIKD-QPJJXVBHSA-N 1 1 244.165 3.914 20 0 BHADMO 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/nfs/dbraw/zinc/58/50/70/370585070.db2.gz XIBNDBSLNDOJKN-LBPRGKRZSA-N 1 1 221.369 3.597 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@@H]2C=CCCC2)s1 ZINC000066498360 370584916 /nfs/dbraw/zinc/58/49/16/370584916.db2.gz XIBNDBSLNDOJKN-GFCCVEGCSA-N 1 1 221.369 3.597 20 0 BHADMO c1cc2c(s1)CCC[N@H+]([C@H]1C=CCCC1)C2 ZINC000066539757 370586187 /nfs/dbraw/zinc/58/61/87/370586187.db2.gz FXEQNIODGKDCQF-ZDUSSCGKSA-N 1 1 233.380 3.605 20 0 BHADMO c1cc2c(s1)CCC[N@H+]([C@@H]1C=CCCC1)C2 ZINC000066539760 370586566 /nfs/dbraw/zinc/58/65/66/370586566.db2.gz FXEQNIODGKDCQF-CYBMUJFWSA-N 1 1 233.380 3.605 20 0 BHADMO CCC[N@@H+](C)[C@@H](c1ccccc1)c1ccccn1 ZINC000066541401 169087105 /nfs/dbraw/zinc/08/71/05/169087105.db2.gz MGVNUXDDXYDFOE-INIZCTEOSA-N 1 1 240.350 3.513 20 0 BHADMO CCC[N@@H+](C)[C@H](c1ccccc1)c1ccccn1 ZINC000066541403 169088214 /nfs/dbraw/zinc/08/82/14/169088214.db2.gz MGVNUXDDXYDFOE-MRXNPFEDSA-N 1 1 240.350 3.513 20 0 BHADMO C[N@@H+](Cc1ccco1)Cc1ccc(Cl)s1 ZINC000066564450 368653906 /nfs/dbraw/zinc/65/39/06/368653906.db2.gz MMINROJCEFFVNW-UHFFFAOYSA-N 1 1 241.743 3.627 20 0 BHADMO C[N@H+](Cc1ccco1)Cc1ccc(Cl)s1 ZINC000066564450 368653903 /nfs/dbraw/zinc/65/39/03/368653903.db2.gz MMINROJCEFFVNW-UHFFFAOYSA-N 1 1 241.743 3.627 20 0 BHADMO C[C@@H](C[N@@H+](C)CCOC(C)(C)C)c1ccccc1 ZINC000066853329 368663017 /nfs/dbraw/zinc/66/30/17/368663017.db2.gz XDKOZYGTEHECJI-AWEZNQCLSA-N 1 1 249.398 3.537 20 0 BHADMO C[C@H](C[N@@H+](C)CCOC(C)(C)C)c1ccccc1 ZINC000066853330 368663049 /nfs/dbraw/zinc/66/30/49/368663049.db2.gz XDKOZYGTEHECJI-CQSZACIVSA-N 1 1 249.398 3.537 20 0 BHADMO CCCC[N@@H+](C)Cc1coc(-c2ccccc2)n1 ZINC000066861684 383896202 /nfs/dbraw/zinc/89/62/02/383896202.db2.gz FEEHUCDTSMPJQK-UHFFFAOYSA-N 1 1 244.338 3.574 20 0 BHADMO Cc1occc1C[NH2+]Cc1ccc([C@@H]2C[C@@H]2C)o1 ZINC000067217870 361989499 /nfs/dbraw/zinc/98/94/99/361989499.db2.gz ZQFFUTACTSRCMI-IINYFYTJSA-N 1 1 245.322 3.594 20 0 BHADMO Cc1occc1C[NH2+]Cc1ccc([C@H]2C[C@@H]2C)o1 ZINC000067217871 349882116 /nfs/dbraw/zinc/88/21/16/349882116.db2.gz ZQFFUTACTSRCMI-HZMBPMFUSA-N 1 1 245.322 3.594 20 0 BHADMO Cc1occc1C[NH2+]Cc1ccc([C@@H]2C[C@H]2C)o1 ZINC000067217873 349882432 /nfs/dbraw/zinc/88/24/32/349882432.db2.gz ZQFFUTACTSRCMI-QMTHXVAHSA-N 1 1 245.322 3.594 20 0 BHADMO Cc1occc1C[NH2+]Cc1ccc([C@H]2C[C@H]2C)o1 ZINC000067217874 349882475 /nfs/dbraw/zinc/88/24/75/349882475.db2.gz ZQFFUTACTSRCMI-YGRLFVJLSA-N 1 1 245.322 3.594 20 0 BHADMO Cc1occc1C[NH2+]Cc1ccccc1Cl ZINC000067218043 368680974 /nfs/dbraw/zinc/68/09/74/368680974.db2.gz MEQOGZYIWIMOSD-UHFFFAOYSA-N 1 1 235.714 3.531 20 0 BHADMO CCCC[N@@H+](C)Cc1cccc(OC(F)F)c1 ZINC000067462622 388734187 /nfs/dbraw/zinc/73/41/87/388734187.db2.gz IGIRBCFTBPSSGL-UHFFFAOYSA-N 1 1 243.297 3.520 20 0 BHADMO CCCC[N@@H+](CCCCOC)Cc1ccccc1 ZINC000067462644 370671732 /nfs/dbraw/zinc/67/17/32/370671732.db2.gz LOTGRQLJFOOXQV-UHFFFAOYSA-N 1 1 249.398 3.715 20 0 BHADMO CC[N@@H+](Cc1nc2ccccc2o1)[C@H](C)C(C)C ZINC000067661280 388737968 /nfs/dbraw/zinc/73/79/68/388737968.db2.gz SPHFJTRUZIQHMN-GFCCVEGCSA-N 1 1 246.354 3.694 20 0 BHADMO CC(C)(C)OCC[N@H+]1CCC[C@@H]1c1ccccc1 ZINC000067716093 385219867 /nfs/dbraw/zinc/21/98/67/385219867.db2.gz FLAXRQMUDSIUAK-OAHLLOKOSA-N 1 1 247.382 3.639 20 0 BHADMO CC(C)(C)OCC[N@H+]1CCC[C@H]1c1ccccc1 ZINC000067716094 385217924 /nfs/dbraw/zinc/21/79/24/385217924.db2.gz FLAXRQMUDSIUAK-HNNXBMFYSA-N 1 1 247.382 3.639 20 0 BHADMO C[C@@H](c1cccs1)[N@@H+](C)CCOC(C)(C)C ZINC000067716678 388738748 /nfs/dbraw/zinc/73/87/48/388738748.db2.gz FWICEJRNIATMON-NSHDSACASA-N 1 1 241.400 3.556 20 0 BHADMO C[C@H](c1cccs1)[N@@H+](C)CCOC(C)(C)C ZINC000067716679 388738509 /nfs/dbraw/zinc/73/85/09/388738509.db2.gz FWICEJRNIATMON-LLVKDONJSA-N 1 1 241.400 3.556 20 0 BHADMO CC[C@@H](C)[N@@H+](C)Cc1nc2ccccc2s1 ZINC000068449653 383994668 /nfs/dbraw/zinc/99/46/68/383994668.db2.gz SMZUSPVAHPOEQW-SNVBAGLBSA-N 1 1 234.368 3.527 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1nc2ccccc2s1 ZINC000068449656 171310096 /nfs/dbraw/zinc/31/00/96/171310096.db2.gz SMZUSPVAHPOEQW-JTQLQIEISA-N 1 1 234.368 3.527 20 0 BHADMO CC[C@@H](C)[N@@H+](C)Cc1ccc(F)c2cccnc12 ZINC000068451146 350253920 /nfs/dbraw/zinc/25/39/20/350253920.db2.gz KFQWCRRJSIWJBV-LLVKDONJSA-N 1 1 246.329 3.604 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1ccc(F)c2cccnc12 ZINC000068451148 350253936 /nfs/dbraw/zinc/25/39/36/350253936.db2.gz KFQWCRRJSIWJBV-NSHDSACASA-N 1 1 246.329 3.604 20 0 BHADMO Cc1cccc(N[C@@H](C)CCC(C)C)[nH+]1 ZINC000068945076 179152856 /nfs/dbraw/zinc/15/28/56/179152856.db2.gz ITMABVZLQYMWLJ-LBPRGKRZSA-N 1 1 206.333 3.627 20 0 BHADMO Cc1cccc(N[C@H](C)CCC(C)C)[nH+]1 ZINC000068945078 179156631 /nfs/dbraw/zinc/15/66/31/179156631.db2.gz ITMABVZLQYMWLJ-GFCCVEGCSA-N 1 1 206.333 3.627 20 0 BHADMO Cc1cc[nH+]c(N[C@@H](C)CCC(C)C)c1 ZINC000068945084 385229022 /nfs/dbraw/zinc/22/90/22/385229022.db2.gz KADUSFVDYOXMOH-LBPRGKRZSA-N 1 1 206.333 3.627 20 0 BHADMO Cc1cc[nH+]c(N[C@H](C)CCC(C)C)c1 ZINC000068945086 385228726 /nfs/dbraw/zinc/22/87/26/385228726.db2.gz KADUSFVDYOXMOH-GFCCVEGCSA-N 1 1 206.333 3.627 20 0 BHADMO Cc1ccc(N[C@@H](C)CCC(C)C)[nH+]c1 ZINC000068945163 388814697 /nfs/dbraw/zinc/81/46/97/388814697.db2.gz BUAHTZPBMQWRJE-LBPRGKRZSA-N 1 1 206.333 3.627 20 0 BHADMO Cc1ccc(N[C@H](C)CCC(C)C)[nH+]c1 ZINC000068945164 324914053 /nfs/dbraw/zinc/91/40/53/324914053.db2.gz BUAHTZPBMQWRJE-GFCCVEGCSA-N 1 1 206.333 3.627 20 0 BHADMO Clc1ccc(C[NH2+]C2(c3ccccc3)CC2)o1 ZINC000068979933 362481234 /nfs/dbraw/zinc/48/12/34/362481234.db2.gz NFKIEFUHYMIWAJ-UHFFFAOYSA-N 1 1 247.725 3.712 20 0 BHADMO CC[N@@H+](Cc1ccco1)Cc1ccc(C)s1 ZINC000069003672 323087619 /nfs/dbraw/zinc/08/76/19/323087619.db2.gz JKKMJISETUWUAS-UHFFFAOYSA-N 1 1 235.352 3.672 20 0 BHADMO C[C@@H](c1ccco1)[N@@H+](C)Cc1ccc(F)cc1 ZINC000069065618 176031497 /nfs/dbraw/zinc/03/14/97/176031497.db2.gz ZRHKXGKTYBYBCH-NSHDSACASA-N 1 1 233.286 3.612 20 0 BHADMO C[C@H](c1ccco1)[N@@H+](C)Cc1ccc(F)cc1 ZINC000069065621 177048107 /nfs/dbraw/zinc/04/81/07/177048107.db2.gz ZRHKXGKTYBYBCH-LLVKDONJSA-N 1 1 233.286 3.612 20 0 BHADMO C[C@@H](c1ccco1)[N@@H+](C)Cc1ccccc1F ZINC000069065623 176031668 /nfs/dbraw/zinc/03/16/68/176031668.db2.gz WNJXQPIVGSXOTQ-NSHDSACASA-N 1 1 233.286 3.612 20 0 BHADMO C[C@@H](c1ccco1)[N@H+](C)Cc1ccccc1F ZINC000069065623 176031667 /nfs/dbraw/zinc/03/16/67/176031667.db2.gz WNJXQPIVGSXOTQ-NSHDSACASA-N 1 1 233.286 3.612 20 0 BHADMO C[C@H](c1ccco1)[N@@H+](C)Cc1ccccc1F ZINC000069065627 177048255 /nfs/dbraw/zinc/04/82/55/177048255.db2.gz WNJXQPIVGSXOTQ-LLVKDONJSA-N 1 1 233.286 3.612 20 0 BHADMO C[C@H](c1ccco1)[N@H+](C)Cc1ccccc1F ZINC000069065627 177048253 /nfs/dbraw/zinc/04/82/53/177048253.db2.gz WNJXQPIVGSXOTQ-LLVKDONJSA-N 1 1 233.286 3.612 20 0 BHADMO C[C@@H](c1ccco1)[N@@H+](C)CCCc1ccccc1 ZINC000069067323 388822050 /nfs/dbraw/zinc/82/20/50/388822050.db2.gz QSZAQGSNKBVATG-AWEZNQCLSA-N 1 1 243.350 3.905 20 0 BHADMO C[C@H](c1ccco1)[N@@H+](C)CCCc1ccccc1 ZINC000069067324 388821383 /nfs/dbraw/zinc/82/13/83/388821383.db2.gz QSZAQGSNKBVATG-CQSZACIVSA-N 1 1 243.350 3.905 20 0 BHADMO Cc1ccccc1C[N@H+](C)[C@@H](C)c1ccco1 ZINC000069067443 388823027 /nfs/dbraw/zinc/82/30/27/388823027.db2.gz WWAHFWONNMSWFI-ZDUSSCGKSA-N 1 1 229.323 3.781 20 0 BHADMO Cc1ccccc1C[N@H+](C)[C@H](C)c1ccco1 ZINC000069067446 388822097 /nfs/dbraw/zinc/82/20/97/388822097.db2.gz WWAHFWONNMSWFI-CYBMUJFWSA-N 1 1 229.323 3.781 20 0 BHADMO Cc1cccc(C[N@H+](C)[C@@H](C)c2ccco2)c1 ZINC000069068131 179068461 /nfs/dbraw/zinc/06/84/61/179068461.db2.gz DCEBVWKPKXIWAL-ZDUSSCGKSA-N 1 1 229.323 3.781 20 0 BHADMO Cc1cccc(C[N@H+](C)[C@H](C)c2ccco2)c1 ZINC000069068133 179069860 /nfs/dbraw/zinc/06/98/60/179069860.db2.gz DCEBVWKPKXIWAL-CYBMUJFWSA-N 1 1 229.323 3.781 20 0 BHADMO C[C@@H](c1ccco1)[N@@H+](C)Cc1cccc(F)c1 ZINC000069068950 388821621 /nfs/dbraw/zinc/82/16/21/388821621.db2.gz VWJKMLWATJCKGW-NSHDSACASA-N 1 1 233.286 3.612 20 0 BHADMO C[C@H](c1ccco1)[N@@H+](C)Cc1cccc(F)c1 ZINC000069068953 388822018 /nfs/dbraw/zinc/82/20/18/388822018.db2.gz VWJKMLWATJCKGW-LLVKDONJSA-N 1 1 233.286 3.612 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@@H](C)c2ccco2)cc1 ZINC000069068974 387111750 /nfs/dbraw/zinc/11/17/50/387111750.db2.gz NNQKQSDHRDHQDG-ZDUSSCGKSA-N 1 1 229.323 3.781 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@H](C)c2ccco2)cc1 ZINC000069068978 387111955 /nfs/dbraw/zinc/11/19/55/387111955.db2.gz NNQKQSDHRDHQDG-CYBMUJFWSA-N 1 1 229.323 3.781 20 0 BHADMO CC[C@@H](c1ccccc1)[N@@H+](C)Cc1ccco1 ZINC000069070634 368744830 /nfs/dbraw/zinc/74/48/30/368744830.db2.gz HEOZLLNGFCBPCE-HNNXBMFYSA-N 1 1 229.323 3.863 20 0 BHADMO CC[N@@H+](C)[C@@H](C)c1ccc(C(F)(F)F)cc1 ZINC000069071742 368744630 /nfs/dbraw/zinc/74/46/30/368744630.db2.gz FAXSJSDJVPIHGO-VIFPVBQESA-N 1 1 231.261 3.718 20 0 BHADMO C[C@@H](c1ccco1)[N@@H+](C)CCc1cccs1 ZINC000069072483 642826214 /nfs/dbraw/zinc/82/62/14/642826214.db2.gz QPVQFLZXRUSIQV-NSHDSACASA-N 1 1 235.352 3.577 20 0 BHADMO C[C@H](c1ccco1)[N@@H+](C)CCc1cccs1 ZINC000069072486 642826242 /nfs/dbraw/zinc/82/62/42/642826242.db2.gz QPVQFLZXRUSIQV-LLVKDONJSA-N 1 1 235.352 3.577 20 0 BHADMO Cc1cc(C[N@@H+](CC2CC2)C2CCCCC2)on1 ZINC000069079300 368744502 /nfs/dbraw/zinc/74/45/02/368744502.db2.gz VPMCVLRLKLRZKT-UHFFFAOYSA-N 1 1 248.370 3.528 20 0 BHADMO Cc1cc(C[N@@H+](CC2CC2)C2CCCCC2)no1 ZINC000069079413 368744409 /nfs/dbraw/zinc/74/44/09/368744409.db2.gz BFRDEBIWOQKBCO-UHFFFAOYSA-N 1 1 248.370 3.528 20 0 BHADMO CCC[N@@H+](C)Cc1csc(-c2ccccc2)n1 ZINC000069092567 362508157 /nfs/dbraw/zinc/50/81/57/362508157.db2.gz XZFXXFJJKQZACN-UHFFFAOYSA-N 1 1 246.379 3.652 20 0 BHADMO CCC[N@@H+](C)Cc1c(C)cc(C)c(C(C)=O)c1C ZINC000069093105 388824679 /nfs/dbraw/zinc/82/46/79/388824679.db2.gz JVGOQFMPRXUQCU-UHFFFAOYSA-N 1 1 247.382 3.656 20 0 BHADMO Cc1csc([C@H](C)[NH2+]Cc2ccc(C)cc2)n1 ZINC000069168561 632587382 /nfs/dbraw/zinc/58/73/82/632587382.db2.gz ITUKXKOXEZEJAT-LBPRGKRZSA-N 1 1 246.379 3.611 20 0 BHADMO Cc1csc([C@@H](C)[NH2+]Cc2ccc(C)cc2)n1 ZINC000069168562 632586771 /nfs/dbraw/zinc/58/67/71/632586771.db2.gz ITUKXKOXEZEJAT-GFCCVEGCSA-N 1 1 246.379 3.611 20 0 BHADMO Cc1csc([C@H](C)[NH2+]Cc2cccc(C)c2)n1 ZINC000069168567 179097496 /nfs/dbraw/zinc/09/74/96/179097496.db2.gz NYRDOFXWOIINPE-LBPRGKRZSA-N 1 1 246.379 3.611 20 0 BHADMO Cc1csc([C@@H](C)[NH2+]Cc2cccc(C)c2)n1 ZINC000069168568 179100036 /nfs/dbraw/zinc/10/00/36/179100036.db2.gz NYRDOFXWOIINPE-GFCCVEGCSA-N 1 1 246.379 3.611 20 0 BHADMO CCC(CC)C[N@@H+](CC)Cc1nc(C)c(C)o1 ZINC000069172863 387116265 /nfs/dbraw/zinc/11/62/65/387116265.db2.gz BOJTWHJOPPYCNQ-UHFFFAOYSA-N 1 1 238.375 3.550 20 0 BHADMO CC[N@@H+](Cc1ccc(Cl)nc1)[C@@H](C)C(C)C ZINC000069222169 642841320 /nfs/dbraw/zinc/84/13/20/642841320.db2.gz AHGFLSUPWONOPH-NSHDSACASA-N 1 1 240.778 3.601 20 0 BHADMO CC[N@@H+](Cc1ccc(Cl)nc1)[C@H](C)C(C)C ZINC000069222171 642841657 /nfs/dbraw/zinc/84/16/57/642841657.db2.gz AHGFLSUPWONOPH-LLVKDONJSA-N 1 1 240.778 3.601 20 0 BHADMO CCC(C)(C)[N@@H+](C)CCCC(=O)c1ccccc1 ZINC000069441465 411243356 /nfs/dbraw/zinc/24/33/56/411243356.db2.gz HZUCASNFTYGJSS-UHFFFAOYSA-N 1 1 247.382 3.770 20 0 BHADMO CCC(C)(C)[N@@H+](C)CCC(=O)c1ccc(C)cc1 ZINC000069447523 388841732 /nfs/dbraw/zinc/84/17/32/388841732.db2.gz ZSVXPSQGFMEPFY-UHFFFAOYSA-N 1 1 247.382 3.688 20 0 BHADMO C[C@@H](c1ccco1)[N@@H+](C)C/C=C/c1ccccc1 ZINC000069519222 388847417 /nfs/dbraw/zinc/84/74/17/388847417.db2.gz VCWXAXJZSCFGRV-XYYIANASSA-N 1 1 241.334 3.986 20 0 BHADMO C[C@H](c1ccco1)[N@@H+](C)C/C=C/c1ccccc1 ZINC000069519223 388847593 /nfs/dbraw/zinc/84/75/93/388847593.db2.gz VCWXAXJZSCFGRV-OAUONFCTSA-N 1 1 241.334 3.986 20 0 BHADMO c1cncc(C[N@H+](CC2CC2)C2CCCCC2)c1 ZINC000069608100 362744518 /nfs/dbraw/zinc/74/45/18/362744518.db2.gz ZKNZUBHQPQXTFS-UHFFFAOYSA-N 1 1 244.382 3.626 20 0 BHADMO C[C@H]1CCCC[N@H+]1Cc1nc2ccccc2s1 ZINC000069875135 370992091 /nfs/dbraw/zinc/99/20/91/370992091.db2.gz BNZVOEGKOGMJLM-NSHDSACASA-N 1 1 246.379 3.671 20 0 BHADMO Clc1ccc(C2([NH2+]Cc3ccco3)CC2)cc1 ZINC000069878688 359035835 /nfs/dbraw/zinc/03/58/35/359035835.db2.gz BGFHDRIRRVTADV-UHFFFAOYSA-N 1 1 247.725 3.712 20 0 BHADMO CC[N@H+](Cc1ccc(Cl)s1)CC1CC1 ZINC000070015077 323161423 /nfs/dbraw/zinc/16/14/23/323161423.db2.gz QINMEJUAULRZPZ-UHFFFAOYSA-N 1 1 229.776 3.633 20 0 BHADMO Cc1[nH+]ccn1Cc1c(Cl)cccc1Cl ZINC000070163312 323169969 /nfs/dbraw/zinc/16/99/69/323169969.db2.gz NHEHAAMMSUEEAA-UHFFFAOYSA-N 1 1 241.121 3.547 20 0 BHADMO Cc1ccc([C@@H](C)[NH2+]Cc2cscn2)cc1C ZINC000070168244 387119676 /nfs/dbraw/zinc/11/96/76/387119676.db2.gz JPJUJYLGQYAKCF-GFCCVEGCSA-N 1 1 246.379 3.611 20 0 BHADMO Cc1ccc([C@H](C)[NH2+]Cc2cscn2)cc1C ZINC000070168245 387121381 /nfs/dbraw/zinc/12/13/81/387121381.db2.gz JPJUJYLGQYAKCF-LBPRGKRZSA-N 1 1 246.379 3.611 20 0 BHADMO Cc1ccc[nH+]c1NCc1ccc(Cl)s1 ZINC000070203449 383885885 /nfs/dbraw/zinc/88/58/85/383885885.db2.gz WBDCVYCKRJRPTQ-UHFFFAOYSA-N 1 1 238.743 3.717 20 0 BHADMO Cc1cc[nH+]c(NCc2ccc(Cl)s2)c1 ZINC000070203453 386504042 /nfs/dbraw/zinc/50/40/42/386504042.db2.gz UADRGCWGFKXUGN-UHFFFAOYSA-N 1 1 238.743 3.717 20 0 BHADMO Cc1cccc(NCc2ccc(Cl)s2)[nH+]1 ZINC000070203458 179150003 /nfs/dbraw/zinc/15/00/03/179150003.db2.gz JTCCGWTUPOEURY-UHFFFAOYSA-N 1 1 238.743 3.717 20 0 BHADMO Cc1ccc(NCc2ccc(Cl)s2)[nH+]c1 ZINC000070203463 383886536 /nfs/dbraw/zinc/88/65/36/383886536.db2.gz BCTOMLZDVSHELV-UHFFFAOYSA-N 1 1 238.743 3.717 20 0 BHADMO CC(C)c1nc(Cn2cc[nH+]c2C(C)C)cs1 ZINC000070422940 359053077 /nfs/dbraw/zinc/05/30/77/359053077.db2.gz XWRXKOVHOMWBOX-UHFFFAOYSA-N 1 1 249.383 3.635 20 0 BHADMO CC(C)c1[nH+]ccn1Cc1ccc(Cl)cc1 ZINC000070422947 384105822 /nfs/dbraw/zinc/10/58/22/384105822.db2.gz YGVJLTJXXNQPCK-UHFFFAOYSA-N 1 1 234.730 3.708 20 0 BHADMO Cc1cc(C)c(Cn2cc[nH+]c2C(C)C)c(C)c1 ZINC000070422960 325009325 /nfs/dbraw/zinc/00/93/25/325009325.db2.gz JTWKUDBXQSKOES-UHFFFAOYSA-N 1 1 242.366 3.980 20 0 BHADMO Cc1cc(C)cc(Cn2cc[nH+]c2C(C)C)c1 ZINC000070422963 325009195 /nfs/dbraw/zinc/00/91/95/325009195.db2.gz QLKZBFVDFBTEQV-UHFFFAOYSA-N 1 1 228.339 3.672 20 0 BHADMO CC(C)c1[nH+]ccn1Cc1cccc(Cl)c1 ZINC000070422995 384106640 /nfs/dbraw/zinc/10/66/40/384106640.db2.gz FNMCRTOUTILOFH-UHFFFAOYSA-N 1 1 234.730 3.708 20 0 BHADMO CC(C)c1[nH+]ccn1CC1CCCCC1 ZINC000070423008 343328596 /nfs/dbraw/zinc/32/85/96/343328596.db2.gz WGROGGHLDQDLBQ-UHFFFAOYSA-N 1 1 206.333 3.587 20 0 BHADMO CC(C)c1[nH+]ccn1CCSc1ccccc1 ZINC000070423013 534916980 /nfs/dbraw/zinc/91/69/80/534916980.db2.gz HMZZXBPHBDEONE-UHFFFAOYSA-N 1 1 246.379 3.799 20 0 BHADMO CCc1ccc(Cn2cc[nH+]c2C(C)C)cc1 ZINC000070423018 325008018 /nfs/dbraw/zinc/00/80/18/325008018.db2.gz BDYCTDPNDUYEKJ-UHFFFAOYSA-N 1 1 228.339 3.617 20 0 BHADMO CC(C)c1[nH+]ccn1Cc1ccc(Cl)s1 ZINC000070423045 383924540 /nfs/dbraw/zinc/92/45/40/383924540.db2.gz YLDGDSRANRXWHY-UHFFFAOYSA-N 1 1 240.759 3.770 20 0 BHADMO CC(C)c1[nH+]ccn1C/C=C/c1ccccc1 ZINC000070423074 359053038 /nfs/dbraw/zinc/05/30/38/359053038.db2.gz KCILFUHTPTYYGF-RMKNXTFCSA-N 1 1 226.323 3.720 20 0 BHADMO Cc1ccc(Cn2cc[nH+]c2C(C)C)cc1C ZINC000070423095 323193791 /nfs/dbraw/zinc/19/37/91/323193791.db2.gz FVTWRWDMCBKGTG-UHFFFAOYSA-N 1 1 228.339 3.672 20 0 BHADMO Cc1ccc(C)c(Cn2cc[nH+]c2C(C)C)c1 ZINC000070423119 323193697 /nfs/dbraw/zinc/19/36/97/323193697.db2.gz PFWRQFKRMKBHFZ-UHFFFAOYSA-N 1 1 228.339 3.672 20 0 BHADMO CCCc1[nH+]ccn1Cc1ccc(Cl)cc1 ZINC000070424238 359052958 /nfs/dbraw/zinc/05/29/58/359052958.db2.gz LAOJLCAMHGYXSL-UHFFFAOYSA-N 1 1 234.730 3.537 20 0 BHADMO CCCc1[nH+]ccn1Cc1c(C)cc(C)cc1C ZINC000070424261 385869053 /nfs/dbraw/zinc/86/90/53/385869053.db2.gz ZGYPFMGDMNKQPR-UHFFFAOYSA-N 1 1 242.366 3.809 20 0 BHADMO CCCc1[nH+]ccn1Cc1cc(C)cc(C)c1 ZINC000070424264 325009303 /nfs/dbraw/zinc/00/93/03/325009303.db2.gz SPCGAVFCKKTVTB-UHFFFAOYSA-N 1 1 228.339 3.501 20 0 BHADMO CCCc1[nH+]ccn1Cc1ccccc1Cl ZINC000070424280 359053028 /nfs/dbraw/zinc/05/30/28/359053028.db2.gz ZPAHXRMPBNCQSH-UHFFFAOYSA-N 1 1 234.730 3.537 20 0 BHADMO CCCc1[nH+]ccn1C/C=C/c1ccccc1 ZINC000070424287 325008856 /nfs/dbraw/zinc/00/88/56/325008856.db2.gz YONNAWCKGZQQIB-UXBLZVDNSA-N 1 1 226.323 3.549 20 0 BHADMO CCCc1[nH+]ccn1Cc1ccc(C)c(C)c1 ZINC000070424328 325008104 /nfs/dbraw/zinc/00/81/04/325008104.db2.gz YHGPWHSMOKCTDG-UHFFFAOYSA-N 1 1 228.339 3.501 20 0 BHADMO CCCc1[nH+]ccn1CCSc1ccccc1 ZINC000070424425 359053087 /nfs/dbraw/zinc/05/30/87/359053087.db2.gz MZXAGEKFZNFPKJ-UHFFFAOYSA-N 1 1 246.379 3.628 20 0 BHADMO CCCc1[nH+]ccn1Cc1cc(C)ccc1C ZINC000070424475 325008314 /nfs/dbraw/zinc/00/83/14/325008314.db2.gz FNJVJIOQQKIKDU-UHFFFAOYSA-N 1 1 228.339 3.501 20 0 BHADMO CC(C)c1[nH+]ccn1Cc1ccc2c(c1)CCC2 ZINC000070503840 359058679 /nfs/dbraw/zinc/05/86/79/359058679.db2.gz ANQXJJWNKKVVNK-UHFFFAOYSA-N 1 1 240.350 3.544 20 0 BHADMO C[C@H]([NH2+][C@@H](C)c1ccccc1)c1nccs1 ZINC000070710593 384133478 /nfs/dbraw/zinc/13/34/78/384133478.db2.gz FILDGVGOMDEJLP-QWRGUYRKSA-N 1 1 232.352 3.555 20 0 BHADMO C[C@@H]([NH2+][C@@H](C)c1nccs1)c1ccccc1 ZINC000070710595 384133675 /nfs/dbraw/zinc/13/36/75/384133675.db2.gz FILDGVGOMDEJLP-MNOVXSKESA-N 1 1 232.352 3.555 20 0 BHADMO C[C@@H]([NH2+][C@@H](C)c1ccccc1)c1nccs1 ZINC000070710597 384134689 /nfs/dbraw/zinc/13/46/89/384134689.db2.gz FILDGVGOMDEJLP-WDEREUQCSA-N 1 1 232.352 3.555 20 0 BHADMO C[C@@H]([NH2+][C@H](C)c1ccccc1)c1nccs1 ZINC000070710600 384133345 /nfs/dbraw/zinc/13/33/45/384133345.db2.gz FILDGVGOMDEJLP-GHMZBOCLSA-N 1 1 232.352 3.555 20 0 BHADMO C[C@H]([NH2+][C@@H](C)c1nccs1)c1ccsc1 ZINC000070717608 325025862 /nfs/dbraw/zinc/02/58/62/325025862.db2.gz ZOMMBGMZMVZGRW-IUCAKERBSA-N 1 1 238.381 3.616 20 0 BHADMO C[C@@H]([NH2+][C@@H](C)c1nccs1)c1ccsc1 ZINC000070717610 325026068 /nfs/dbraw/zinc/02/60/68/325026068.db2.gz ZOMMBGMZMVZGRW-BDAKNGLRSA-N 1 1 238.381 3.616 20 0 BHADMO C[C@@H]([NH2+][C@@H](C)c1ccsc1)c1nccs1 ZINC000070717612 490235293 /nfs/dbraw/zinc/23/52/93/490235293.db2.gz ZOMMBGMZMVZGRW-DTWKUNHWSA-N 1 1 238.381 3.616 20 0 BHADMO C[C@@H]([NH2+][C@H](C)c1nccs1)c1ccsc1 ZINC000070717613 490235266 /nfs/dbraw/zinc/23/52/66/490235266.db2.gz ZOMMBGMZMVZGRW-RKDXNWHRSA-N 1 1 238.381 3.616 20 0 BHADMO C[C@H]([NH2+][C@@H](C)c1nccs1)c1cccs1 ZINC000070732192 383962402 /nfs/dbraw/zinc/96/24/02/383962402.db2.gz JFKCKCLBXAAFEL-IUCAKERBSA-N 1 1 238.381 3.616 20 0 BHADMO C[C@@H]([NH2+][C@@H](C)c1nccs1)c1cccs1 ZINC000070732193 383962672 /nfs/dbraw/zinc/96/26/72/383962672.db2.gz JFKCKCLBXAAFEL-BDAKNGLRSA-N 1 1 238.381 3.616 20 0 BHADMO C[C@H]([NH2+]C/C=C/c1ccccc1)c1nccs1 ZINC000070942408 134926393 /nfs/dbraw/zinc/92/63/93/134926393.db2.gz RRXLIHYXMKIVPL-ZCRIDZFUSA-N 1 1 244.363 3.507 20 0 BHADMO C[C@@H]([NH2+]C/C=C/c1ccccc1)c1nccs1 ZINC000070942409 359065927 /nfs/dbraw/zinc/06/59/27/359065927.db2.gz RRXLIHYXMKIVPL-FZKGZDJFSA-N 1 1 244.363 3.507 20 0 BHADMO Cc1cc(C)cc(C[NH2+][C@@H](C)c2nccs2)c1 ZINC000070942426 325045855 /nfs/dbraw/zinc/04/58/55/325045855.db2.gz NIUCSVQOYUEVLN-LBPRGKRZSA-N 1 1 246.379 3.611 20 0 BHADMO Cc1cc(C)cc(C[NH2+][C@H](C)c2nccs2)c1 ZINC000070942427 343574263 /nfs/dbraw/zinc/57/42/63/343574263.db2.gz NIUCSVQOYUEVLN-GFCCVEGCSA-N 1 1 246.379 3.611 20 0 BHADMO CCc1ccc(C[NH2+][C@@H](C)c2nccs2)cc1 ZINC000070942586 325045872 /nfs/dbraw/zinc/04/58/72/325045872.db2.gz QSIPGUCFZSVQFN-NSHDSACASA-N 1 1 246.379 3.556 20 0 BHADMO Cc1cccc(C[NH2+][C@@H](C)c2nccs2)c1C ZINC000070942616 325045810 /nfs/dbraw/zinc/04/58/10/325045810.db2.gz QUYDEONCFKDLAF-LBPRGKRZSA-N 1 1 246.379 3.611 20 0 BHADMO Cc1ccc(C[NH2+][C@@H](C)c2nccs2)cc1C ZINC000070942618 325045717 /nfs/dbraw/zinc/04/57/17/325045717.db2.gz KZVBIQABMHNPOJ-LBPRGKRZSA-N 1 1 246.379 3.611 20 0 BHADMO Cc1ccc(C[NH2+][C@@H](C)c2nccs2)c(C)c1 ZINC000070942642 398141514 /nfs/dbraw/zinc/14/15/14/398141514.db2.gz PVTOHKXCINTWMJ-LBPRGKRZSA-N 1 1 246.379 3.611 20 0 BHADMO Cc1ccc(C[NH2+][C@H](C)c2nccs2)c(C)c1 ZINC000070942643 398141630 /nfs/dbraw/zinc/14/16/30/398141630.db2.gz PVTOHKXCINTWMJ-GFCCVEGCSA-N 1 1 246.379 3.611 20 0 BHADMO Cc1ccc(C)c(C[NH2+][C@@H](C)c2nccs2)c1 ZINC000070942644 323515283 /nfs/dbraw/zinc/51/52/83/323515283.db2.gz DKCVKXXKAQLLOK-LBPRGKRZSA-N 1 1 246.379 3.611 20 0 BHADMO CC(C)[N@@H+](Cc1cscn1)Cc1ccccc1 ZINC000070946075 368768698 /nfs/dbraw/zinc/76/86/98/368768698.db2.gz XIBKPYVNMNUDLO-UHFFFAOYSA-N 1 1 246.379 3.554 20 0 BHADMO CC(C)[N@H+](Cc1cscn1)Cc1ccccc1 ZINC000070946075 368768693 /nfs/dbraw/zinc/76/86/93/368768693.db2.gz XIBKPYVNMNUDLO-UHFFFAOYSA-N 1 1 246.379 3.554 20 0 BHADMO c1cncc(C[N@H+](CC2CCCCC2)C2CC2)c1 ZINC000071122168 325057319 /nfs/dbraw/zinc/05/73/19/325057319.db2.gz SKDHRKZLYYHSNW-UHFFFAOYSA-N 1 1 244.382 3.626 20 0 BHADMO CCCC[N@@H+](CC)Cc1cccc(Cl)c1 ZINC000071809261 490316851 /nfs/dbraw/zinc/31/68/51/490316851.db2.gz DWFRJMUUSGUTFM-UHFFFAOYSA-N 1 1 225.763 3.962 20 0 BHADMO CCCC[N@@H+](CC)CCCOc1ccccc1 ZINC000071809262 490316873 /nfs/dbraw/zinc/31/68/73/490316873.db2.gz KKQAHEGRNKXHCJ-UHFFFAOYSA-N 1 1 235.371 3.578 20 0 BHADMO CCCC[N@@H+](CC)Cc1cccc(C)c1 ZINC000071809273 388900471 /nfs/dbraw/zinc/90/04/71/388900471.db2.gz CALVRQDFFQIDOX-UHFFFAOYSA-N 1 1 205.345 3.617 20 0 BHADMO CCC[N@@H+](CCCOc1ccccc1)CC1CC1 ZINC000071809296 490316976 /nfs/dbraw/zinc/31/69/76/490316976.db2.gz PSFMSZRHIPZLJC-UHFFFAOYSA-N 1 1 247.382 3.578 20 0 BHADMO Cc1ccc(C[N@@H+](C)CC2CCCCC2)o1 ZINC000071809623 384181176 /nfs/dbraw/zinc/18/11/76/384181176.db2.gz BJSOVQJTDYVNFF-UHFFFAOYSA-N 1 1 221.344 3.600 20 0 BHADMO C[N@@H+](CCOc1ccccc1)C1CCCCCC1 ZINC000071815602 388899674 /nfs/dbraw/zinc/89/96/74/388899674.db2.gz VIRDIFMWUCFZHA-UHFFFAOYSA-N 1 1 247.382 3.720 20 0 BHADMO C[N@@H+](Cc1ccccc1F)C1CCCCCC1 ZINC000071815603 582691816 /nfs/dbraw/zinc/69/18/16/582691816.db2.gz WSEJVMZCIPWIHB-UHFFFAOYSA-N 1 1 235.346 3.980 20 0 BHADMO CC(C)CC[N@@H+]1CC=C(c2ccc(O)cc2)CC1 ZINC000071816560 491126042 /nfs/dbraw/zinc/12/60/42/491126042.db2.gz NTKQMNYTLPKFTC-UHFFFAOYSA-N 1 1 245.366 3.527 20 0 BHADMO C[C@@H](C1CC1)[N@@H+](C)Cc1ccccc1Cl ZINC000071836697 388901127 /nfs/dbraw/zinc/90/11/27/388901127.db2.gz YHOLZFVUGSQXCS-JTQLQIEISA-N 1 1 223.747 3.570 20 0 BHADMO C[C@H](C1CC1)[N@@H+](C)Cc1ccccc1Cl ZINC000071836700 388900829 /nfs/dbraw/zinc/90/08/29/388900829.db2.gz YHOLZFVUGSQXCS-SNVBAGLBSA-N 1 1 223.747 3.570 20 0 BHADMO C[C@@H](C1CC1)[N@@H+](C)Cc1c(F)cccc1Cl ZINC000071836701 388901501 /nfs/dbraw/zinc/90/15/01/388901501.db2.gz SQZFZPCBLKFRDP-VIFPVBQESA-N 1 1 241.737 3.709 20 0 BHADMO CCC[N@H+](Cc1cccc(F)c1F)CC1CC1 ZINC000071854573 169175751 /nfs/dbraw/zinc/17/57/51/169175751.db2.gz LOLRDUUAHCBATD-UHFFFAOYSA-N 1 1 239.309 3.587 20 0 BHADMO CCc1ccc(C[N@@H+](C/C=C/Cl)C2CC2)cc1 ZINC000071951830 711901092 /nfs/dbraw/zinc/90/10/92/711901092.db2.gz KIJOILGVOGKSGV-XCVCLJGOSA-N 1 1 249.785 3.966 20 0 BHADMO CCCC[N@@H+](C)Cc1ccccc1OC(C)C ZINC000071987373 325107742 /nfs/dbraw/zinc/10/77/42/325107742.db2.gz SDPZMLUMLXIFCI-UHFFFAOYSA-N 1 1 235.371 3.706 20 0 BHADMO CC[C@@H](C)[N@@H+](C)Cc1coc(-c2ccccc2)n1 ZINC000072601450 325159431 /nfs/dbraw/zinc/15/94/31/325159431.db2.gz MFPAOIPGKHTZQG-GFCCVEGCSA-N 1 1 244.338 3.572 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1coc(-c2ccccc2)n1 ZINC000072601454 325158853 /nfs/dbraw/zinc/15/88/53/325158853.db2.gz MFPAOIPGKHTZQG-LBPRGKRZSA-N 1 1 244.338 3.572 20 0 BHADMO CC(C)[N@@H+](Cc1cccc(N(C)C)c1)C1CCC1 ZINC000072685642 369485374 /nfs/dbraw/zinc/48/53/74/369485374.db2.gz MRTQLHKJIZJFOB-UHFFFAOYSA-N 1 1 246.398 3.516 20 0 BHADMO c1cc(C[N@H+]2CCCC3(C2)CCCCCC3)on1 ZINC000072801094 364210850 /nfs/dbraw/zinc/21/08/50/364210850.db2.gz CIOMWBQPYAWZEC-UHFFFAOYSA-N 1 1 248.370 3.611 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@@H](C)c2ccccc2)o1 ZINC000072802298 359090673 /nfs/dbraw/zinc/09/06/73/359090673.db2.gz CPNUUPIPIASRML-ZDUSSCGKSA-N 1 1 229.323 3.781 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@H](C)c2ccccc2)o1 ZINC000072802300 359091259 /nfs/dbraw/zinc/09/12/59/359091259.db2.gz CPNUUPIPIASRML-CYBMUJFWSA-N 1 1 229.323 3.781 20 0 BHADMO CC1(C)CC[N@@H+](Cc2nc3ccccc3s2)C1 ZINC000072827867 359091055 /nfs/dbraw/zinc/09/10/55/359091055.db2.gz QKSXEBQBPZEXFN-UHFFFAOYSA-N 1 1 246.379 3.528 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@@H](C)c2ccc(F)cc2)o1 ZINC000072895590 490412652 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ZINC000076803689 135051815 /nfs/dbraw/zinc/05/18/15/135051815.db2.gz DLXFOBVLSQVUES-LBPRGKRZSA-N 1 1 207.317 3.607 20 0 BHADMO C[N@@H+](CCC(F)(F)F)C1CCCCCC1 ZINC000077248121 344814048 /nfs/dbraw/zinc/81/40/48/344814048.db2.gz CCNGGRCXEKZVDS-UHFFFAOYSA-N 1 1 223.282 3.593 20 0 BHADMO FC(F)(F)CC[N@H+]1CCC[C@H]1c1ccccc1 ZINC000077248299 344814077 /nfs/dbraw/zinc/81/40/77/344814077.db2.gz ITKKAEQJGYHGOS-LBPRGKRZSA-N 1 1 243.272 3.776 20 0 BHADMO FC(F)(F)CC[N@H+]1CCC[C@@H]1c1ccccc1 ZINC000077248301 487845965 /nfs/dbraw/zinc/84/59/65/487845965.db2.gz ITKKAEQJGYHGOS-GFCCVEGCSA-N 1 1 243.272 3.776 20 0 BHADMO FC(F)(F)CC[N@@H+](Cc1ccccc1)C1CC1 ZINC000077250129 344813960 /nfs/dbraw/zinc/81/39/60/344813960.db2.gz BUSRBGOOLQNVEP-UHFFFAOYSA-N 1 1 243.272 3.603 20 0 BHADMO CCCCC[N@@H+](CCC(F)(F)F)C(C)C ZINC000077250907 370404176 /nfs/dbraw/zinc/40/41/76/370404176.db2.gz IIHSRXDRPXQKMP-UHFFFAOYSA-N 1 1 225.298 3.839 20 0 BHADMO FC(F)(F)CC[N@H+]1CCC[C@H]1c1ccsc1 ZINC000077265640 344814697 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/nfs/dbraw/zinc/20/86/58/384208658.db2.gz KZOPGABCHWIFRE-SNVBAGLBSA-N 1 1 237.309 3.839 20 0 BHADMO c1cc(C[N@@H+]2CCC[C@@H]2CC2CCCCC2)no1 ZINC000077273197 370409486 /nfs/dbraw/zinc/40/94/86/370409486.db2.gz WEUYQZPHUADUBI-OAHLLOKOSA-N 1 1 248.370 3.609 20 0 BHADMO c1cc(C[N@@H+]2CCC[C@H]2CC2CCCCC2)no1 ZINC000077273202 370409672 /nfs/dbraw/zinc/40/96/72/370409672.db2.gz WEUYQZPHUADUBI-HNNXBMFYSA-N 1 1 248.370 3.609 20 0 BHADMO CCCCCC[N@@H+](CC)CCC(F)(F)F ZINC000077274043 631417286 /nfs/dbraw/zinc/41/72/86/631417286.db2.gz HKTUKOZKXGUTDL-UHFFFAOYSA-N 1 1 225.298 3.841 20 0 BHADMO C[N@@H+](CCC(F)(F)F)C1CCCCCCC1 ZINC000077274259 711464853 /nfs/dbraw/zinc/46/48/53/711464853.db2.gz UJSHFYNABRXSNU-UHFFFAOYSA-N 1 1 237.309 3.984 20 0 BHADMO FC(F)(F)CC[N@@H+](CC1CC1)C1CCCCC1 ZINC000077278920 325372617 /nfs/dbraw/zinc/37/26/17/325372617.db2.gz WCBSFQQKXNQRGK-UHFFFAOYSA-N 1 1 249.320 3.984 20 0 BHADMO CC[C@@H](C)[C@@H](C)[N@@H+](CCC(F)(F)F)C1CC1 ZINC000077282890 344815128 /nfs/dbraw/zinc/81/51/28/344815128.db2.gz YMGRNBIYKCTUDW-NXEZZACHSA-N 1 1 237.309 3.838 20 0 BHADMO CC[C@H](C)[C@@H](C)[N@@H+](CCC(F)(F)F)C1CC1 ZINC000077282893 344814985 /nfs/dbraw/zinc/81/49/85/344814985.db2.gz YMGRNBIYKCTUDW-VHSXEESVSA-N 1 1 237.309 3.838 20 0 BHADMO CC[C@@H](C)[C@H](C)[N@@H+](CCC(F)(F)F)C1CC1 ZINC000077282895 344814936 /nfs/dbraw/zinc/81/49/36/344814936.db2.gz YMGRNBIYKCTUDW-ZJUUUORDSA-N 1 1 237.309 3.838 20 0 BHADMO CC[C@H](C)[C@H](C)[N@@H+](CCC(F)(F)F)C1CC1 ZINC000077282900 344815187 /nfs/dbraw/zinc/81/51/87/344815187.db2.gz YMGRNBIYKCTUDW-UWVGGRQHSA-N 1 1 237.309 3.838 20 0 BHADMO CC(C)[C@@H](c1ccccc1)[N@@H+](C)Cc1ccon1 ZINC000077312782 411217864 /nfs/dbraw/zinc/21/78/64/411217864.db2.gz XSDRTDITOZOGQE-HNNXBMFYSA-N 1 1 244.338 3.504 20 0 BHADMO CC(C)[C@@H](c1ccccc1)[N@H+](C)Cc1ccon1 ZINC000077312782 411217860 /nfs/dbraw/zinc/21/78/60/411217860.db2.gz XSDRTDITOZOGQE-HNNXBMFYSA-N 1 1 244.338 3.504 20 0 BHADMO CC(C)[C@H](c1ccccc1)[N@@H+](C)Cc1ccon1 ZINC000077312785 411217586 /nfs/dbraw/zinc/21/75/86/411217586.db2.gz XSDRTDITOZOGQE-OAHLLOKOSA-N 1 1 244.338 3.504 20 0 BHADMO CC(C)[C@H](c1ccccc1)[N@H+](C)Cc1ccon1 ZINC000077312785 411217584 /nfs/dbraw/zinc/21/75/84/411217584.db2.gz XSDRTDITOZOGQE-OAHLLOKOSA-N 1 1 244.338 3.504 20 0 BHADMO CCC(CC)C[N@@H+](CC)CCC(F)(F)F ZINC000077314567 344816346 /nfs/dbraw/zinc/81/63/46/344816346.db2.gz LHOMFJJBHPZBBH-UHFFFAOYSA-N 1 1 225.298 3.697 20 0 BHADMO CC(C)[C@@H]1CCC[N@@H+](CCC(F)(F)F)CC1 ZINC000077316259 344816208 /nfs/dbraw/zinc/81/62/08/344816208.db2.gz IHFOSUSPLUEEQL-LLVKDONJSA-N 1 1 237.309 3.697 20 0 BHADMO CC(C)[C@H]1CCC[N@@H+](CCC(F)(F)F)CC1 ZINC000077316260 344816525 /nfs/dbraw/zinc/81/65/25/344816525.db2.gz IHFOSUSPLUEEQL-NSHDSACASA-N 1 1 237.309 3.697 20 0 BHADMO CC(C)[N@@H+](Cc1nc2ccccc2o1)C1CCC1 ZINC000077357758 535120580 /nfs/dbraw/zinc/12/05/80/535120580.db2.gz VBWFFAQQYWIZIG-UHFFFAOYSA-N 1 1 244.338 3.591 20 0 BHADMO CC(C)c1nc(C[N@H+]2CCCC2(C)C)cs1 ZINC000077383038 325376422 /nfs/dbraw/zinc/37/64/22/325376422.db2.gz BGNUDMZDHJPPKL-UHFFFAOYSA-N 1 1 238.400 3.641 20 0 BHADMO Clc1cccc(C2([NH2+]Cc3ccco3)CC2)c1 ZINC000077467775 384409243 /nfs/dbraw/zinc/40/92/43/384409243.db2.gz AUJRBCZDPJDVMQ-UHFFFAOYSA-N 1 1 247.725 3.712 20 0 BHADMO CC(C)(C)[C@@H]1CCC[N@H+]1Cc1ccccc1 ZINC000077923523 344083649 /nfs/dbraw/zinc/08/36/49/344083649.db2.gz OBDUUZAUCDKWGM-AWEZNQCLSA-N 1 1 217.356 3.697 20 0 BHADMO CC(C)(C)[C@H]1CCC[N@H+]1Cc1ccccc1 ZINC000077923524 370507085 /nfs/dbraw/zinc/50/70/85/370507085.db2.gz OBDUUZAUCDKWGM-CQSZACIVSA-N 1 1 217.356 3.697 20 0 BHADMO CC[C@H]([NH2+]Cc1cccc(C)c1)c1nccs1 ZINC000078004137 535919739 /nfs/dbraw/zinc/91/97/39/535919739.db2.gz NCTPEDGJUWCBQA-ZDUSSCGKSA-N 1 1 246.379 3.692 20 0 BHADMO CC[C@@H]([NH2+]Cc1cccc(C)c1)c1nccs1 ZINC000078004138 135392812 /nfs/dbraw/zinc/39/28/12/135392812.db2.gz NCTPEDGJUWCBQA-CYBMUJFWSA-N 1 1 246.379 3.692 20 0 BHADMO CC[C@@H]1CCC[N@H+]([C@@H](C)c2ccccc2)C1 ZINC000078214626 364436111 /nfs/dbraw/zinc/43/61/11/364436111.db2.gz KUYAQCREIMFKQK-UONOGXRCSA-N 1 1 217.356 3.870 20 0 BHADMO CC[C@H]1CCC[N@H+]([C@@H](C)c2ccccc2)C1 ZINC000078214627 344833101 /nfs/dbraw/zinc/83/31/01/344833101.db2.gz KUYAQCREIMFKQK-KBPBESRZSA-N 1 1 217.356 3.870 20 0 BHADMO Cc1ccc(NC/C=C/c2ccccc2)[nH+]c1 ZINC000078254144 641908902 /nfs/dbraw/zinc/90/89/02/641908902.db2.gz LJMWPWZDBPBMRA-VMPITWQZSA-N 1 1 224.307 3.515 20 0 BHADMO Cc1ccc(NCc2coc3ccccc23)[nH+]c1 ZINC000078260823 636791576 /nfs/dbraw/zinc/79/15/76/636791576.db2.gz KIFYHMXUMIHRBE-UHFFFAOYSA-N 1 1 238.290 3.748 20 0 BHADMO CCC[N@H+]1CCC[C@@H]1c1ccc(C)cc1 ZINC000078435929 488208039 /nfs/dbraw/zinc/20/80/39/488208039.db2.gz FVLRKBDRXBBHJO-CQSZACIVSA-N 1 1 203.329 3.542 20 0 BHADMO CCCC[N@H+]1CCC[C@H]1c1cccc(OC)c1 ZINC000078436247 344869006 /nfs/dbraw/zinc/86/90/06/344869006.db2.gz STSOEHYOZRJBLY-HNNXBMFYSA-N 1 1 233.355 3.632 20 0 BHADMO CC(C)C[N@@H+](CC1CC1)C1CCCCC1 ZINC000078458870 370566750 /nfs/dbraw/zinc/56/67/50/370566750.db2.gz HKHIYRJSLJJBHG-UHFFFAOYSA-N 1 1 209.377 3.687 20 0 BHADMO CC1(C)CCN(c2cc[nH+]c3ccsc32)C1 ZINC000078561900 344882982 /nfs/dbraw/zinc/88/29/82/344882982.db2.gz XKKDSVBOBOKFBF-UHFFFAOYSA-N 1 1 232.352 3.533 20 0 BHADMO CCC[N@@H+](CCC(F)(F)F)Cc1ccccc1 ZINC000078720139 490221625 /nfs/dbraw/zinc/22/16/25/490221625.db2.gz NNATUQSYSDYMNY-UHFFFAOYSA-N 1 1 245.288 3.851 20 0 BHADMO C[C@@H](c1ccccc1)[N@@H+](C)CCC(F)(F)F ZINC000078729367 344102106 /nfs/dbraw/zinc/10/21/06/344102106.db2.gz HQIUJSFNBUIYDG-JTQLQIEISA-N 1 1 231.261 3.632 20 0 BHADMO C[C@H](c1ccccc1)[N@@H+](C)CCC(F)(F)F ZINC000078729372 344102013 /nfs/dbraw/zinc/10/20/13/344102013.db2.gz HQIUJSFNBUIYDG-SNVBAGLBSA-N 1 1 231.261 3.632 20 0 BHADMO c1cc(C[N@H+](CC2CCCCC2)C2CC2)ccn1 ZINC000078731218 384459661 /nfs/dbraw/zinc/45/96/61/384459661.db2.gz HECXTXXMWOQEKW-UHFFFAOYSA-N 1 1 244.382 3.626 20 0 BHADMO C[C@@H]1C[C@H](C)C[N@H+](CCSc2ccccc2)C1 ZINC000078738916 388512073 /nfs/dbraw/zinc/51/20/73/388512073.db2.gz KZEZZOBUHHRGNT-OKILXGFUSA-N 1 1 249.423 3.757 20 0 BHADMO CCCC[N@@H+](C)CCSc1ccccc1 ZINC000078738925 388511876 /nfs/dbraw/zinc/51/18/76/388511876.db2.gz OWCXLFKOKIBJRM-UHFFFAOYSA-N 1 1 223.385 3.511 20 0 BHADMO C[C@@H]1CCCC[N@H+]1CCSc1ccccc1 ZINC000078738942 388512300 /nfs/dbraw/zinc/51/23/00/388512300.db2.gz CMWYEAPNBPUVNT-CYBMUJFWSA-N 1 1 235.396 3.653 20 0 BHADMO C[C@H]1CCCC[N@H+]1CCSc1ccccc1 ZINC000078738943 388512534 /nfs/dbraw/zinc/51/25/34/388512534.db2.gz CMWYEAPNBPUVNT-ZDUSSCGKSA-N 1 1 235.396 3.653 20 0 BHADMO CCCC[N@@H+](CC)CCSc1ccccc1 ZINC000078739021 388512262 /nfs/dbraw/zinc/51/22/62/388512262.db2.gz WRYLMGLLYJZWME-UHFFFAOYSA-N 1 1 237.412 3.901 20 0 BHADMO CC(C)CC[N@@H+](C)CCSc1ccccc1 ZINC000078739061 370595178 /nfs/dbraw/zinc/59/51/78/370595178.db2.gz QEUZGFWVAKSZOY-UHFFFAOYSA-N 1 1 237.412 3.757 20 0 BHADMO C[C@@H](C1CC1)[N@@H+](C)CCSc1ccccc1 ZINC000078739088 368431819 /nfs/dbraw/zinc/43/18/19/368431819.db2.gz VXEFKGZQTJHZFR-LBPRGKRZSA-N 1 1 235.396 3.509 20 0 BHADMO C[C@H](C1CC1)[N@@H+](C)CCSc1ccccc1 ZINC000078739091 368432469 /nfs/dbraw/zinc/43/24/69/368432469.db2.gz VXEFKGZQTJHZFR-GFCCVEGCSA-N 1 1 235.396 3.509 20 0 BHADMO CC(C)(C)[C@@H]1CCC[N@@H+](C/C=C/Cl)CC1 ZINC000078762067 641952155 /nfs/dbraw/zinc/95/21/55/641952155.db2.gz ZJRPOMXWQNMXSI-FZKGZDJFSA-N 1 1 229.795 3.887 20 0 BHADMO CC(C)(C)[C@H]1CCC[N@@H+](C/C=C/Cl)CC1 ZINC000078762076 641951740 /nfs/dbraw/zinc/95/17/40/641951740.db2.gz ZJRPOMXWQNMXSI-ZCRIDZFUSA-N 1 1 229.795 3.887 20 0 BHADMO CCCCC[N@@H+](Cc1ccccc1)C1CC1 ZINC000078774784 388685295 /nfs/dbraw/zinc/68/52/95/388685295.db2.gz LCOKOTYSGTXOTE-UHFFFAOYSA-N 1 1 217.356 3.841 20 0 BHADMO CCCCC[N@@H+]1C[C@@H](c2ccccc2)O[C@@H](C)C1 ZINC000078774849 388685950 /nfs/dbraw/zinc/68/59/50/388685950.db2.gz ZULVNZWDEOYTHZ-HOCLYGCPSA-N 1 1 247.382 3.639 20 0 BHADMO CCCCC[N@H+]1C[C@@H](C)O[C@H](c2ccccc2)C1 ZINC000078774852 388685613 /nfs/dbraw/zinc/68/56/13/388685613.db2.gz ZULVNZWDEOYTHZ-ZBFHGGJFSA-N 1 1 247.382 3.639 20 0 BHADMO CCCCC[N@@H+](C)CCCOc1ccccc1 ZINC000078774944 388512991 /nfs/dbraw/zinc/51/29/91/388512991.db2.gz RZMYYJXJOVPAJK-UHFFFAOYSA-N 1 1 235.371 3.578 20 0 BHADMO CCCCC[N@@H+](Cc1ccccc1OC)C1CC1 ZINC000078774989 344102894 /nfs/dbraw/zinc/10/28/94/344102894.db2.gz YRPXIOINDXBDPG-UHFFFAOYSA-N 1 1 247.382 3.850 20 0 BHADMO CCCCC[N@@H+](C)CCCc1ccc(OC)cc1 ZINC000078775009 388685446 /nfs/dbraw/zinc/68/54/46/388685446.db2.gz ZTLQJBVTLXTFER-UHFFFAOYSA-N 1 1 249.398 3.750 20 0 BHADMO CCCCC[N@@H+](CC)Cc1c(F)cccc1F ZINC000078775084 384462638 /nfs/dbraw/zinc/46/26/38/384462638.db2.gz JILRNFHKVPBORE-UHFFFAOYSA-N 1 1 241.325 3.977 20 0 BHADMO CCCCC[N@@H+](C)Cc1ccc(OC)c(C)c1 ZINC000078775329 388513141 /nfs/dbraw/zinc/51/31/41/388513141.db2.gz ZGLIRTXYBLDIEG-UHFFFAOYSA-N 1 1 235.371 3.626 20 0 BHADMO CCCCC[N@H+]1CCCc2cc(OC)ccc2C1 ZINC000078775330 388513585 /nfs/dbraw/zinc/51/35/85/388513585.db2.gz YVXYPEOBOPYKEI-UHFFFAOYSA-N 1 1 247.382 3.634 20 0 BHADMO CCCCC[N@H+]1CCCC[C@H](SCC)C1 ZINC000078775395 388685068 /nfs/dbraw/zinc/68/50/68/388685068.db2.gz RBXHCZQANAECEZ-ZDUSSCGKSA-N 1 1 229.433 3.784 20 0 BHADMO CCCCC[N@H+]1CCCC[C@@H](SCC)C1 ZINC000078775398 388685850 /nfs/dbraw/zinc/68/58/50/388685850.db2.gz RBXHCZQANAECEZ-CYBMUJFWSA-N 1 1 229.433 3.784 20 0 BHADMO CC(C)C[N@H+]1CCCCC[C@@H]1c1ccco1 ZINC000078831240 370606313 /nfs/dbraw/zinc/60/63/13/370606313.db2.gz USBFEGSQQSHWHA-CYBMUJFWSA-N 1 1 221.344 3.853 20 0 BHADMO CC(C)C[N@H+]1CCCCC[C@H]1c1ccco1 ZINC000078831248 370605778 /nfs/dbraw/zinc/60/57/78/370605778.db2.gz USBFEGSQQSHWHA-ZDUSSCGKSA-N 1 1 221.344 3.853 20 0 BHADMO Cc1ccc([C@@H]2CCC[N@@H+]2CCOC(C)C)cc1 ZINC000078873258 344916381 /nfs/dbraw/zinc/91/63/81/344916381.db2.gz SJQBJGOLRUBTKR-INIZCTEOSA-N 1 1 247.382 3.557 20 0 BHADMO Cc1ccc([C@H]2CCC[N@@H+]2CCOC(C)C)cc1 ZINC000078873260 344916335 /nfs/dbraw/zinc/91/63/35/344916335.db2.gz SJQBJGOLRUBTKR-MRXNPFEDSA-N 1 1 247.382 3.557 20 0 BHADMO c1c[nH]c([C@@H]2CCC[N@@H+]2CC2CCCCC2)c1 ZINC000078961867 490186311 /nfs/dbraw/zinc/18/63/11/490186311.db2.gz LVOKIFOBXZGGMY-HNNXBMFYSA-N 1 1 232.371 3.732 20 0 BHADMO c1c[nH]c([C@H]2CCC[N@@H+]2CC2CCCCC2)c1 ZINC000078961874 490186188 /nfs/dbraw/zinc/18/61/88/490186188.db2.gz LVOKIFOBXZGGMY-OAHLLOKOSA-N 1 1 232.371 3.732 20 0 BHADMO CC(C)CC[N@@H+](Cc1cccs1)C1CC1 ZINC000079085449 388523692 /nfs/dbraw/zinc/52/36/92/388523692.db2.gz ZODNOYABSBLYOS-UHFFFAOYSA-N 1 1 223.385 3.759 20 0 BHADMO CC(C)[C@@H]1CCC[N@@H+](Cc2cccc(N)c2)CC1 ZINC000079302541 135306196 /nfs/dbraw/zinc/30/61/96/135306196.db2.gz VBJXMIHMICVQET-OAHLLOKOSA-N 1 1 246.398 3.527 20 0 BHADMO CC(C)[C@H]1CCC[N@@H+](Cc2cccc(N)c2)CC1 ZINC000079302544 135306045 /nfs/dbraw/zinc/30/60/45/135306045.db2.gz VBJXMIHMICVQET-HNNXBMFYSA-N 1 1 246.398 3.527 20 0 BHADMO Cc1cn(Cc2ccc(C)cc2Cl)c(C)[nH+]1 ZINC000079377321 487639142 /nfs/dbraw/zinc/63/91/42/487639142.db2.gz ARMHYSHOWZPJNB-UHFFFAOYSA-N 1 1 234.730 3.510 20 0 BHADMO CC[C@@H]1CCC[N@@H+](CCC(=O)C(C)(C)C)CC1 ZINC000079397948 636359697 /nfs/dbraw/zinc/35/96/97/636359697.db2.gz OCOLIWPVRFBLTR-CYBMUJFWSA-N 1 1 239.403 3.504 20 0 BHADMO CC[C@H]1CCC[N@@H+](CCC(=O)C(C)(C)C)CC1 ZINC000079397951 636359775 /nfs/dbraw/zinc/35/97/75/636359775.db2.gz OCOLIWPVRFBLTR-ZDUSSCGKSA-N 1 1 239.403 3.504 20 0 BHADMO Cc1cn(Cc2ccc(Cl)cc2C)c(C)[nH+]1 ZINC000079410420 644179443 /nfs/dbraw/zinc/17/94/43/644179443.db2.gz JXOJGSWEZNULPC-UHFFFAOYSA-N 1 1 234.730 3.510 20 0 BHADMO CC[N@H+]1CC[C@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000079603903 643276522 /nfs/dbraw/zinc/27/65/22/643276522.db2.gz LVZLFRFVPIGTES-NSHDSACASA-N 1 1 243.272 3.515 20 0 BHADMO CC[N@H+]1CC[C@@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000079603906 643278332 /nfs/dbraw/zinc/27/83/32/643278332.db2.gz LVZLFRFVPIGTES-LLVKDONJSA-N 1 1 243.272 3.515 20 0 BHADMO C[N@@H+](CCSc1ccccc1)C1CCCC1 ZINC000079618364 359660157 /nfs/dbraw/zinc/66/01/57/359660157.db2.gz YAEGVIFJCLJYQT-UHFFFAOYSA-N 1 1 235.396 3.653 20 0 BHADMO CC(C)[C@@H](C)[N@@H+](C)CCSc1ccccc1 ZINC000079618377 388540725 /nfs/dbraw/zinc/54/07/25/388540725.db2.gz KJLUNKKDQUBWKP-CYBMUJFWSA-N 1 1 237.412 3.755 20 0 BHADMO CC(C)[C@H](C)[N@@H+](C)CCSc1ccccc1 ZINC000079618378 388541163 /nfs/dbraw/zinc/54/11/63/388541163.db2.gz KJLUNKKDQUBWKP-ZDUSSCGKSA-N 1 1 237.412 3.755 20 0 BHADMO CC(C)C[N@@H+](CCSc1ccccc1)C1CC1 ZINC000079618380 388540424 /nfs/dbraw/zinc/54/04/24/388540424.db2.gz QKTKABXFTHFQCC-UHFFFAOYSA-N 1 1 249.423 3.899 20 0 BHADMO CC[C@@H]1CCC[N@@H+](CCSc2ccccc2)C1 ZINC000079618436 388540446 /nfs/dbraw/zinc/54/04/46/388540446.db2.gz WRSRTVJALIQEQF-CQSZACIVSA-N 1 1 249.423 3.901 20 0 BHADMO CC[C@H]1CCC[N@@H+](CCSc2ccccc2)C1 ZINC000079618440 359660132 /nfs/dbraw/zinc/66/01/32/359660132.db2.gz WRSRTVJALIQEQF-AWEZNQCLSA-N 1 1 249.423 3.901 20 0 BHADMO CC(C)[N@@H+](CCSc1ccccc1)CC1CC1 ZINC000079618443 359660138 /nfs/dbraw/zinc/66/01/38/359660138.db2.gz KJQRCXUPCOPLBE-UHFFFAOYSA-N 1 1 249.423 3.899 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)CCSc1ccccc1 ZINC000079618446 359659917 /nfs/dbraw/zinc/65/99/17/359659917.db2.gz LORAVSGGJQVCRY-CYBMUJFWSA-N 1 1 237.412 3.899 20 0 BHADMO CCC[C@H](C)[N@@H+](C)CCSc1ccccc1 ZINC000079618449 387579417 /nfs/dbraw/zinc/57/94/17/387579417.db2.gz LORAVSGGJQVCRY-ZDUSSCGKSA-N 1 1 237.412 3.899 20 0 BHADMO C[N@@H+](CCSc1ccccc1)Cc1ccoc1 ZINC000079618586 135397472 /nfs/dbraw/zinc/39/74/72/135397472.db2.gz BQISMCUHOQAYIG-UHFFFAOYSA-N 1 1 247.363 3.504 20 0 BHADMO CC(C)[C@@H]1CCC[N@H+]1CCSc1ccccc1 ZINC000079618626 388541000 /nfs/dbraw/zinc/54/10/00/388541000.db2.gz JHKMIXFGASQXCG-HNNXBMFYSA-N 1 1 249.423 3.899 20 0 BHADMO CC(C)[C@H]1CCC[N@H+]1CCSc1ccccc1 ZINC000079618628 388540980 /nfs/dbraw/zinc/54/09/80/388540980.db2.gz JHKMIXFGASQXCG-OAHLLOKOSA-N 1 1 249.423 3.899 20 0 BHADMO C[C@@H]1CCC[N@@H+](CCSc2ccccc2)CC1 ZINC000079618659 388541978 /nfs/dbraw/zinc/54/19/78/388541978.db2.gz INBJJWFMJGGUSB-CQSZACIVSA-N 1 1 249.423 3.901 20 0 BHADMO C[C@H]1CCC[N@@H+](CCSc2ccccc2)CC1 ZINC000079618663 388542497 /nfs/dbraw/zinc/54/24/97/388542497.db2.gz INBJJWFMJGGUSB-AWEZNQCLSA-N 1 1 249.423 3.901 20 0 BHADMO CCC[N@@H+](CC)CCSc1ccccc1 ZINC000079618668 388541800 /nfs/dbraw/zinc/54/18/00/388541800.db2.gz NTFLCPHZRBXDRV-UHFFFAOYSA-N 1 1 223.385 3.511 20 0 BHADMO C[N@@H+](CCSc1ccccc1)CC1CCCC1 ZINC000079618678 388542431 /nfs/dbraw/zinc/54/24/31/388542431.db2.gz FROBXHZNBRAUIG-UHFFFAOYSA-N 1 1 249.423 3.901 20 0 BHADMO CC[N@@H+](CCSc1ccccc1)C(C)C ZINC000079618699 135397605 /nfs/dbraw/zinc/39/76/05/135397605.db2.gz RVJNTDNHZXGXCA-UHFFFAOYSA-N 1 1 223.385 3.509 20 0 BHADMO C[N@@H+](CCSc1ccccc1)CC(C)(C)C ZINC000079618737 387578809 /nfs/dbraw/zinc/57/88/09/387578809.db2.gz CLMVGPSYIUBHCQ-UHFFFAOYSA-N 1 1 237.412 3.757 20 0 BHADMO CC[C@@H](C)[N@@H+](C)CCSc1ccccc1 ZINC000079618746 387579916 /nfs/dbraw/zinc/57/99/16/387579916.db2.gz FOEFTRBGFUEMFL-GFCCVEGCSA-N 1 1 223.385 3.509 20 0 BHADMO CC[C@H](C)[N@@H+](C)CCSc1ccccc1 ZINC000079618750 387578953 /nfs/dbraw/zinc/57/89/53/387578953.db2.gz FOEFTRBGFUEMFL-LBPRGKRZSA-N 1 1 223.385 3.509 20 0 BHADMO CC[C@@H]1CCC[N@H+]1CCSc1ccccc1 ZINC000079618764 387579829 /nfs/dbraw/zinc/57/98/29/387579829.db2.gz CSUNNDQCKIFGTP-CYBMUJFWSA-N 1 1 235.396 3.653 20 0 BHADMO CC[C@H]1CCC[N@H+]1CCSc1ccccc1 ZINC000079618767 387579370 /nfs/dbraw/zinc/57/93/70/387579370.db2.gz CSUNNDQCKIFGTP-ZDUSSCGKSA-N 1 1 235.396 3.653 20 0 BHADMO CC1(C)CCC[N@H+]1CCSc1ccccc1 ZINC000079618788 387579297 /nfs/dbraw/zinc/57/92/97/387579297.db2.gz IVXQFVQIRKMYBP-UHFFFAOYSA-N 1 1 235.396 3.653 20 0 BHADMO CCC[N@@H+](CCSc1ccccc1)C1CC1 ZINC000079618826 388541737 /nfs/dbraw/zinc/54/17/37/388541737.db2.gz NKSSUKDOQUEBJW-UHFFFAOYSA-N 1 1 235.396 3.653 20 0 BHADMO CC[C@@H](C)C[N@@H+](C)CCSc1ccccc1 ZINC000079618947 388540397 /nfs/dbraw/zinc/54/03/97/388540397.db2.gz FVVBBLPUIUPFPX-CYBMUJFWSA-N 1 1 237.412 3.757 20 0 BHADMO CC[C@H](C)C[N@@H+](C)CCSc1ccccc1 ZINC000079618951 388541793 /nfs/dbraw/zinc/54/17/93/388541793.db2.gz FVVBBLPUIUPFPX-ZDUSSCGKSA-N 1 1 237.412 3.757 20 0 BHADMO C[N@@H+](CCSc1ccccc1)CC1CCC1 ZINC000079618954 134391150 /nfs/dbraw/zinc/39/11/50/134391150.db2.gz KNJUTNHSUOOSQP-UHFFFAOYSA-N 1 1 235.396 3.511 20 0 BHADMO CC[N@@H+](CCSc1ccccc1)CC1CC1 ZINC000079618963 388542439 /nfs/dbraw/zinc/54/24/39/388542439.db2.gz HGJFRXJXZCRPAS-UHFFFAOYSA-N 1 1 235.396 3.511 20 0 BHADMO CCC(C)(C)[N@@H+](C)CCSc1ccccc1 ZINC000079618965 388542102 /nfs/dbraw/zinc/54/21/02/388542102.db2.gz GEURDVJABNYXNO-UHFFFAOYSA-N 1 1 237.412 3.899 20 0 BHADMO CCC[N@@H+](CCSc1ccccc1)CC1CC1 ZINC000079618998 388541652 /nfs/dbraw/zinc/54/16/52/388541652.db2.gz KEUAKJPDDQLNJO-UHFFFAOYSA-N 1 1 249.423 3.901 20 0 BHADMO CC[N@@H+](CCSc1ccccc1)CC(C)C ZINC000079619002 388541829 /nfs/dbraw/zinc/54/18/29/388541829.db2.gz KGWFJKYGNDCZJW-UHFFFAOYSA-N 1 1 237.412 3.757 20 0 BHADMO CSc1ccc(CNc2ccc(C)c[nH+]2)cc1 ZINC000079753001 636648636 /nfs/dbraw/zinc/64/86/36/636648636.db2.gz SQIYTVQRJGBCBJ-UHFFFAOYSA-N 1 1 244.363 3.724 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)Cc1csc(C(C)C)n1 ZINC000079863709 345046351 /nfs/dbraw/zinc/04/63/51/345046351.db2.gz MRZXYHJJSANKRY-LLVKDONJSA-N 1 1 240.416 3.887 20 0 BHADMO CCC[C@H](C)[N@@H+](C)Cc1csc(C(C)C)n1 ZINC000079863712 345046475 /nfs/dbraw/zinc/04/64/75/345046475.db2.gz MRZXYHJJSANKRY-NSHDSACASA-N 1 1 240.416 3.887 20 0 BHADMO Cc1ccccc1C[N@H+](C)[C@@H](C)c1cccnc1 ZINC000079876257 135363103 /nfs/dbraw/zinc/36/31/03/135363103.db2.gz GKBPYNRLTMDGAU-AWEZNQCLSA-N 1 1 240.350 3.583 20 0 BHADMO Cc1ccccc1C[N@H+](C)[C@H](C)c1cccnc1 ZINC000079876259 135362949 /nfs/dbraw/zinc/36/29/49/135362949.db2.gz GKBPYNRLTMDGAU-CQSZACIVSA-N 1 1 240.350 3.583 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@@H](C)c2cccc(F)c2)o1 ZINC000079876323 388548449 /nfs/dbraw/zinc/54/84/49/388548449.db2.gz FDLSXEOEGAFOSS-LBPRGKRZSA-N 1 1 247.313 3.920 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@H](C)c2cccc(F)c2)o1 ZINC000079876326 388548601 /nfs/dbraw/zinc/54/86/01/388548601.db2.gz FDLSXEOEGAFOSS-GFCCVEGCSA-N 1 1 247.313 3.920 20 0 BHADMO CC(C)[N@@H+](C)Cc1csc2ccccc12 ZINC000079989658 136374916 /nfs/dbraw/zinc/37/49/16/136374916.db2.gz KMXMVPXBKRJBDT-UHFFFAOYSA-N 1 1 219.353 3.742 20 0 BHADMO CCC[C@@H]1CCC[N@@H+](CCCc2ccncc2)C1 ZINC000080017702 345079262 /nfs/dbraw/zinc/07/92/62/345079262.db2.gz JFPCHGRQJKSCRE-MRXNPFEDSA-N 1 1 246.398 3.526 20 0 BHADMO CCC[C@H]1CCC[N@@H+](CCCc2ccncc2)C1 ZINC000080017707 345079285 /nfs/dbraw/zinc/07/92/85/345079285.db2.gz JFPCHGRQJKSCRE-INIZCTEOSA-N 1 1 246.398 3.526 20 0 BHADMO Cc1cccc(C[N@H+]2CCC[C@@H]2c2ccc[nH]2)c1 ZINC000080026286 136374978 /nfs/dbraw/zinc/37/49/78/136374978.db2.gz SUIIKDPKIGFYAA-MRXNPFEDSA-N 1 1 240.350 3.660 20 0 BHADMO Cc1cccc(C[N@H+]2CCC[C@H]2c2ccc[nH]2)c1 ZINC000080026291 136374967 /nfs/dbraw/zinc/37/49/67/136374967.db2.gz SUIIKDPKIGFYAA-INIZCTEOSA-N 1 1 240.350 3.660 20 0 BHADMO CC[N@@H+](C)Cc1csc(-c2ccc(C)cc2)n1 ZINC000080111751 388552903 /nfs/dbraw/zinc/55/29/03/388552903.db2.gz BXWDYAQRIGJILF-UHFFFAOYSA-N 1 1 246.379 3.570 20 0 BHADMO CC[N@H+](C)Cc1csc(-c2ccc(C)cc2)n1 ZINC000080111751 388552902 /nfs/dbraw/zinc/55/29/02/388552902.db2.gz BXWDYAQRIGJILF-UHFFFAOYSA-N 1 1 246.379 3.570 20 0 BHADMO CC[N@@H+](C)C1c2ccccc2-c2ccccc21 ZINC000080115699 388552834 /nfs/dbraw/zinc/55/28/34/388552834.db2.gz JZGCYRCDAVZJTO-UHFFFAOYSA-N 1 1 223.319 3.708 20 0 BHADMO Cc1[nH+]ccn1Cc1ccc(-c2ccccc2)cc1 ZINC000080137276 388553815 /nfs/dbraw/zinc/55/38/15/388553815.db2.gz IDZHCQVYEKZYOR-UHFFFAOYSA-N 1 1 248.329 3.907 20 0 BHADMO Cc1ccc(C[C@H](C)Nc2cccc(C)[nH+]2)s1 ZINC000080248656 179153154 /nfs/dbraw/zinc/15/31/54/179153154.db2.gz XYWWAFJMWRNOFH-NSHDSACASA-N 1 1 246.379 3.803 20 0 BHADMO Cc1ccc(C[C@@H](C)Nc2cccc(C)[nH+]2)s1 ZINC000080248661 179156599 /nfs/dbraw/zinc/15/65/99/179156599.db2.gz XYWWAFJMWRNOFH-LLVKDONJSA-N 1 1 246.379 3.803 20 0 BHADMO Cc1ccc(C[C@H](C)Nc2cc(C)cc[nH+]2)s1 ZINC000080249025 386238006 /nfs/dbraw/zinc/23/80/06/386238006.db2.gz JUKXMPRKAYXCGS-NSHDSACASA-N 1 1 246.379 3.803 20 0 BHADMO Cc1ccc(C[C@@H](C)Nc2cc(C)cc[nH+]2)s1 ZINC000080249030 386238780 /nfs/dbraw/zinc/23/87/80/386238780.db2.gz JUKXMPRKAYXCGS-LLVKDONJSA-N 1 1 246.379 3.803 20 0 BHADMO CC[C@H]([NH2+]Cc1ccc(C)cc1)c1nccs1 ZINC000080263125 387985219 /nfs/dbraw/zinc/98/52/19/387985219.db2.gz MGIVROINPOXWEB-ZDUSSCGKSA-N 1 1 246.379 3.692 20 0 BHADMO CC[C@@H]([NH2+]Cc1ccc(C)cc1)c1nccs1 ZINC000080263128 387985730 /nfs/dbraw/zinc/98/57/30/387985730.db2.gz MGIVROINPOXWEB-CYBMUJFWSA-N 1 1 246.379 3.692 20 0 BHADMO Cc1ccccc1[C@@H](C)[NH2+][C@@H](C)c1nccs1 ZINC000080264968 179321951 /nfs/dbraw/zinc/32/19/51/179321951.db2.gz GAIGVWBOCWRTKD-NEPJUHHUSA-N 1 1 246.379 3.863 20 0 BHADMO Cc1ccccc1[C@H](C)[NH2+][C@@H](C)c1nccs1 ZINC000080264969 179339816 /nfs/dbraw/zinc/33/98/16/179339816.db2.gz GAIGVWBOCWRTKD-RYUDHWBXSA-N 1 1 246.379 3.863 20 0 BHADMO Cc1ccccc1[C@@H](C)[NH2+][C@H](C)c1nccs1 ZINC000080264972 179322859 /nfs/dbraw/zinc/32/28/59/179322859.db2.gz GAIGVWBOCWRTKD-VXGBXAGGSA-N 1 1 246.379 3.863 20 0 BHADMO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2nccs2)cc1 ZINC000080265267 384542384 /nfs/dbraw/zinc/54/23/84/384542384.db2.gz KPYKUDVVPKKSTN-NEPJUHHUSA-N 1 1 246.379 3.863 20 0 BHADMO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2nccs2)cc1 ZINC000080265269 387985160 /nfs/dbraw/zinc/98/51/60/387985160.db2.gz KPYKUDVVPKKSTN-RYUDHWBXSA-N 1 1 246.379 3.863 20 0 BHADMO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2nccs2)cc1 ZINC000080265271 384541871 /nfs/dbraw/zinc/54/18/71/384541871.db2.gz KPYKUDVVPKKSTN-VXGBXAGGSA-N 1 1 246.379 3.863 20 0 BHADMO Cc1ccc([C@H](C)[NH2+][C@H](C)c2nccs2)cc1 ZINC000080265272 387985146 /nfs/dbraw/zinc/98/51/46/387985146.db2.gz KPYKUDVVPKKSTN-NWDGAFQWSA-N 1 1 246.379 3.863 20 0 BHADMO CCc1ccccc1C[NH2+][C@@H](C)c1nccs1 ZINC000080266322 384544004 /nfs/dbraw/zinc/54/40/04/384544004.db2.gz BGSNWYXIXQLKGE-NSHDSACASA-N 1 1 246.379 3.556 20 0 BHADMO CCc1ccccc1C[NH2+][C@H](C)c1nccs1 ZINC000080266325 384543685 /nfs/dbraw/zinc/54/36/85/384543685.db2.gz BGSNWYXIXQLKGE-LLVKDONJSA-N 1 1 246.379 3.556 20 0 BHADMO Cc1csc([C@@H](C)[NH2+][C@@H](C)c2ccccc2)n1 ZINC000080273828 135368374 /nfs/dbraw/zinc/36/83/74/135368374.db2.gz CLLGNZPIDCMUNH-NWDGAFQWSA-N 1 1 246.379 3.863 20 0 BHADMO Cc1csc([C@H](C)[NH2+][C@@H](C)c2ccccc2)n1 ZINC000080273831 135368448 /nfs/dbraw/zinc/36/84/48/135368448.db2.gz CLLGNZPIDCMUNH-RYUDHWBXSA-N 1 1 246.379 3.863 20 0 BHADMO Cc1csc([C@@H](C)[NH2+][C@H](C)c2ccccc2)n1 ZINC000080273832 135368437 /nfs/dbraw/zinc/36/84/37/135368437.db2.gz CLLGNZPIDCMUNH-VXGBXAGGSA-N 1 1 246.379 3.863 20 0 BHADMO Cc1csc([C@H](C)[NH2+][C@H](C)c2ccccc2)n1 ZINC000080273837 135368444 /nfs/dbraw/zinc/36/84/44/135368444.db2.gz CLLGNZPIDCMUNH-NEPJUHHUSA-N 1 1 246.379 3.863 20 0 BHADMO Cc1[nH+]ccn1Cc1cccc(Cl)c1Cl ZINC000080811418 384175327 /nfs/dbraw/zinc/17/53/27/384175327.db2.gz UCAKMFIZCFMYJC-UHFFFAOYSA-N 1 1 241.121 3.547 20 0 BHADMO CC[C@@H](C)C[N@@H+](CC)Cc1cccc(Cl)n1 ZINC000080848201 643113373 /nfs/dbraw/zinc/11/33/73/643113373.db2.gz WLIZHMRORMPPHP-LLVKDONJSA-N 1 1 240.778 3.603 20 0 BHADMO CC[C@H](C)C[N@@H+](CC)Cc1cccc(Cl)n1 ZINC000080848205 643112856 /nfs/dbraw/zinc/11/28/56/643112856.db2.gz WLIZHMRORMPPHP-NSHDSACASA-N 1 1 240.778 3.603 20 0 BHADMO CC[C@@H](C)C[N@@H+](CC)Cc1ccnc(Cl)c1 ZINC000080848208 643112732 /nfs/dbraw/zinc/11/27/32/643112732.db2.gz DVGRLXYALHIARG-LLVKDONJSA-N 1 1 240.778 3.603 20 0 BHADMO CC[C@H](C)C[N@@H+](CC)Cc1ccnc(Cl)c1 ZINC000080848212 643113303 /nfs/dbraw/zinc/11/33/03/643113303.db2.gz DVGRLXYALHIARG-NSHDSACASA-N 1 1 240.778 3.603 20 0 BHADMO CC[C@@H](C)C[N@@H+](CC)Cc1ccc(Cl)nc1 ZINC000080848218 643113309 /nfs/dbraw/zinc/11/33/09/643113309.db2.gz QHKXCEZTHDDJEE-LLVKDONJSA-N 1 1 240.778 3.603 20 0 BHADMO CC[C@H](C)C[N@@H+](CC)Cc1ccc(Cl)nc1 ZINC000080848222 643114166 /nfs/dbraw/zinc/11/41/66/643114166.db2.gz QHKXCEZTHDDJEE-NSHDSACASA-N 1 1 240.778 3.603 20 0 BHADMO CC[C@@H](C)C[N@@H+](CC)Cc1cccnc1Cl ZINC000080848227 643493317 /nfs/dbraw/zinc/49/33/17/643493317.db2.gz KSBZCNJDSHVVEW-LLVKDONJSA-N 1 1 240.778 3.603 20 0 BHADMO CC[C@H](C)C[N@@H+](CC)Cc1cccnc1Cl ZINC000080848230 643494030 /nfs/dbraw/zinc/49/40/30/643494030.db2.gz KSBZCNJDSHVVEW-NSHDSACASA-N 1 1 240.778 3.603 20 0 BHADMO CC(C)C[N@@H+](Cc1ccccc1)C(C)C ZINC000080909166 487487050 /nfs/dbraw/zinc/48/70/50/487487050.db2.gz NQTNSYHFBYBBEB-UHFFFAOYSA-N 1 1 205.345 3.553 20 0 BHADMO C[C@@H](c1ccccc1)[N@@H+](C)Cc1cccc(O)c1 ZINC000080922986 176020292 /nfs/dbraw/zinc/02/02/92/176020292.db2.gz XBFHTRXYIIWLDA-ZDUSSCGKSA-N 1 1 241.334 3.585 20 0 BHADMO C[C@H](c1ccccc1)[N@@H+](C)Cc1cccc(O)c1 ZINC000080922990 177038376 /nfs/dbraw/zinc/03/83/76/177038376.db2.gz XBFHTRXYIIWLDA-CYBMUJFWSA-N 1 1 241.334 3.585 20 0 BHADMO CCCC[N@@H+](CC)[C@@H](C)c1cccc(O)c1 ZINC000080931737 388564322 /nfs/dbraw/zinc/56/43/22/388564322.db2.gz CTQDAHZVZAKZML-LBPRGKRZSA-N 1 1 221.344 3.575 20 0 BHADMO CCCC[N@@H+](CC)[C@H](C)c1cccc(O)c1 ZINC000080931740 388564370 /nfs/dbraw/zinc/56/43/70/388564370.db2.gz CTQDAHZVZAKZML-GFCCVEGCSA-N 1 1 221.344 3.575 20 0 BHADMO Clc1c[nH+]ccc1N1CC[C@@H]2CCCC[C@@H]21 ZINC000080972542 345457076 /nfs/dbraw/zinc/45/70/76/345457076.db2.gz FTHZULFDPNPRPX-JQWIXIFHSA-N 1 1 236.746 3.504 20 0 BHADMO CC1(C)CC[N@H+]1Cc1ccc(C(F)(F)F)cc1 ZINC000081045716 345459626 /nfs/dbraw/zinc/45/96/26/345459626.db2.gz ISEYTJAWGXEUHY-UHFFFAOYSA-N 1 1 243.272 3.690 20 0 BHADMO CC(C)Oc1ccc(C[N@H+]2CCC23CCC3)cc1 ZINC000081515714 345482024 /nfs/dbraw/zinc/48/20/24/345482024.db2.gz CJQKKHBSQZEJFZ-UHFFFAOYSA-N 1 1 245.366 3.602 20 0 BHADMO Clc1ccc(C[N@H+]2CCC23CCC3)s1 ZINC000081544939 345477669 /nfs/dbraw/zinc/47/76/69/345477669.db2.gz IXVSOJKWJWPQGA-UHFFFAOYSA-N 1 1 227.760 3.530 20 0 BHADMO Clc1ccc(C[N@@H+]2CCC23CCC3)s1 ZINC000081544939 345477667 /nfs/dbraw/zinc/47/76/67/345477667.db2.gz IXVSOJKWJWPQGA-UHFFFAOYSA-N 1 1 227.760 3.530 20 0 BHADMO CC(C)Oc1ccccc1C[N@H+]1CCC12CCC2 ZINC000081545338 345477926 /nfs/dbraw/zinc/47/79/26/345477926.db2.gz HYERGMGDMIWAQW-UHFFFAOYSA-N 1 1 245.366 3.602 20 0 BHADMO Clc1ccccc1CC[N@H+]1CCC12CCC2 ZINC000081545578 345478040 /nfs/dbraw/zinc/47/80/40/345478040.db2.gz RBGBUTGTDUPYMI-UHFFFAOYSA-N 1 1 235.758 3.511 20 0 BHADMO Fc1ccc(C[N@H+]2CCC23CCC3)c(Cl)c1 ZINC000081563192 345478697 /nfs/dbraw/zinc/47/86/97/345478697.db2.gz ZWVAIESWINHHDY-UHFFFAOYSA-N 1 1 239.721 3.608 20 0 BHADMO Fc1ccc(C[N@@H+]2CCC23CCC3)c(Cl)c1 ZINC000081563192 345478694 /nfs/dbraw/zinc/47/86/94/345478694.db2.gz ZWVAIESWINHHDY-UHFFFAOYSA-N 1 1 239.721 3.608 20 0 BHADMO Fc1cccc(Cl)c1C[N@H+]1CCC12CCC2 ZINC000081580160 345479718 /nfs/dbraw/zinc/47/97/18/345479718.db2.gz PGXHCIRCRJYNMW-UHFFFAOYSA-N 1 1 239.721 3.608 20 0 BHADMO Fc1cccc(Cl)c1C[N@@H+]1CCC12CCC2 ZINC000081580160 345479714 /nfs/dbraw/zinc/47/97/14/345479714.db2.gz PGXHCIRCRJYNMW-UHFFFAOYSA-N 1 1 239.721 3.608 20 0 BHADMO CC(C)C[N@H+]1CC[C@@H]1c1ccc(Cl)cc1 ZINC000081605289 345486266 /nfs/dbraw/zinc/48/62/66/345486266.db2.gz LQLVTCZLAMWSTJ-CYBMUJFWSA-N 1 1 223.747 3.743 20 0 BHADMO CC(C)C[N@H+]1CC[C@H]1c1ccc(Cl)cc1 ZINC000081605293 345486086 /nfs/dbraw/zinc/48/60/86/345486086.db2.gz LQLVTCZLAMWSTJ-ZDUSSCGKSA-N 1 1 223.747 3.743 20 0 BHADMO Cc1nc(C[N@H+](C)C2CCCCC2)sc1C ZINC000081643227 388587378 /nfs/dbraw/zinc/58/73/78/388587378.db2.gz NJGYPLIJJQUJHH-UHFFFAOYSA-N 1 1 238.400 3.524 20 0 BHADMO CCCCC[N@@H+](Cc1nc(C)cs1)C(C)C ZINC000081648977 388588178 /nfs/dbraw/zinc/58/81/78/388588178.db2.gz HDRRKCGAOXFSPB-UHFFFAOYSA-N 1 1 240.416 3.852 20 0 BHADMO Cc1ccc2[nH]c(NCc3cccs3)[nH+]c2c1 ZINC000082741382 371029818 /nfs/dbraw/zinc/02/98/18/371029818.db2.gz SEKODWMCBREUEH-UHFFFAOYSA-N 1 1 243.335 3.545 20 0 BHADMO Nc1cccc2c1cc[nH+]c2NC1CCCCC1 ZINC000082753964 487725559 /nfs/dbraw/zinc/72/55/59/487725559.db2.gz YTIJCUZPPRLCPF-UHFFFAOYSA-N 1 1 241.338 3.562 20 0 BHADMO c1cc2cc[nH+]cc2c(NC2CCCC2)c1 ZINC000082797799 388622779 /nfs/dbraw/zinc/62/27/79/388622779.db2.gz KFHXMAKKHLIJLQ-UHFFFAOYSA-N 1 1 212.296 3.589 20 0 BHADMO Cc1ccc[nH+]c1NC[C@@H](C)c1ccccc1 ZINC000083354855 188316108 /nfs/dbraw/zinc/31/61/08/188316108.db2.gz CAPQXQJEWGCARV-CYBMUJFWSA-N 1 1 226.323 3.606 20 0 BHADMO Cc1ccc[nH+]c1NC[C@H](C)c1ccccc1 ZINC000083354856 384762675 /nfs/dbraw/zinc/76/26/75/384762675.db2.gz CAPQXQJEWGCARV-ZDUSSCGKSA-N 1 1 226.323 3.606 20 0 BHADMO Cc1ccc(CNc2[nH+]cccc2C)cc1C ZINC000083354857 387404239 /nfs/dbraw/zinc/40/42/39/387404239.db2.gz JULFHDCRCMSMLA-UHFFFAOYSA-N 1 1 226.323 3.619 20 0 BHADMO Cc1ccc(C)c(CNc2[nH+]cccc2C)c1 ZINC000083354858 387405118 /nfs/dbraw/zinc/40/51/18/387405118.db2.gz JUPVRLZGPSOCBB-UHFFFAOYSA-N 1 1 226.323 3.619 20 0 BHADMO Cc1cc(C)cc(CNc2[nH+]cccc2C)c1 ZINC000083354859 398278224 /nfs/dbraw/zinc/27/82/24/398278224.db2.gz TUUCWSDKZJGTEP-UHFFFAOYSA-N 1 1 226.323 3.619 20 0 BHADMO Cc1cccc(C)c1CNc1[nH+]cccc1C ZINC000083354860 388048597 /nfs/dbraw/zinc/04/85/97/388048597.db2.gz FJEBIHGQZTWNFD-UHFFFAOYSA-N 1 1 226.323 3.619 20 0 BHADMO Cc1cccc(CNc2[nH+]cccc2C)c1C ZINC000083354861 388049164 /nfs/dbraw/zinc/04/91/64/388049164.db2.gz RIRVOWLEPBAKMQ-UHFFFAOYSA-N 1 1 226.323 3.619 20 0 BHADMO CCc1ccc(CNc2ccc(C)c[nH+]2)cc1 ZINC000083354862 387404890 /nfs/dbraw/zinc/40/48/90/387404890.db2.gz YUJSSYNVWOVYCO-UHFFFAOYSA-N 1 1 226.323 3.565 20 0 BHADMO Cc1ccc(NC[C@@H](C)c2ccccc2)[nH+]c1 ZINC000083354863 387404300 /nfs/dbraw/zinc/40/43/00/387404300.db2.gz QRNIKEVIFNUQRY-CYBMUJFWSA-N 1 1 226.323 3.606 20 0 BHADMO Cc1ccc(NC[C@H](C)c2ccccc2)[nH+]c1 ZINC000083354864 387404428 /nfs/dbraw/zinc/40/44/28/387404428.db2.gz QRNIKEVIFNUQRY-ZDUSSCGKSA-N 1 1 226.323 3.606 20 0 BHADMO Cc1ccc(NCc2ccc(C)c(C)c2)[nH+]c1 ZINC000083354865 643435107 /nfs/dbraw/zinc/43/51/07/643435107.db2.gz PAXVNYWHPOWLNW-UHFFFAOYSA-N 1 1 226.323 3.619 20 0 BHADMO Cc1ccc(NCc2cc(C)ccc2C)[nH+]c1 ZINC000083354866 643437024 /nfs/dbraw/zinc/43/70/24/643437024.db2.gz CJSGXJGPLGXTNS-UHFFFAOYSA-N 1 1 226.323 3.619 20 0 BHADMO Cc1ccc(NCc2cc(C)cc(C)c2)[nH+]c1 ZINC000083354867 643438404 /nfs/dbraw/zinc/43/84/04/643438404.db2.gz PHQAECWPKFEWJL-UHFFFAOYSA-N 1 1 226.323 3.619 20 0 BHADMO Cc1ccc(NCc2c(C)cccc2C)[nH+]c1 ZINC000083354868 643437968 /nfs/dbraw/zinc/43/79/68/643437968.db2.gz UUWAGGLGHCFYSO-UHFFFAOYSA-N 1 1 226.323 3.619 20 0 BHADMO Cc1ccc(NCc2cccc(C)c2C)[nH+]c1 ZINC000083354869 643438585 /nfs/dbraw/zinc/43/85/85/643438585.db2.gz BWLXZCFIBHULBB-UHFFFAOYSA-N 1 1 226.323 3.619 20 0 BHADMO CCc1ccc(CNc2cccc(C)[nH+]2)cc1 ZINC000083354870 388049382 /nfs/dbraw/zinc/04/93/82/388049382.db2.gz REDKNRDKPORPPW-UHFFFAOYSA-N 1 1 226.323 3.565 20 0 BHADMO Cc1cc(C)cc(CNc2cccc(C)[nH+]2)c1 ZINC000083354875 491161299 /nfs/dbraw/zinc/16/12/99/491161299.db2.gz SVRAYMOTPRLQPK-UHFFFAOYSA-N 1 1 226.323 3.619 20 0 BHADMO CCc1ccc(CNc2cc(C)cc[nH+]2)cc1 ZINC000083354881 387405335 /nfs/dbraw/zinc/40/53/35/387405335.db2.gz FSLRGYBEWCHMNZ-UHFFFAOYSA-N 1 1 226.323 3.565 20 0 BHADMO Cc1cc[nH+]c(NCc2cc(C)cc(C)c2)c1 ZINC000083354886 491161304 /nfs/dbraw/zinc/16/13/04/491161304.db2.gz KGRZIYXLTKZHDX-UHFFFAOYSA-N 1 1 226.323 3.619 20 0 BHADMO CCCc1ccc(CNc2ccc(C)c[nH+]2)cc1 ZINC000083368627 643441136 /nfs/dbraw/zinc/44/11/36/643441136.db2.gz HZMIPHPHIYPWEG-UHFFFAOYSA-N 1 1 240.350 3.955 20 0 BHADMO Cc1ccc[nH+]c1NC/C=C/c1ccc(F)cc1 ZINC000083370463 387405299 /nfs/dbraw/zinc/40/52/99/387405299.db2.gz PBPOTDGXGLIDGW-HWKANZROSA-N 1 1 242.297 3.654 20 0 BHADMO Cc1ccc(NC/C=C/c2ccc(F)cc2)[nH+]c1 ZINC000083370464 643440730 /nfs/dbraw/zinc/44/07/30/643440730.db2.gz ZHRWIPJGQRMSGN-NSCUHMNNSA-N 1 1 242.297 3.654 20 0 BHADMO CSc1ccc(CNc2[nH+]cccc2C)cc1 ZINC000083373064 259338436 /nfs/dbraw/zinc/33/84/36/259338436.db2.gz XYAWEMUQFBVQIM-UHFFFAOYSA-N 1 1 244.363 3.724 20 0 BHADMO Cc1cccc(NCc2cc(Cl)ccc2C)[nH+]1 ZINC000083376196 643444378 /nfs/dbraw/zinc/44/43/78/643444378.db2.gz XHWNEIVWJFZINH-UHFFFAOYSA-N 1 1 246.741 3.964 20 0 BHADMO Cc1cc[nH+]c(NCc2cc(Cl)ccc2C)c1 ZINC000083376199 643443138 /nfs/dbraw/zinc/44/31/38/643443138.db2.gz WWPCEJOTTRRDNM-UHFFFAOYSA-N 1 1 246.741 3.964 20 0 BHADMO C(=C/c1ccccc1)\CNc1[nH]c2ccccc2[nH+]1 ZINC000083380969 188098015 /nfs/dbraw/zinc/09/80/15/188098015.db2.gz BXLZNWLYCMATLD-RMKNXTFCSA-N 1 1 249.317 3.688 20 0 BHADMO Cc1ccc(C[NH2+][C@@H]2CSc3ccccc32)o1 ZINC000083748692 388060527 /nfs/dbraw/zinc/06/05/27/388060527.db2.gz MUUXWFIXNQNURJ-CYBMUJFWSA-N 1 1 245.347 3.525 20 0 BHADMO Cc1ccc(C[NH2+][C@H]2CSc3ccccc32)o1 ZINC000083748694 388060516 /nfs/dbraw/zinc/06/05/16/388060516.db2.gz MUUXWFIXNQNURJ-ZDUSSCGKSA-N 1 1 245.347 3.525 20 0 BHADMO CC[C@@H](C)C[C@@H](C)Nc1cc(C)cc[nH+]1 ZINC000083865234 387426099 /nfs/dbraw/zinc/42/60/99/387426099.db2.gz VNHGVVVVFDBEDN-ZYHUDNBSSA-N 1 1 206.333 3.627 20 0 BHADMO CC[C@H](C)C[C@@H](C)Nc1cc(C)cc[nH+]1 ZINC000083865235 387426551 /nfs/dbraw/zinc/42/65/51/387426551.db2.gz VNHGVVVVFDBEDN-CMPLNLGQSA-N 1 1 206.333 3.627 20 0 BHADMO CC[C@@H](C)C[C@H](C)Nc1cc(C)cc[nH+]1 ZINC000083865236 387426232 /nfs/dbraw/zinc/42/62/32/387426232.db2.gz VNHGVVVVFDBEDN-PWSUYJOCSA-N 1 1 206.333 3.627 20 0 BHADMO CC[C@H](C)C[C@H](C)Nc1cc(C)cc[nH+]1 ZINC000083865237 387426256 /nfs/dbraw/zinc/42/62/56/387426256.db2.gz VNHGVVVVFDBEDN-JQWIXIFHSA-N 1 1 206.333 3.627 20 0 BHADMO CC[C@@H](C)C[C@@H](C)Nc1cccc(C)[nH+]1 ZINC000083865270 343507461 /nfs/dbraw/zinc/50/74/61/343507461.db2.gz RHTOTVFGIXCTRX-ZYHUDNBSSA-N 1 1 206.333 3.627 20 0 BHADMO CC[C@H](C)C[C@@H](C)Nc1cccc(C)[nH+]1 ZINC000083865271 343507473 /nfs/dbraw/zinc/50/74/73/343507473.db2.gz RHTOTVFGIXCTRX-CMPLNLGQSA-N 1 1 206.333 3.627 20 0 BHADMO CC[C@@H](C)C[C@H](C)Nc1cccc(C)[nH+]1 ZINC000083865272 351963246 /nfs/dbraw/zinc/96/32/46/351963246.db2.gz RHTOTVFGIXCTRX-PWSUYJOCSA-N 1 1 206.333 3.627 20 0 BHADMO CC[C@H](C)C[C@H](C)Nc1cccc(C)[nH+]1 ZINC000083865273 343507454 /nfs/dbraw/zinc/50/74/54/343507454.db2.gz RHTOTVFGIXCTRX-JQWIXIFHSA-N 1 1 206.333 3.627 20 0 BHADMO Cc1ccc(N[C@@H]2CCCCC[C@@H]2C)[nH+]c1 ZINC000083949619 343689084 /nfs/dbraw/zinc/68/90/84/343689084.db2.gz XTJCMHUAEYCNCN-QWHCGFSZSA-N 1 1 218.344 3.771 20 0 BHADMO Cc1ccc(N[C@H]2CCCCC[C@@H]2C)[nH+]c1 ZINC000083949620 343689077 /nfs/dbraw/zinc/68/90/77/343689077.db2.gz XTJCMHUAEYCNCN-STQMWFEESA-N 1 1 218.344 3.771 20 0 BHADMO Cc1ccc(N[C@@H]2CCCCC[C@H]2C)[nH+]c1 ZINC000083949621 343688961 /nfs/dbraw/zinc/68/89/61/343688961.db2.gz XTJCMHUAEYCNCN-CHWSQXEVSA-N 1 1 218.344 3.771 20 0 BHADMO Cc1ccc(N[C@H]2CCCCC[C@H]2C)[nH+]c1 ZINC000083949622 343688779 /nfs/dbraw/zinc/68/87/79/343688779.db2.gz XTJCMHUAEYCNCN-OLZOCXBDSA-N 1 1 218.344 3.771 20 0 BHADMO CC(C)CC[N@@H+](CCC(F)(F)F)CC1CC1 ZINC000084137620 387438150 /nfs/dbraw/zinc/43/81/50/387438150.db2.gz GWYVYVIOLDADBR-UHFFFAOYSA-N 1 1 237.309 3.697 20 0 BHADMO FC(F)(F)CC[N@@H+](CC1CC1)CC1CCCC1 ZINC000084138123 388652661 /nfs/dbraw/zinc/65/26/61/388652661.db2.gz OKPWRRGLBOKABU-UHFFFAOYSA-N 1 1 249.320 3.841 20 0 BHADMO CCCCC[N@@H+](CCC(F)(F)F)CC1CC1 ZINC000084138163 387437398 /nfs/dbraw/zinc/43/73/98/387437398.db2.gz NWLZSCZJHUHBKT-UHFFFAOYSA-N 1 1 237.309 3.841 20 0 BHADMO CC(C)=CC[N@@H+](CCC(F)(F)F)CC1CC1 ZINC000084138421 384583151 /nfs/dbraw/zinc/58/31/51/384583151.db2.gz NOLXLCWMSKYAJM-UHFFFAOYSA-N 1 1 235.293 3.617 20 0 BHADMO CCc1ccccc1CNc1cc(C)cc[nH+]1 ZINC000084205004 388074278 /nfs/dbraw/zinc/07/42/78/388074278.db2.gz CHBFONFDCZHVTI-UHFFFAOYSA-N 1 1 226.323 3.565 20 0 BHADMO CCc1ccccc1CNc1cccc(C)[nH+]1 ZINC000084205052 388073234 /nfs/dbraw/zinc/07/32/34/388073234.db2.gz RUCYEWMEHGHOQE-UHFFFAOYSA-N 1 1 226.323 3.565 20 0 BHADMO Cc1ccc(N[C@@H]2CC[N@H+](C)C(C)(C)C2)c(C)c1 ZINC000084566760 488063566 /nfs/dbraw/zinc/06/35/66/488063566.db2.gz NLXWVACHHQXCOZ-CQSZACIVSA-N 1 1 246.398 3.588 20 0 BHADMO Cc1ccc(N[C@H]2CC[N@H+](C)C(C)(C)C2)c(C)c1 ZINC000084566762 488063605 /nfs/dbraw/zinc/06/36/05/488063605.db2.gz NLXWVACHHQXCOZ-AWEZNQCLSA-N 1 1 246.398 3.588 20 0 BHADMO Cc1ccc(C)c(N[C@@H]2CC[N@H+](C)C(C)(C)C2)c1 ZINC000084566766 488063898 /nfs/dbraw/zinc/06/38/98/488063898.db2.gz DCHBBKTXHMELIK-CQSZACIVSA-N 1 1 246.398 3.588 20 0 BHADMO Cc1ccc(C)c(N[C@H]2CC[N@H+](C)C(C)(C)C2)c1 ZINC000084566770 488063788 /nfs/dbraw/zinc/06/37/88/488063788.db2.gz DCHBBKTXHMELIK-AWEZNQCLSA-N 1 1 246.398 3.588 20 0 BHADMO Cc1ccc(N[C@@H]2CC[N@H+](C)C(C)(C)C2)cc1C ZINC000084566773 488063634 /nfs/dbraw/zinc/06/36/34/488063634.db2.gz 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/nfs/dbraw/zinc/06/35/88/488063588.db2.gz ZRYKLUMRKZZQJY-CQSZACIVSA-N 1 1 246.398 3.534 20 0 BHADMO CCc1ccccc1N[C@H]1CC[N@@H+](C)C(C)(C)C1 ZINC000084566789 488063469 /nfs/dbraw/zinc/06/34/69/488063469.db2.gz ZRYKLUMRKZZQJY-AWEZNQCLSA-N 1 1 246.398 3.534 20 0 BHADMO CCc1ccc(N[C@@H]2CC[N@@H+](C)C(C)(C)C2)cc1 ZINC000084566791 488063814 /nfs/dbraw/zinc/06/38/14/488063814.db2.gz SQCBCAVUIOCGOC-OAHLLOKOSA-N 1 1 246.398 3.534 20 0 BHADMO CCc1ccc(N[C@H]2CC[N@@H+](C)C(C)(C)C2)cc1 ZINC000084566792 488063876 /nfs/dbraw/zinc/06/38/76/488063876.db2.gz SQCBCAVUIOCGOC-HNNXBMFYSA-N 1 1 246.398 3.534 20 0 BHADMO CC(C)C[N@@H+](Cc1cccc(Cl)n1)C(C)C ZINC000085696842 643770189 /nfs/dbraw/zinc/77/01/89/643770189.db2.gz JTYUFVKWRZSKGF-UHFFFAOYSA-N 1 1 240.778 3.601 20 0 BHADMO C[C@H]([N@@H+](C)Cc1cccc(Cl)n1)C(C)(C)C ZINC000085734134 644451183 /nfs/dbraw/zinc/45/11/83/644451183.db2.gz SMYHBDNAVVXJOJ-JTQLQIEISA-N 1 1 240.778 3.601 20 0 BHADMO C[C@@H]([N@@H+](C)Cc1cccc(Cl)n1)C(C)(C)C ZINC000085734135 644451773 /nfs/dbraw/zinc/45/17/73/644451773.db2.gz SMYHBDNAVVXJOJ-SNVBAGLBSA-N 1 1 240.778 3.601 20 0 BHADMO C[C@H]([NH2+]C/C(Cl)=C/Cl)c1ccccc1 ZINC000085976821 384582156 /nfs/dbraw/zinc/58/21/56/384582156.db2.gz LSKPNAWEIKZSAC-MKVDPYIPSA-N 1 1 230.138 3.656 20 0 BHADMO C[C@@H]([NH2+]C/C(Cl)=C/Cl)c1ccccc1 ZINC000085976826 384583728 /nfs/dbraw/zinc/58/37/28/384583728.db2.gz LSKPNAWEIKZSAC-MDXIRLPMSA-N 1 1 230.138 3.656 20 0 BHADMO Cc1ccc([C@@H](C)[NH2+]C/C(Cl)=C/Cl)cc1 ZINC000085978471 643870316 /nfs/dbraw/zinc/87/03/16/643870316.db2.gz VUOZMKAINNMCQU-VPMLRQHESA-N 1 1 244.165 3.965 20 0 BHADMO Cc1ccc([C@H](C)[NH2+]C/C(Cl)=C/Cl)cc1 ZINC000085978475 643870151 /nfs/dbraw/zinc/87/01/51/643870151.db2.gz VUOZMKAINNMCQU-BZPKPHBRSA-N 1 1 244.165 3.965 20 0 BHADMO C[C@H]([NH2+]C/C(Cl)=C/Cl)c1ccsc1 ZINC000085979059 643875497 /nfs/dbraw/zinc/87/54/97/643875497.db2.gz GUWSQOQASSXONG-YHESJLBYSA-N 1 1 236.167 3.718 20 0 BHADMO C[C@@H]([NH2+]C/C(Cl)=C/Cl)c1ccsc1 ZINC000085979062 643875132 /nfs/dbraw/zinc/87/51/32/643875132.db2.gz GUWSQOQASSXONG-CPLNQPMESA-N 1 1 236.167 3.718 20 0 BHADMO CC(C)c1ccc([C@@H](C)[NH2+]Cc2ccon2)cc1 ZINC000086485622 385020769 /nfs/dbraw/zinc/02/07/69/385020769.db2.gz MAFPRRYWKYYSNE-GFCCVEGCSA-N 1 1 244.338 3.649 20 0 BHADMO CC(C)c1ccc([C@H](C)[NH2+]Cc2ccon2)cc1 ZINC000086485623 385020660 /nfs/dbraw/zinc/02/06/60/385020660.db2.gz MAFPRRYWKYYSNE-LBPRGKRZSA-N 1 1 244.338 3.649 20 0 BHADMO C[N@@H+](Cc1cnc(Cl)s1)C1CCCCC1 ZINC000086776399 385044267 /nfs/dbraw/zinc/04/42/67/385044267.db2.gz ZYHSNWDREYVIAS-UHFFFAOYSA-N 1 1 244.791 3.561 20 0 BHADMO CC[N@@H+](Cc1cnc(Cl)s1)C1CCCC1 ZINC000086776480 343628615 /nfs/dbraw/zinc/62/86/15/343628615.db2.gz WHPKPCJCHZEUNT-UHFFFAOYSA-N 1 1 244.791 3.561 20 0 BHADMO CCCC[N@@H+](Cc1cnc(Cl)s1)C1CC1 ZINC000086776630 384684246 /nfs/dbraw/zinc/68/42/46/384684246.db2.gz OORRGKYOYQQSRJ-UHFFFAOYSA-N 1 1 244.791 3.561 20 0 BHADMO CC(C)C[N@@H+](Cc1cnc(Cl)s1)C(C)C ZINC000086776730 344222579 /nfs/dbraw/zinc/22/25/79/344222579.db2.gz XZUPSCFVWCOMQZ-UHFFFAOYSA-N 1 1 246.807 3.663 20 0 BHADMO C[C@H]([N@@H+](C)Cc1cnc(Cl)s1)C(C)(C)C ZINC000086776753 643638719 /nfs/dbraw/zinc/63/87/19/643638719.db2.gz UBAYAGQNWQCXNS-QMMMGPOBSA-N 1 1 246.807 3.663 20 0 BHADMO C[C@@H]([N@@H+](C)Cc1cnc(Cl)s1)C(C)(C)C ZINC000086776755 643639539 /nfs/dbraw/zinc/63/95/39/643639539.db2.gz UBAYAGQNWQCXNS-MRVPVSSYSA-N 1 1 246.807 3.663 20 0 BHADMO C[C@@H]1CCCCC[N@H+]1Cc1cnc(Cl)s1 ZINC000086776939 644178792 /nfs/dbraw/zinc/17/87/92/644178792.db2.gz ZYAWXDGXHYOPIL-SECBINFHSA-N 1 1 244.791 3.561 20 0 BHADMO C[C@H]1CCCCC[N@H+]1Cc1cnc(Cl)s1 ZINC000086776941 644178937 /nfs/dbraw/zinc/17/89/37/644178937.db2.gz ZYAWXDGXHYOPIL-VIFPVBQESA-N 1 1 244.791 3.561 20 0 BHADMO CC[C@@H](C)C[N@@H+](CC)Cc1cnc(Cl)s1 ZINC000086777009 644178970 /nfs/dbraw/zinc/17/89/70/644178970.db2.gz WSFSVCUYFDCDTJ-SECBINFHSA-N 1 1 246.807 3.665 20 0 BHADMO CC[C@H](C)C[N@@H+](CC)Cc1cnc(Cl)s1 ZINC000086777011 644178833 /nfs/dbraw/zinc/17/88/33/644178833.db2.gz WSFSVCUYFDCDTJ-VIFPVBQESA-N 1 1 246.807 3.665 20 0 BHADMO C[C@H](Nc1cc[nH+]cc1Cl)c1ccccc1 ZINC000086778288 388108762 /nfs/dbraw/zinc/10/87/62/388108762.db2.gz CKNXZJAEFXFWKV-JTQLQIEISA-N 1 1 232.714 3.908 20 0 BHADMO C[C@@H](Nc1cc[nH+]cc1Cl)c1ccccc1 ZINC000086778290 388108758 /nfs/dbraw/zinc/10/87/58/388108758.db2.gz CKNXZJAEFXFWKV-SNVBAGLBSA-N 1 1 232.714 3.908 20 0 BHADMO Cc1ccc(CNc2cc[nH+]cc2Cl)cc1 ZINC000086778364 388108751 /nfs/dbraw/zinc/10/87/51/388108751.db2.gz HZWBQYSFLZCNHV-UHFFFAOYSA-N 1 1 232.714 3.656 20 0 BHADMO Cc1ccccc1CNc1cc[nH+]cc1Cl ZINC000086778387 388108685 /nfs/dbraw/zinc/10/86/85/388108685.db2.gz YAJIPMNBXYLCOW-UHFFFAOYSA-N 1 1 232.714 3.656 20 0 BHADMO Cc1cccc(CNc2cc[nH+]cc2Cl)c1 ZINC000086831206 135097803 /nfs/dbraw/zinc/09/78/03/135097803.db2.gz IGGUZHOESGSAJD-UHFFFAOYSA-N 1 1 232.714 3.656 20 0 BHADMO CC(C)CCCNc1cc[nH+]cc1Cl ZINC000086831208 135097852 /nfs/dbraw/zinc/09/78/52/135097852.db2.gz WXJPYSZHJNOFIK-UHFFFAOYSA-N 1 1 212.724 3.583 20 0 BHADMO Cc1ccc(CNc2cc[nH+]cc2Cl)s1 ZINC000086831225 384698219 /nfs/dbraw/zinc/69/82/19/384698219.db2.gz ZZSGOGGTDZGMPR-UHFFFAOYSA-N 1 1 238.743 3.717 20 0 BHADMO Cc1ccsc1CNc1cc[nH+]cc1Cl ZINC000086831263 384698149 /nfs/dbraw/zinc/69/81/49/384698149.db2.gz DYPMTLXJUKFMMN-UHFFFAOYSA-N 1 1 238.743 3.717 20 0 BHADMO CCC[C@@H](CC)Nc1cc[nH+]cc1Cl ZINC000086831271 388512425 /nfs/dbraw/zinc/51/24/25/388512425.db2.gz IRXRDLXPCCPQCJ-SECBINFHSA-N 1 1 212.724 3.726 20 0 BHADMO CCC[C@H](CC)Nc1cc[nH+]cc1Cl ZINC000086831272 388512965 /nfs/dbraw/zinc/51/29/65/388512965.db2.gz IRXRDLXPCCPQCJ-VIFPVBQESA-N 1 1 212.724 3.726 20 0 BHADMO Clc1c[nH+]ccc1NCC(C1CC1)C1CC1 ZINC000086831358 385051621 /nfs/dbraw/zinc/05/16/21/385051621.db2.gz KHLZEPVNNKCOSJ-UHFFFAOYSA-N 1 1 236.746 3.583 20 0 BHADMO CC1(C)CCC[C@@H]1Nc1cc[nH+]cc1Cl ZINC000086831412 135097707 /nfs/dbraw/zinc/09/77/07/135097707.db2.gz XVJPSABHSBGWIT-NSHDSACASA-N 1 1 224.735 3.726 20 0 BHADMO CC1(C)CCC[C@H]1Nc1cc[nH+]cc1Cl ZINC000086831413 535308859 /nfs/dbraw/zinc/30/88/59/535308859.db2.gz XVJPSABHSBGWIT-LLVKDONJSA-N 1 1 224.735 3.726 20 0 BHADMO CC(C)C[C@@H](C)Nc1cc[nH+]cc1Cl ZINC000086833035 388512817 /nfs/dbraw/zinc/51/28/17/388512817.db2.gz BLSQFXVJNSMELX-SECBINFHSA-N 1 1 212.724 3.582 20 0 BHADMO CC(C)C[C@H](C)Nc1cc[nH+]cc1Cl ZINC000086833036 256799562 /nfs/dbraw/zinc/79/95/62/256799562.db2.gz BLSQFXVJNSMELX-VIFPVBQESA-N 1 1 212.724 3.582 20 0 BHADMO CC[C@@H](C)[C@@H](C)Nc1cc[nH+]cc1Cl ZINC000086833095 398192202 /nfs/dbraw/zinc/19/22/02/398192202.db2.gz ARURIWNHDVHYET-RKDXNWHRSA-N 1 1 212.724 3.582 20 0 BHADMO CC[C@H](C)[C@@H](C)Nc1cc[nH+]cc1Cl ZINC000086833096 398192006 /nfs/dbraw/zinc/19/20/06/398192006.db2.gz ARURIWNHDVHYET-DTWKUNHWSA-N 1 1 212.724 3.582 20 0 BHADMO CC[C@@H](C)[C@H](C)Nc1cc[nH+]cc1Cl ZINC000086833097 398192289 /nfs/dbraw/zinc/19/22/89/398192289.db2.gz ARURIWNHDVHYET-BDAKNGLRSA-N 1 1 212.724 3.582 20 0 BHADMO CC[C@H](C)[C@H](C)Nc1cc[nH+]cc1Cl ZINC000086833098 398192186 /nfs/dbraw/zinc/19/21/86/398192186.db2.gz ARURIWNHDVHYET-IUCAKERBSA-N 1 1 212.724 3.582 20 0 BHADMO C[C@H](Nc1cc[nH+]cc1Cl)c1ccsc1 ZINC000086833173 491064654 /nfs/dbraw/zinc/06/46/54/491064654.db2.gz QYYAIMCLYRLXGX-QMMMGPOBSA-N 1 1 238.743 3.970 20 0 BHADMO C[C@@H](Nc1cc[nH+]cc1Cl)c1ccsc1 ZINC000086833174 491064630 /nfs/dbraw/zinc/06/46/30/491064630.db2.gz QYYAIMCLYRLXGX-MRVPVSSYSA-N 1 1 238.743 3.970 20 0 BHADMO Cc1ccc(N[C@@H](C)CC(C)C)c(C)[nH+]1 ZINC000087151501 384202101 /nfs/dbraw/zinc/20/21/01/384202101.db2.gz ABLSSAJUGAJCII-NSHDSACASA-N 1 1 206.333 3.545 20 0 BHADMO Cc1ccc(N[C@H](C)CC(C)C)c(C)[nH+]1 ZINC000087151503 384202238 /nfs/dbraw/zinc/20/22/38/384202238.db2.gz ABLSSAJUGAJCII-LLVKDONJSA-N 1 1 206.333 3.545 20 0 BHADMO Cc1ccc(NCCC(C)(C)C)c(C)[nH+]1 ZINC000087151791 135107913 /nfs/dbraw/zinc/10/79/13/135107913.db2.gz MEKFJGWJNSPQBY-UHFFFAOYSA-N 1 1 206.333 3.547 20 0 BHADMO C[C@H]([NH2+]Cc1ccccc1Cl)c1ccoc1 ZINC000087289444 384927555 /nfs/dbraw/zinc/92/75/55/384927555.db2.gz KLSVCLKEPHFZIA-JTQLQIEISA-N 1 1 235.714 3.784 20 0 BHADMO C[C@@H]([NH2+]Cc1ccccc1Cl)c1ccoc1 ZINC000087289445 322874203 /nfs/dbraw/zinc/87/42/03/322874203.db2.gz KLSVCLKEPHFZIA-SNVBAGLBSA-N 1 1 235.714 3.784 20 0 BHADMO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccoc2)o1 ZINC000087289796 491067655 /nfs/dbraw/zinc/06/76/55/491067655.db2.gz PEUJSWFKHGCWCL-WDEREUQCSA-N 1 1 219.284 3.593 20 0 BHADMO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2ccoc2)o1 ZINC000087289797 491067594 /nfs/dbraw/zinc/06/75/94/491067594.db2.gz PEUJSWFKHGCWCL-QWRGUYRKSA-N 1 1 219.284 3.593 20 0 BHADMO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2ccoc2)o1 ZINC000087289798 491067627 /nfs/dbraw/zinc/06/76/27/491067627.db2.gz PEUJSWFKHGCWCL-GHMZBOCLSA-N 1 1 219.284 3.593 20 0 BHADMO Cc1ccc([C@H](C)[NH2+][C@H](C)c2ccoc2)o1 ZINC000087289799 491067590 /nfs/dbraw/zinc/06/75/90/491067590.db2.gz PEUJSWFKHGCWCL-MNOVXSKESA-N 1 1 219.284 3.593 20 0 BHADMO Cc1cscc1CNc1cc[nH+]cc1Cl ZINC000087311160 135122771 /nfs/dbraw/zinc/12/27/71/135122771.db2.gz GLUGWJKBMHUIFD-UHFFFAOYSA-N 1 1 238.743 3.717 20 0 BHADMO CC(C)CCNc1cccc2cc[nH+]cc21 ZINC000087377149 383832893 /nfs/dbraw/zinc/83/28/93/383832893.db2.gz MKLVVFJXOLJDIB-UHFFFAOYSA-N 1 1 214.312 3.693 20 0 BHADMO CCC(CC)Nc1cccc2cc[nH+]cc21 ZINC000087521275 388708186 /nfs/dbraw/zinc/70/81/86/388708186.db2.gz WQFBZAPFNAXUDK-UHFFFAOYSA-N 1 1 214.312 3.835 20 0 BHADMO CC[C@@H](C)CNc1cccc2cc[nH+]cc21 ZINC000087521279 325637016 /nfs/dbraw/zinc/63/70/16/325637016.db2.gz CRIMARWWFJEJAM-LLVKDONJSA-N 1 1 214.312 3.693 20 0 BHADMO CC[C@H](C)CNc1cccc2cc[nH+]cc21 ZINC000087521280 388707332 /nfs/dbraw/zinc/70/73/32/388707332.db2.gz CRIMARWWFJEJAM-NSHDSACASA-N 1 1 214.312 3.693 20 0 BHADMO CC(C)[C@@H](C)Nc1cccc2cc[nH+]cc21 ZINC000087521288 384981849 /nfs/dbraw/zinc/98/18/49/384981849.db2.gz XSFVZZYDXXUUJX-LLVKDONJSA-N 1 1 214.312 3.691 20 0 BHADMO CC(C)[C@H](C)Nc1cccc2cc[nH+]cc21 ZINC000087521289 384979264 /nfs/dbraw/zinc/97/92/64/384979264.db2.gz XSFVZZYDXXUUJX-NSHDSACASA-N 1 1 214.312 3.691 20 0 BHADMO CCC[C@@H](C)Nc1cccc2cc[nH+]cc21 ZINC000087521290 322885933 /nfs/dbraw/zinc/88/59/33/322885933.db2.gz CLVUWYNCUJUEMQ-LLVKDONJSA-N 1 1 214.312 3.835 20 0 BHADMO CCC[C@H](C)Nc1cccc2cc[nH+]cc21 ZINC000087521291 384981004 /nfs/dbraw/zinc/98/10/04/384981004.db2.gz CLVUWYNCUJUEMQ-NSHDSACASA-N 1 1 214.312 3.835 20 0 BHADMO CC(C)(C)C(=O)CC[N@H+]1CCCC(C)(C)CC1 ZINC000087659718 644501450 /nfs/dbraw/zinc/50/14/50/644501450.db2.gz VWWKWBNNRWIMJD-UHFFFAOYSA-N 1 1 239.403 3.504 20 0 BHADMO C[C@H]([NH2+]CCF)c1ccc(Cl)cc1Cl ZINC000087689860 384832655 /nfs/dbraw/zinc/83/26/55/384832655.db2.gz WSPUMGNZQULGNB-ZETCQYMHSA-N 1 1 236.117 3.614 20 0 BHADMO C[C@@H]([NH2+]CCF)c1ccc(Cl)cc1Cl ZINC000087689861 384833229 /nfs/dbraw/zinc/83/32/29/384833229.db2.gz WSPUMGNZQULGNB-SSDOTTSWSA-N 1 1 236.117 3.614 20 0 BHADMO Cc1[nH+]ccn1Cc1cc(Cl)ccc1Cl ZINC000087758281 343658735 /nfs/dbraw/zinc/65/87/35/343658735.db2.gz AKSANEFEVJGSII-UHFFFAOYSA-N 1 1 241.121 3.547 20 0 BHADMO CCc1cc(N[C@@H](C)c2ccccc2)nc(C)[nH+]1 ZINC000088058172 359934427 /nfs/dbraw/zinc/93/44/27/359934427.db2.gz SUVYMJFJDJELFP-NSHDSACASA-N 1 1 241.338 3.521 20 0 BHADMO CCc1cc(N[C@H](C)c2ccccc2)nc(C)[nH+]1 ZINC000088058173 359933945 /nfs/dbraw/zinc/93/39/45/359933945.db2.gz SUVYMJFJDJELFP-LLVKDONJSA-N 1 1 241.338 3.521 20 0 BHADMO C[C@@H]1CCC[N@@H+](CCSc2ccccc2)[C@@H]1C ZINC000088077833 384007316 /nfs/dbraw/zinc/00/73/16/384007316.db2.gz WRBXGUJMIKKRRJ-ZIAGYGMSSA-N 1 1 249.423 3.899 20 0 BHADMO C[C@@H]1[C@@H](C)CCC[N@H+]1CCSc1ccccc1 ZINC000088077834 384008231 /nfs/dbraw/zinc/00/82/31/384008231.db2.gz WRBXGUJMIKKRRJ-UONOGXRCSA-N 1 1 249.423 3.899 20 0 BHADMO CC[C@@H](C)C[N@@H+](C)[C@@H](C)c1sc(C)nc1C ZINC000088509885 359964363 /nfs/dbraw/zinc/96/43/63/359964363.db2.gz BTDDKBWHNAEYPZ-KOLCDFICSA-N 1 1 240.416 3.799 20 0 BHADMO CC[C@H](C)C[N@@H+](C)[C@@H](C)c1sc(C)nc1C ZINC000088509886 359964898 /nfs/dbraw/zinc/96/48/98/359964898.db2.gz BTDDKBWHNAEYPZ-ONGXEEELSA-N 1 1 240.416 3.799 20 0 BHADMO CC[C@@H](C)C[N@H+]1CCCC[C@@H]1c1cccn1C ZINC000088537362 383908579 /nfs/dbraw/zinc/90/85/79/383908579.db2.gz UXHOGGNYMJSLKP-UKRRQHHQSA-N 1 1 234.387 3.598 20 0 BHADMO CC[C@H](C)C[N@H+]1CCCC[C@@H]1c1cccn1C ZINC000088537363 383907986 /nfs/dbraw/zinc/90/79/86/383907986.db2.gz UXHOGGNYMJSLKP-DZGCQCFKSA-N 1 1 234.387 3.598 20 0 BHADMO CC[C@@H](C)C[N@@H+](CCC(F)(F)F)CC1CC1 ZINC000088548200 388532144 /nfs/dbraw/zinc/53/21/44/388532144.db2.gz HGZKQXBWXZQXSE-SNVBAGLBSA-N 1 1 237.309 3.697 20 0 BHADMO CC[C@H](C)C[N@@H+](CCC(F)(F)F)CC1CC1 ZINC000088548201 388532374 /nfs/dbraw/zinc/53/23/74/388532374.db2.gz HGZKQXBWXZQXSE-JTQLQIEISA-N 1 1 237.309 3.697 20 0 BHADMO CC[N@@H+](Cc1nc(C)cs1)C1CCCCC1 ZINC000088577894 383912634 /nfs/dbraw/zinc/91/26/34/383912634.db2.gz XPPJHEURBXSFIO-UHFFFAOYSA-N 1 1 238.400 3.606 20 0 BHADMO CC[N@@H+](Cc1nc(C)c(C)s1)C1CCCC1 ZINC000088578179 388532644 /nfs/dbraw/zinc/53/26/44/388532644.db2.gz NLCXTELKEJQWDF-UHFFFAOYSA-N 1 1 238.400 3.524 20 0 BHADMO CC[N@@H+](Cc1nc(C)c(C)s1)[C@@H](C)C(C)C ZINC000088586948 383912833 /nfs/dbraw/zinc/91/28/33/383912833.db2.gz KSAQHXQNOGSNBU-NSHDSACASA-N 1 1 240.416 3.626 20 0 BHADMO CC[N@@H+](Cc1nc(C)c(C)s1)[C@H](C)C(C)C ZINC000088586949 388531882 /nfs/dbraw/zinc/53/18/82/388531882.db2.gz KSAQHXQNOGSNBU-LLVKDONJSA-N 1 1 240.416 3.626 20 0 BHADMO Cc1nc(C[N@@H+]2[C@H](C)CCC[C@@H]2C)sc1C ZINC000088598762 388533699 /nfs/dbraw/zinc/53/36/99/388533699.db2.gz LHOGAFPWFSVVLK-AOOOYVTPSA-N 1 1 238.400 3.523 20 0 BHADMO Cc1nc(C[N@@H+]2CCCCC[C@@H]2C)sc1C ZINC000088599859 345542622 /nfs/dbraw/zinc/54/26/22/345542622.db2.gz QTPCTLIQAZONPL-JTQLQIEISA-N 1 1 238.400 3.524 20 0 BHADMO Cc1nc(C[N@@H+]2CCCCC[C@H]2C)sc1C ZINC000088599860 345542819 /nfs/dbraw/zinc/54/28/19/345542819.db2.gz QTPCTLIQAZONPL-SNVBAGLBSA-N 1 1 238.400 3.524 20 0 BHADMO CC[C@@H]1CCCCC[N@H+]1Cc1nc(C)cs1 ZINC000088601316 323081549 /nfs/dbraw/zinc/08/15/49/323081549.db2.gz YUXSWBRSIMBKIN-GFCCVEGCSA-N 1 1 238.400 3.606 20 0 BHADMO CC[C@H]1CCCCC[N@H+]1Cc1nc(C)cs1 ZINC000088601317 323081540 /nfs/dbraw/zinc/08/15/40/323081540.db2.gz YUXSWBRSIMBKIN-LBPRGKRZSA-N 1 1 238.400 3.606 20 0 BHADMO CCc1cc(N[C@H](C)c2cccs2)nc(C)[nH+]1 ZINC000088760142 491108263 /nfs/dbraw/zinc/10/82/63/491108263.db2.gz SLDRPHOKYWVKFQ-SECBINFHSA-N 1 1 247.367 3.582 20 0 BHADMO CCc1cc(N[C@@H](C)c2ccsc2)nc(C)[nH+]1 ZINC000088760386 491108492 /nfs/dbraw/zinc/10/84/92/491108492.db2.gz DGADTYBAHQEVCO-VIFPVBQESA-N 1 1 247.367 3.582 20 0 BHADMO CCc1cc(N[C@H](C)c2ccsc2)nc(C)[nH+]1 ZINC000088760387 491108526 /nfs/dbraw/zinc/10/85/26/491108526.db2.gz DGADTYBAHQEVCO-SECBINFHSA-N 1 1 247.367 3.582 20 0 BHADMO Cc1cccc(C)c1Nc1c[nH+]c2ccccn12 ZINC000089201146 179045219 /nfs/dbraw/zinc/04/52/19/179045219.db2.gz BFHYVWBDMUQOOK-UHFFFAOYSA-N 1 1 237.306 3.695 20 0 BHADMO CC[C@@H](c1ccccc1)[N@H+]1CCCSCC1 ZINC000089982800 388743075 /nfs/dbraw/zinc/74/30/75/388743075.db2.gz ZOPZTNBBCBECPA-AWEZNQCLSA-N 1 1 235.396 3.577 20 0 BHADMO CC[C@H](c1ccccc1)[N@H+]1CCCSCC1 ZINC000089982801 388743239 /nfs/dbraw/zinc/74/32/39/388743239.db2.gz ZOPZTNBBCBECPA-CQSZACIVSA-N 1 1 235.396 3.577 20 0 BHADMO COc1ccc([C@H](C)Nc2cc(C)cc[nH+]2)cc1 ZINC000090340462 175190182 /nfs/dbraw/zinc/19/01/82/175190182.db2.gz OTWIGMCSRXINJY-LBPRGKRZSA-N 1 1 242.322 3.572 20 0 BHADMO COc1ccc([C@@H](C)Nc2cc(C)cc[nH+]2)cc1 ZINC000090340463 175177693 /nfs/dbraw/zinc/17/76/93/175177693.db2.gz OTWIGMCSRXINJY-GFCCVEGCSA-N 1 1 242.322 3.572 20 0 BHADMO COc1ccc([C@H](C)Nc2cccc(C)[nH+]2)cc1 ZINC000090340482 175190344 /nfs/dbraw/zinc/19/03/44/175190344.db2.gz DQISGKUNMMWOIO-LBPRGKRZSA-N 1 1 242.322 3.572 20 0 BHADMO COc1ccc([C@@H](C)Nc2cccc(C)[nH+]2)cc1 ZINC000090340483 175177571 /nfs/dbraw/zinc/17/75/71/175177571.db2.gz DQISGKUNMMWOIO-GFCCVEGCSA-N 1 1 242.322 3.572 20 0 BHADMO CC[C@H]([NH2+][C@@H](C)c1ccco1)c1c(C)noc1C ZINC000090887265 360092506 /nfs/dbraw/zinc/09/25/06/360092506.db2.gz VKWGAZRPEYQFKK-CABZTGNLSA-N 1 1 248.326 3.686 20 0 BHADMO CC[C@@H]([NH2+][C@@H](C)c1ccco1)c1c(C)noc1C ZINC000090887266 360092389 /nfs/dbraw/zinc/09/23/89/360092389.db2.gz VKWGAZRPEYQFKK-JOYOIKCWSA-N 1 1 248.326 3.686 20 0 BHADMO CC[C@H]([NH2+][C@H](C)c1ccco1)c1c(C)noc1C ZINC000090887267 360092227 /nfs/dbraw/zinc/09/22/27/360092227.db2.gz VKWGAZRPEYQFKK-SKDRFNHKSA-N 1 1 248.326 3.686 20 0 BHADMO CC[C@@H]([NH2+][C@H](C)c1ccco1)c1c(C)noc1C ZINC000090887268 360093037 /nfs/dbraw/zinc/09/30/37/360093037.db2.gz VKWGAZRPEYQFKK-BXKDBHETSA-N 1 1 248.326 3.686 20 0 BHADMO Cc1n[nH]c(C)c1[C@@H]1CCC[N@H+]1CCC(C)(C)C ZINC000091081009 388759162 /nfs/dbraw/zinc/75/91/62/388759162.db2.gz UIDPDNCICOLZTH-ZDUSSCGKSA-N 1 1 249.402 3.600 20 0 BHADMO Cc1n[nH]c(C)c1[C@H]1CCC[N@H+]1CCC(C)(C)C ZINC000091081010 388758278 /nfs/dbraw/zinc/75/82/78/388758278.db2.gz UIDPDNCICOLZTH-CYBMUJFWSA-N 1 1 249.402 3.600 20 0 BHADMO CC1(C)CC[N@@H+](CCSc2ccccc2)C1 ZINC000091439795 383966527 /nfs/dbraw/zinc/96/65/27/383966527.db2.gz FHPPEDSIKNJBMU-UHFFFAOYSA-N 1 1 235.396 3.511 20 0 BHADMO C[C@@H]1CC[C@H](C)[N@@H+](CCSc2ccccc2)C1 ZINC000091440397 256577427 /nfs/dbraw/zinc/57/74/27/256577427.db2.gz FRHQWXQBQXEYCE-KGLIPLIRSA-N 1 1 249.423 3.899 20 0 BHADMO C[C@H]1CC[C@H](C)[N@@H+](CCSc2ccccc2)C1 ZINC000091440400 383967614 /nfs/dbraw/zinc/96/76/14/383967614.db2.gz FRHQWXQBQXEYCE-KBPBESRZSA-N 1 1 249.423 3.899 20 0 BHADMO C[C@@H]1CC[C@@H](C)[N@@H+](CCSc2ccccc2)C1 ZINC000091440403 383966503 /nfs/dbraw/zinc/96/65/03/383966503.db2.gz FRHQWXQBQXEYCE-ZIAGYGMSSA-N 1 1 249.423 3.899 20 0 BHADMO C[C@@H]1CC[C@H](C)C[N@@H+]1CCSc1ccccc1 ZINC000091440405 383967241 /nfs/dbraw/zinc/96/72/41/383967241.db2.gz FRHQWXQBQXEYCE-UONOGXRCSA-N 1 1 249.423 3.899 20 0 BHADMO Cc1cc[nH+]c(N2CCC[C@@H]2C2CCCC2)c1 ZINC000091455869 345592985 /nfs/dbraw/zinc/59/29/85/345592985.db2.gz DEKIKMUUZGGOQW-CQSZACIVSA-N 1 1 230.355 3.549 20 0 BHADMO Cc1cc[nH+]c(N2CCC[C@H]2C2CCCC2)c1 ZINC000091455870 345593063 /nfs/dbraw/zinc/59/30/63/345593063.db2.gz DEKIKMUUZGGOQW-AWEZNQCLSA-N 1 1 230.355 3.549 20 0 BHADMO C[C@H](c1ccccn1)[N@@H+](C)CCC(C)(C)C ZINC000091703959 177042959 /nfs/dbraw/zinc/04/29/59/177042959.db2.gz RLYINMBMDQBRJM-GFCCVEGCSA-N 1 1 220.360 3.511 20 0 BHADMO CC[C@@H](C)C[N@@H+](C)Cc1cnc(C(C)C)s1 ZINC000091796065 360131037 /nfs/dbraw/zinc/13/10/37/360131037.db2.gz PYRYXDKITXYMLG-LLVKDONJSA-N 1 1 240.416 3.744 20 0 BHADMO CC[C@H](C)C[N@@H+](C)Cc1cnc(C(C)C)s1 ZINC000091796067 360131026 /nfs/dbraw/zinc/13/10/26/360131026.db2.gz PYRYXDKITXYMLG-NSHDSACASA-N 1 1 240.416 3.744 20 0 BHADMO CC[C@@H](C)C[N@@H+](C)Cc1cccc2[nH]ccc21 ZINC000091796855 384148444 /nfs/dbraw/zinc/14/84/44/384148444.db2.gz GPCZXIDUDCTVGQ-GFCCVEGCSA-N 1 1 230.355 3.646 20 0 BHADMO CC[C@H](C)C[N@@H+](C)Cc1cccc2[nH]ccc21 ZINC000091796859 384048139 /nfs/dbraw/zinc/04/81/39/384048139.db2.gz GPCZXIDUDCTVGQ-LBPRGKRZSA-N 1 1 230.355 3.646 20 0 BHADMO CCOc1ccc(C2=CC[N@H+](C(C)C)CC2)cc1 ZINC000091800644 360131758 /nfs/dbraw/zinc/13/17/58/360131758.db2.gz YWYLIHQYFUNHDT-UHFFFAOYSA-N 1 1 245.366 3.583 20 0 BHADMO CC[C@@H]1c2ccsc2CC[N@@H+]1Cc1ccco1 ZINC000091897948 360135195 /nfs/dbraw/zinc/13/51/95/360135195.db2.gz HPIQDHWHKRIVEP-CYBMUJFWSA-N 1 1 247.363 3.851 20 0 BHADMO CC[C@H]1c2ccsc2CC[N@@H+]1Cc1ccco1 ZINC000091897951 360135354 /nfs/dbraw/zinc/13/53/54/360135354.db2.gz HPIQDHWHKRIVEP-ZDUSSCGKSA-N 1 1 247.363 3.851 20 0 BHADMO CC[C@@H]1c2ccsc2CC[N@@H+]1Cc1ccoc1 ZINC000091898060 644641464 /nfs/dbraw/zinc/64/14/64/644641464.db2.gz XGZPIJMEAQZPRH-CYBMUJFWSA-N 1 1 247.363 3.851 20 0 BHADMO CC[C@H]1c2ccsc2CC[N@@H+]1Cc1ccoc1 ZINC000091898063 644642038 /nfs/dbraw/zinc/64/20/38/644642038.db2.gz XGZPIJMEAQZPRH-ZDUSSCGKSA-N 1 1 247.363 3.851 20 0 BHADMO C[C@H]([N@@H+](C)Cc1ccc(Cl)o1)C1(C)CC1 ZINC000091900183 360135279 /nfs/dbraw/zinc/13/52/79/360135279.db2.gz CLOBTLFOHKXBJM-VIFPVBQESA-N 1 1 227.735 3.553 20 0 BHADMO C[C@@H]([N@@H+](C)Cc1ccc(Cl)o1)C1(C)CC1 ZINC000091900185 360135106 /nfs/dbraw/zinc/13/51/06/360135106.db2.gz CLOBTLFOHKXBJM-SECBINFHSA-N 1 1 227.735 3.553 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@@H](C)C2(C)CC2)s1 ZINC000091900412 352088039 /nfs/dbraw/zinc/08/80/39/352088039.db2.gz QPWFGNZJQAWMDR-NSHDSACASA-N 1 1 223.385 3.677 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@H](C)C2(C)CC2)s1 ZINC000091900414 352088260 /nfs/dbraw/zinc/08/82/60/352088260.db2.gz QPWFGNZJQAWMDR-LLVKDONJSA-N 1 1 223.385 3.677 20 0 BHADMO Cc1ccsc1C[N@H+](C)[C@@H](C)C1(C)CC1 ZINC000091900548 360135402 /nfs/dbraw/zinc/13/54/02/360135402.db2.gz VMCMSAWDTFDQMG-NSHDSACASA-N 1 1 223.385 3.677 20 0 BHADMO Cc1ccsc1C[N@H+](C)[C@H](C)C1(C)CC1 ZINC000091900549 360135179 /nfs/dbraw/zinc/13/51/79/360135179.db2.gz VMCMSAWDTFDQMG-LLVKDONJSA-N 1 1 223.385 3.677 20 0 BHADMO Cc1cc(C[N@H+](C)[C@@H](C)C2(C)CC2)c(C)o1 ZINC000091900721 644642129 /nfs/dbraw/zinc/64/21/29/644642129.db2.gz GHDHJVNZOCSLQD-LBPRGKRZSA-N 1 1 221.344 3.517 20 0 BHADMO Cc1cc(C[N@H+](C)[C@H](C)C2(C)CC2)c(C)o1 ZINC000091900722 644641513 /nfs/dbraw/zinc/64/15/13/644641513.db2.gz GHDHJVNZOCSLQD-GFCCVEGCSA-N 1 1 221.344 3.517 20 0 BHADMO C[C@H]([N@@H+](C)Cc1cccc2[nH]ccc21)C1(C)CC1 ZINC000091900976 360135104 /nfs/dbraw/zinc/13/51/04/360135104.db2.gz OXJAVUWAOWFDKS-LBPRGKRZSA-N 1 1 242.366 3.788 20 0 BHADMO C[C@@H]([N@@H+](C)Cc1cccc2[nH]ccc21)C1(C)CC1 ZINC000091900978 360135153 /nfs/dbraw/zinc/13/51/53/360135153.db2.gz OXJAVUWAOWFDKS-GFCCVEGCSA-N 1 1 242.366 3.788 20 0 BHADMO CC(C)(C)C[N@@H+](CCC(F)(F)F)CC1CC1 ZINC000091901648 388772224 /nfs/dbraw/zinc/77/22/24/388772224.db2.gz NXMBZMLICZJPFT-UHFFFAOYSA-N 1 1 237.309 3.697 20 0 BHADMO C[C@@H]1CC[C@H](C)[N@@H+]1Cc1cccc2[nH]ccc21 ZINC000091937956 360137944 /nfs/dbraw/zinc/13/79/44/360137944.db2.gz XOGZEBFRBDELAQ-TXEJJXNPSA-N 1 1 228.339 3.541 20 0 BHADMO CC[N@@H+](Cc1ccoc1)[C@@H](C)c1cccc(O)c1 ZINC000091975264 631546368 /nfs/dbraw/zinc/54/63/68/631546368.db2.gz VNJHMORVKZSMCJ-LBPRGKRZSA-N 1 1 245.322 3.568 20 0 BHADMO CC[N@@H+](Cc1ccoc1)[C@H](C)c1cccc(O)c1 ZINC000091975265 644644574 /nfs/dbraw/zinc/64/45/74/644644574.db2.gz VNJHMORVKZSMCJ-GFCCVEGCSA-N 1 1 245.322 3.568 20 0 BHADMO C[C@@H](c1ccncc1)[N@@H+](C)CCC(C)(C)C ZINC000091989447 176034593 /nfs/dbraw/zinc/03/45/93/176034593.db2.gz OWNIOXUTJRBIDT-LBPRGKRZSA-N 1 1 220.360 3.511 20 0 BHADMO C[C@H](c1ccncc1)[N@@H+](C)CCC(C)(C)C ZINC000091989449 177050487 /nfs/dbraw/zinc/05/04/87/177050487.db2.gz OWNIOXUTJRBIDT-GFCCVEGCSA-N 1 1 220.360 3.511 20 0 BHADMO CC(C)C[N@@H+](Cc1ccc(Cl)o1)C1CC1 ZINC000092008582 345614467 /nfs/dbraw/zinc/61/44/67/345614467.db2.gz ARCPUSUERZERAO-UHFFFAOYSA-N 1 1 227.735 3.553 20 0 BHADMO C[C@@H](C1CC1)[N@@H+](Cc1ccc(Cl)o1)C1CC1 ZINC000092009301 345614712 /nfs/dbraw/zinc/61/47/12/345614712.db2.gz LFFCFSQFRUCLBG-VIFPVBQESA-N 1 1 239.746 3.696 20 0 BHADMO C[C@H](C1CC1)[N@@H+](Cc1ccc(Cl)o1)C1CC1 ZINC000092009303 345614360 /nfs/dbraw/zinc/61/43/60/345614360.db2.gz LFFCFSQFRUCLBG-SECBINFHSA-N 1 1 239.746 3.696 20 0 BHADMO Cc1ccc(C[N@H+]([C@@H](C)C2CC2)C2CC2)s1 ZINC000092009486 360145843 /nfs/dbraw/zinc/14/58/43/360145843.db2.gz VAMQFORXULZMGA-NSHDSACASA-N 1 1 235.396 3.819 20 0 BHADMO Cc1ccc(C[N@H+]([C@H](C)C2CC2)C2CC2)s1 ZINC000092009491 360145737 /nfs/dbraw/zinc/14/57/37/360145737.db2.gz VAMQFORXULZMGA-LLVKDONJSA-N 1 1 235.396 3.819 20 0 BHADMO Cc1cc(C[N@H+]([C@@H](C)C2CC2)C2CC2)c(C)o1 ZINC000092009764 643331930 /nfs/dbraw/zinc/33/19/30/643331930.db2.gz BSFQFFRXKAIARO-NSHDSACASA-N 1 1 233.355 3.659 20 0 BHADMO Cc1cc(C[N@H+]([C@H](C)C2CC2)C2CC2)c(C)o1 ZINC000092009766 643334097 /nfs/dbraw/zinc/33/40/97/643334097.db2.gz BSFQFFRXKAIARO-LLVKDONJSA-N 1 1 233.355 3.659 20 0 BHADMO Cc1ccsc1C[N@H+]([C@@H](C)C1CC1)C1CC1 ZINC000092009783 256584103 /nfs/dbraw/zinc/58/41/03/256584103.db2.gz GEAHNDXBOKMHTQ-NSHDSACASA-N 1 1 235.396 3.819 20 0 BHADMO Cc1ccsc1C[N@H+]([C@H](C)C1CC1)C1CC1 ZINC000092009785 384159718 /nfs/dbraw/zinc/15/97/18/384159718.db2.gz GEAHNDXBOKMHTQ-LLVKDONJSA-N 1 1 235.396 3.819 20 0 BHADMO C[C@@H](C1CC1)[N@@H+](Cc1ccsc1)C1CC1 ZINC000092010013 360146330 /nfs/dbraw/zinc/14/63/30/360146330.db2.gz RGAOYIGXTGSEBY-JTQLQIEISA-N 1 1 221.369 3.511 20 0 BHADMO C[C@H](C1CC1)[N@@H+](Cc1ccsc1)C1CC1 ZINC000092010015 360145975 /nfs/dbraw/zinc/14/59/75/360145975.db2.gz RGAOYIGXTGSEBY-SNVBAGLBSA-N 1 1 221.369 3.511 20 0 BHADMO Cc1[nH]ncc1C[N@@H+]1CCCC[C@@H]1CCC(C)C ZINC000092015859 360145619 /nfs/dbraw/zinc/14/56/19/360145619.db2.gz IXUNNFTUDLOWRM-OAHLLOKOSA-N 1 1 249.402 3.509 20 0 BHADMO Cc1[nH]ncc1C[N@H+]1CCCC[C@@H]1CCC(C)C ZINC000092015859 360145615 /nfs/dbraw/zinc/14/56/15/360145615.db2.gz IXUNNFTUDLOWRM-OAHLLOKOSA-N 1 1 249.402 3.509 20 0 BHADMO Cc1n[nH]cc1C[N@@H+]1CCCC[C@@H]1CCC(C)C ZINC000092015859 360145612 /nfs/dbraw/zinc/14/56/12/360145612.db2.gz IXUNNFTUDLOWRM-OAHLLOKOSA-N 1 1 249.402 3.509 20 0 BHADMO Cc1[nH]ncc1C[N@@H+]1CCCC[C@H]1CCC(C)C ZINC000092015860 360146188 /nfs/dbraw/zinc/14/61/88/360146188.db2.gz IXUNNFTUDLOWRM-HNNXBMFYSA-N 1 1 249.402 3.509 20 0 BHADMO Cc1[nH]ncc1C[N@H+]1CCCC[C@H]1CCC(C)C ZINC000092015860 360146186 /nfs/dbraw/zinc/14/61/86/360146186.db2.gz IXUNNFTUDLOWRM-HNNXBMFYSA-N 1 1 249.402 3.509 20 0 BHADMO Cc1n[nH]cc1C[N@@H+]1CCCC[C@H]1CCC(C)C ZINC000092015860 360146183 /nfs/dbraw/zinc/14/61/83/360146183.db2.gz IXUNNFTUDLOWRM-HNNXBMFYSA-N 1 1 249.402 3.509 20 0 BHADMO C[N@@H+](CCC1CC1)C[C@@H]1C[C@@H]1c1ccccc1 ZINC000092067143 345615390 /nfs/dbraw/zinc/61/53/90/345615390.db2.gz GFIGIMPRJMNHDQ-JKSUJKDBSA-N 1 1 229.367 3.522 20 0 BHADMO C[N@@H+](CCC1CC1)C[C@H]1C[C@@H]1c1ccccc1 ZINC000092067144 345615490 /nfs/dbraw/zinc/61/54/90/345615490.db2.gz GFIGIMPRJMNHDQ-HZPDHXFCSA-N 1 1 229.367 3.522 20 0 BHADMO C[N@@H+](CCc1ccc(F)cc1)Cc1ccsc1 ZINC000092162170 360154112 /nfs/dbraw/zinc/15/41/12/360154112.db2.gz YYFKPWJOZFEANH-UHFFFAOYSA-N 1 1 249.354 3.562 20 0 BHADMO CC(C)c1ncc(C[N@@H+](C)CC(C)(C)C)s1 ZINC000092217592 360157376 /nfs/dbraw/zinc/15/73/76/360157376.db2.gz TZUDVEMFXBOWJC-UHFFFAOYSA-N 1 1 240.416 3.744 20 0 BHADMO Cc1ccc(C[N@H+](C)CC(C)(C)C)s1 ZINC000092217615 384169288 /nfs/dbraw/zinc/16/92/88/384169288.db2.gz INXQPCHYUFROBU-UHFFFAOYSA-N 1 1 211.374 3.534 20 0 BHADMO C[N@@H+](Cc1cccc2[nH]ccc21)CC(C)(C)C ZINC000092217726 345608188 /nfs/dbraw/zinc/60/81/88/345608188.db2.gz YLRZKUWXEAGCIZ-UHFFFAOYSA-N 1 1 230.355 3.646 20 0 BHADMO CC[C@@H](c1ccncc1)[N@@H+](C)[C@H]1C=CCCC1 ZINC000092223810 344290601 /nfs/dbraw/zinc/29/06/01/344290601.db2.gz GFLFXDCBAHZVLJ-GJZGRUSLSA-N 1 1 230.355 3.573 20 0 BHADMO CC[C@H](c1ccncc1)[N@@H+](C)[C@H]1C=CCCC1 ZINC000092223811 384169660 /nfs/dbraw/zinc/16/96/60/384169660.db2.gz GFLFXDCBAHZVLJ-LSDHHAIUSA-N 1 1 230.355 3.573 20 0 BHADMO CC[C@@H](c1ccncc1)[N@@H+](C)CCC(C)C ZINC000092223974 344290821 /nfs/dbraw/zinc/29/08/21/344290821.db2.gz ITCSFHQISZGFGA-AWEZNQCLSA-N 1 1 220.360 3.511 20 0 BHADMO CC[C@H](c1ccncc1)[N@@H+](C)CCC(C)C ZINC000092223975 384169887 /nfs/dbraw/zinc/16/98/87/384169887.db2.gz ITCSFHQISZGFGA-CQSZACIVSA-N 1 1 220.360 3.511 20 0 BHADMO CC[C@@H](C)C[N@@H+](C)[C@@H](CC)c1ccncc1 ZINC000092224187 170957199 /nfs/dbraw/zinc/95/71/99/170957199.db2.gz GFWJZGGFOVMGBS-OCCSQVGLSA-N 1 1 220.360 3.511 20 0 BHADMO CC[C@H](C)C[N@@H+](C)[C@@H](CC)c1ccncc1 ZINC000092224188 171274924 /nfs/dbraw/zinc/27/49/24/171274924.db2.gz GFWJZGGFOVMGBS-JSGCOSHPSA-N 1 1 220.360 3.511 20 0 BHADMO CCCCC[N@@H+](C)[C@@H](CC)c1ccncc1 ZINC000092224773 360157332 /nfs/dbraw/zinc/15/73/32/360157332.db2.gz GOAYSWFSHVLCDD-AWEZNQCLSA-N 1 1 220.360 3.655 20 0 BHADMO CCCCC[N@@H+](C)[C@H](CC)c1ccncc1 ZINC000092224774 360156789 /nfs/dbraw/zinc/15/67/89/360156789.db2.gz GOAYSWFSHVLCDD-CQSZACIVSA-N 1 1 220.360 3.655 20 0 BHADMO CC[C@@H](c1ccncc1)[N@@H+](C)CCC(C)(C)C ZINC000092224814 388792613 /nfs/dbraw/zinc/79/26/13/388792613.db2.gz KFQPWNQTOJMYFE-AWEZNQCLSA-N 1 1 234.387 3.901 20 0 BHADMO CC[C@H](c1ccncc1)[N@@H+](C)CCC(C)(C)C ZINC000092224815 388792125 /nfs/dbraw/zinc/79/21/25/388792125.db2.gz KFQPWNQTOJMYFE-CQSZACIVSA-N 1 1 234.387 3.901 20 0 BHADMO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2c(C)noc2C)o1 ZINC000092327037 582855100 /nfs/dbraw/zinc/85/51/00/582855100.db2.gz XRPISABGKMOGQS-ZJUUUORDSA-N 1 1 248.326 3.605 20 0 BHADMO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2c(C)noc2C)o1 ZINC000092327038 582855119 /nfs/dbraw/zinc/85/51/19/582855119.db2.gz XRPISABGKMOGQS-UWVGGRQHSA-N 1 1 248.326 3.605 20 0 BHADMO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2c(C)noc2C)o1 ZINC000092327040 582855339 /nfs/dbraw/zinc/85/53/39/582855339.db2.gz XRPISABGKMOGQS-NXEZZACHSA-N 1 1 248.326 3.605 20 0 BHADMO Cc1ccc([C@H](C)[NH2+][C@H](C)c2c(C)noc2C)o1 ZINC000092327042 582855545 /nfs/dbraw/zinc/85/55/45/582855545.db2.gz XRPISABGKMOGQS-VHSXEESVSA-N 1 1 248.326 3.605 20 0 BHADMO Cc1ncccc1C[N@H+]1CCC[C@@H]1C1CCCC1 ZINC000092401711 360169866 /nfs/dbraw/zinc/16/98/66/360169866.db2.gz IXTVUNSQYORDEI-MRXNPFEDSA-N 1 1 244.382 3.545 20 0 BHADMO Cc1ncccc1C[N@H+]1CCC[C@H]1C1CCCC1 ZINC000092401712 360169509 /nfs/dbraw/zinc/16/95/09/360169509.db2.gz IXTVUNSQYORDEI-INIZCTEOSA-N 1 1 244.382 3.545 20 0 BHADMO Cc1cc(C)cc(C2=CC[N@@H+](CCCF)CC2)c1 ZINC000092427208 388805396 /nfs/dbraw/zinc/80/53/96/388805396.db2.gz JSPXUXSKEILKRE-UHFFFAOYSA-N 1 1 247.357 3.752 20 0 BHADMO Cc1ccc(C[N@H+](C)Cc2ccoc2C)s1 ZINC000092438539 387212435 /nfs/dbraw/zinc/21/24/35/387212435.db2.gz XSNOWXQQPDENFE-UHFFFAOYSA-N 1 1 235.352 3.590 20 0 BHADMO Cc1occc1C[N@H+](C)Cc1ccc(F)cc1C ZINC000092438672 178086286 /nfs/dbraw/zinc/08/62/86/178086286.db2.gz COWQTUGQTLJKNJ-UHFFFAOYSA-N 1 1 247.313 3.668 20 0 BHADMO Cc1ccsc1C[N@H+](C)Cc1ccoc1C ZINC000092438713 387212809 /nfs/dbraw/zinc/21/28/09/387212809.db2.gz UATFAJUQOYZIBZ-UHFFFAOYSA-N 1 1 235.352 3.590 20 0 BHADMO Cc1ccc(F)c(C[N@@H+](C)CCC(F)(F)F)c1 ZINC000092477881 345624348 /nfs/dbraw/zinc/62/43/48/345624348.db2.gz KHTGCIIXYADBTB-UHFFFAOYSA-N 1 1 249.251 3.518 20 0 BHADMO Cc1ccc(F)c(C[N@H+](C)CCC(F)(F)F)c1 ZINC000092477881 345624345 /nfs/dbraw/zinc/62/43/45/345624345.db2.gz KHTGCIIXYADBTB-UHFFFAOYSA-N 1 1 249.251 3.518 20 0 BHADMO Cc1cccc(C[N@@H+](C)CCC(F)(F)F)c1C ZINC000092478762 398306274 /nfs/dbraw/zinc/30/62/74/398306274.db2.gz UFZNGHWXPLWCPI-UHFFFAOYSA-N 1 1 245.288 3.688 20 0 BHADMO Cc1cc(C[N@@H+](C)CCC(F)(F)F)ccc1F ZINC000092478798 387213825 /nfs/dbraw/zinc/21/38/25/387213825.db2.gz CWKOXZSMIOUKFL-UHFFFAOYSA-N 1 1 249.251 3.518 20 0 BHADMO Cc1cc(F)ccc1C[N@@H+](C)CCC(F)(F)F ZINC000092479084 345624551 /nfs/dbraw/zinc/62/45/51/345624551.db2.gz HRVGLOAGMBPNQQ-UHFFFAOYSA-N 1 1 249.251 3.518 20 0 BHADMO Cc1ccc(C[N@@H+](C)CCC(F)(F)F)cc1C ZINC000092479347 398306681 /nfs/dbraw/zinc/30/66/81/398306681.db2.gz UJIADFHMTJGGHN-UHFFFAOYSA-N 1 1 245.288 3.688 20 0 BHADMO Cc1ccc(C[N@@H+](C)CCC(F)(F)F)cc1F ZINC000092479795 345624833 /nfs/dbraw/zinc/62/48/33/345624833.db2.gz XIGZHQNSAUSQQP-UHFFFAOYSA-N 1 1 249.251 3.518 20 0 BHADMO Cc1ccc(C[N@H+]([C@@H](C)c2ccco2)C2CC2)o1 ZINC000092483504 384181699 /nfs/dbraw/zinc/18/16/99/384181699.db2.gz KRXGMRBNQSURLJ-LBPRGKRZSA-N 1 1 245.322 3.907 20 0 BHADMO Cc1ccc(C[N@@H+]([C@@H](C)c2ccco2)C2CC2)o1 ZINC000092483504 384181694 /nfs/dbraw/zinc/18/16/94/384181694.db2.gz KRXGMRBNQSURLJ-LBPRGKRZSA-N 1 1 245.322 3.907 20 0 BHADMO Cc1ccc(C[N@H+]([C@H](C)c2ccco2)C2CC2)o1 ZINC000092483508 384181360 /nfs/dbraw/zinc/18/13/60/384181360.db2.gz KRXGMRBNQSURLJ-GFCCVEGCSA-N 1 1 245.322 3.907 20 0 BHADMO Cc1ccc(C[N@@H+]([C@H](C)c2ccco2)C2CC2)o1 ZINC000092483508 384181354 /nfs/dbraw/zinc/18/13/54/384181354.db2.gz KRXGMRBNQSURLJ-GFCCVEGCSA-N 1 1 245.322 3.907 20 0 BHADMO C[C@@H](c1ccco1)[N@@H+](Cc1ccco1)C1CC1 ZINC000092483975 176032760 /nfs/dbraw/zinc/03/27/60/176032760.db2.gz VALLGXSNWAVSMY-NSHDSACASA-N 1 1 231.295 3.598 20 0 BHADMO C[C@@H](c1ccco1)[N@H+](Cc1ccco1)C1CC1 ZINC000092483975 176032759 /nfs/dbraw/zinc/03/27/59/176032759.db2.gz VALLGXSNWAVSMY-NSHDSACASA-N 1 1 231.295 3.598 20 0 BHADMO C[C@H](c1ccco1)[N@@H+](Cc1ccco1)C1CC1 ZINC000092483979 177047282 /nfs/dbraw/zinc/04/72/82/177047282.db2.gz VALLGXSNWAVSMY-LLVKDONJSA-N 1 1 231.295 3.598 20 0 BHADMO C[C@H](c1ccco1)[N@H+](Cc1ccco1)C1CC1 ZINC000092483979 177047281 /nfs/dbraw/zinc/04/72/81/177047281.db2.gz VALLGXSNWAVSMY-LLVKDONJSA-N 1 1 231.295 3.598 20 0 BHADMO Cc1ccoc1C[N@H+]([C@@H](C)c1ccco1)C1CC1 ZINC000092483998 384181459 /nfs/dbraw/zinc/18/14/59/384181459.db2.gz AVNUNAOWANLGEJ-LBPRGKRZSA-N 1 1 245.322 3.907 20 0 BHADMO Cc1ccoc1C[N@@H+]([C@@H](C)c1ccco1)C1CC1 ZINC000092483998 384181453 /nfs/dbraw/zinc/18/14/53/384181453.db2.gz AVNUNAOWANLGEJ-LBPRGKRZSA-N 1 1 245.322 3.907 20 0 BHADMO Cc1ccoc1C[N@H+]([C@H](C)c1ccco1)C1CC1 ZINC000092484001 384182200 /nfs/dbraw/zinc/18/22/00/384182200.db2.gz AVNUNAOWANLGEJ-GFCCVEGCSA-N 1 1 245.322 3.907 20 0 BHADMO Cc1ccoc1C[N@@H+]([C@H](C)c1ccco1)C1CC1 ZINC000092484001 384182191 /nfs/dbraw/zinc/18/21/91/384182191.db2.gz AVNUNAOWANLGEJ-GFCCVEGCSA-N 1 1 245.322 3.907 20 0 BHADMO C[C@@H](c1ccco1)[N@@H+](Cc1ccoc1)C1CC1 ZINC000092484105 643133633 /nfs/dbraw/zinc/13/36/33/643133633.db2.gz VEPQBCRPUUZHEG-NSHDSACASA-N 1 1 231.295 3.598 20 0 BHADMO C[C@@H](c1ccco1)[N@H+](Cc1ccoc1)C1CC1 ZINC000092484105 643133624 /nfs/dbraw/zinc/13/36/24/643133624.db2.gz VEPQBCRPUUZHEG-NSHDSACASA-N 1 1 231.295 3.598 20 0 BHADMO C[C@H](c1ccco1)[N@@H+](Cc1ccoc1)C1CC1 ZINC000092484108 643133397 /nfs/dbraw/zinc/13/33/97/643133397.db2.gz VEPQBCRPUUZHEG-LLVKDONJSA-N 1 1 231.295 3.598 20 0 BHADMO C[C@H](c1ccco1)[N@H+](Cc1ccoc1)C1CC1 ZINC000092484108 643133388 /nfs/dbraw/zinc/13/33/88/643133388.db2.gz VEPQBCRPUUZHEG-LLVKDONJSA-N 1 1 231.295 3.598 20 0 BHADMO Clc1ccc(C[N@H+]2CCC[C@H]3CCC[C@@H]32)o1 ZINC000092485376 345624865 /nfs/dbraw/zinc/62/48/65/345624865.db2.gz FYTZKVWILGUNNI-PWSUYJOCSA-N 1 1 239.746 3.698 20 0 BHADMO Clc1ccc(C[N@H+]2CCC[C@@H]3CCC[C@@H]32)o1 ZINC000092485379 345625194 /nfs/dbraw/zinc/62/51/94/345625194.db2.gz FYTZKVWILGUNNI-JQWIXIFHSA-N 1 1 239.746 3.698 20 0 BHADMO c1csc(C[N@H+]2CCC[C@H]3CCC[C@@H]32)c1 ZINC000092485879 387213105 /nfs/dbraw/zinc/21/31/05/387213105.db2.gz FBBZXIDYSIAOGN-YPMHNXCESA-N 1 1 221.369 3.513 20 0 BHADMO c1csc(C[N@H+]2CCC[C@@H]3CCC[C@@H]32)c1 ZINC000092485881 387213770 /nfs/dbraw/zinc/21/37/70/387213770.db2.gz FBBZXIDYSIAOGN-AAEUAGOBSA-N 1 1 221.369 3.513 20 0 BHADMO c1cc(C[N@H+]2CCC[C@H]3CCC[C@@H]32)cs1 ZINC000092485883 183342270 /nfs/dbraw/zinc/34/22/70/183342270.db2.gz RDVJSYLMUJBOLU-OLZOCXBDSA-N 1 1 221.369 3.513 20 0 BHADMO c1cc(C[N@H+]2CCC[C@@H]3CCC[C@@H]32)cs1 ZINC000092485885 183343266 /nfs/dbraw/zinc/34/32/66/183343266.db2.gz RDVJSYLMUJBOLU-STQMWFEESA-N 1 1 221.369 3.513 20 0 BHADMO CCCCC[N@@H+](Cc1c[nH]cn1)[C@@H](C)CCC ZINC000092511786 384196048 /nfs/dbraw/zinc/19/60/48/384196048.db2.gz PVYXIWMQAUGQGA-ZDUSSCGKSA-N 1 1 237.391 3.591 20 0 BHADMO CCCCC[N@H+](Cc1c[nH]cn1)[C@@H](C)CCC ZINC000092511786 384196042 /nfs/dbraw/zinc/19/60/42/384196042.db2.gz PVYXIWMQAUGQGA-ZDUSSCGKSA-N 1 1 237.391 3.591 20 0 BHADMO CCCCC[N@@H+](Cc1cnc[nH]1)[C@@H](C)CCC ZINC000092511786 384196036 /nfs/dbraw/zinc/19/60/36/384196036.db2.gz PVYXIWMQAUGQGA-ZDUSSCGKSA-N 1 1 237.391 3.591 20 0 BHADMO CCCCC[N@@H+](Cc1c[nH]cn1)[C@H](C)CCC ZINC000092511788 384196331 /nfs/dbraw/zinc/19/63/31/384196331.db2.gz PVYXIWMQAUGQGA-CYBMUJFWSA-N 1 1 237.391 3.591 20 0 BHADMO CCCCC[N@H+](Cc1c[nH]cn1)[C@H](C)CCC ZINC000092511788 384196327 /nfs/dbraw/zinc/19/63/27/384196327.db2.gz PVYXIWMQAUGQGA-CYBMUJFWSA-N 1 1 237.391 3.591 20 0 BHADMO CCCCC[N@@H+](Cc1cnc[nH]1)[C@H](C)CCC ZINC000092511788 384196325 /nfs/dbraw/zinc/19/63/25/384196325.db2.gz PVYXIWMQAUGQGA-CYBMUJFWSA-N 1 1 237.391 3.591 20 0 BHADMO CC[N@@H+](Cc1sccc1OC)[C@@H](C)C(C)C ZINC000092590224 345640415 /nfs/dbraw/zinc/64/04/15/345640415.db2.gz SZNOZNGJJNPGNR-NSHDSACASA-N 1 1 241.400 3.623 20 0 BHADMO CC[N@@H+](Cc1sccc1OC)[C@H](C)C(C)C ZINC000092590226 360185080 /nfs/dbraw/zinc/18/50/80/360185080.db2.gz SZNOZNGJJNPGNR-LLVKDONJSA-N 1 1 241.400 3.623 20 0 BHADMO CC[N@@H+](Cc1cccs1)[C@@H](C)C(C)C ZINC000092590547 135579377 /nfs/dbraw/zinc/57/93/77/135579377.db2.gz BQVKEPGNYLMFKK-NSHDSACASA-N 1 1 211.374 3.615 20 0 BHADMO CC[N@@H+](Cc1cccs1)[C@H](C)C(C)C ZINC000092590548 360183449 /nfs/dbraw/zinc/18/34/49/360183449.db2.gz BQVKEPGNYLMFKK-LLVKDONJSA-N 1 1 211.374 3.615 20 0 BHADMO CC[N@@H+](Cc1ccsc1)[C@@H](C)C(C)C ZINC000092590557 360184879 /nfs/dbraw/zinc/18/48/79/360184879.db2.gz NIJHWTLKUAAENW-NSHDSACASA-N 1 1 211.374 3.615 20 0 BHADMO CC[N@@H+](Cc1ccsc1)[C@H](C)C(C)C ZINC000092590558 360183762 /nfs/dbraw/zinc/18/37/62/360183762.db2.gz NIJHWTLKUAAENW-LLVKDONJSA-N 1 1 211.374 3.615 20 0 BHADMO CC(C)(C)C[C@@H]1CCC[N@H+]1Cc1cncs1 ZINC000092644188 360187911 /nfs/dbraw/zinc/18/79/11/360187911.db2.gz DXHLHFCCZIJUBT-NSHDSACASA-N 1 1 238.400 3.544 20 0 BHADMO CC(C)(C)C[C@H]1CCC[N@H+]1Cc1cncs1 ZINC000092644189 360187386 /nfs/dbraw/zinc/18/73/86/360187386.db2.gz DXHLHFCCZIJUBT-LLVKDONJSA-N 1 1 238.400 3.544 20 0 BHADMO Cc1ncccc1C[N@H+]1CCC[C@@H]1CC(C)(C)C ZINC000092644254 360187889 /nfs/dbraw/zinc/18/78/89/360187889.db2.gz WAOJTIPHHFOLGM-OAHLLOKOSA-N 1 1 246.398 3.791 20 0 BHADMO Cc1ncccc1C[N@H+]1CCC[C@H]1CC(C)(C)C ZINC000092644255 360187398 /nfs/dbraw/zinc/18/73/98/360187398.db2.gz WAOJTIPHHFOLGM-HNNXBMFYSA-N 1 1 246.398 3.791 20 0 BHADMO C[N@H+](Cc1ccc(Cl)o1)CC1CCCC1 ZINC000092667137 344300493 /nfs/dbraw/zinc/30/04/93/344300493.db2.gz LLSILOWCOQPRJE-UHFFFAOYSA-N 1 1 227.735 3.555 20 0 BHADMO C[N@@H+](Cc1ccc(Cl)o1)C(C1CC1)C1CC1 ZINC000092703943 345636620 /nfs/dbraw/zinc/63/66/20/345636620.db2.gz WTCPNWGZPYIIAL-UHFFFAOYSA-N 1 1 239.746 3.553 20 0 BHADMO Cc1ccc(C[N@H+](C)C(C2CC2)C2CC2)s1 ZINC000092704001 384189720 /nfs/dbraw/zinc/18/97/20/384189720.db2.gz VEITZQIJYFCFQF-UHFFFAOYSA-N 1 1 235.396 3.677 20 0 BHADMO Cc1cc(C[N@H+](C)C(C2CC2)C2CC2)c(C)o1 ZINC000092704072 644666411 /nfs/dbraw/zinc/66/64/11/644666411.db2.gz JKMGZNUEEXXJOQ-UHFFFAOYSA-N 1 1 233.355 3.517 20 0 BHADMO Cc1ccsc1C[N@H+](C)C(C1CC1)C1CC1 ZINC000092704077 384238414 /nfs/dbraw/zinc/23/84/14/384238414.db2.gz GNESDWSEZYURJL-UHFFFAOYSA-N 1 1 235.396 3.677 20 0 BHADMO Clc1ccc(C[N@H+]2CC[C@@H]3CCCC[C@@H]32)o1 ZINC000092709525 345448115 /nfs/dbraw/zinc/44/81/15/345448115.db2.gz ZCEKKYAXCQOWSZ-JQWIXIFHSA-N 1 1 239.746 3.698 20 0 BHADMO c1csc(C[N@H+]2CC[C@@H]3CCCC[C@@H]32)c1 ZINC000092709790 345451354 /nfs/dbraw/zinc/45/13/54/345451354.db2.gz PLNBZEWKBLARMM-AAEUAGOBSA-N 1 1 221.369 3.513 20 0 BHADMO c1cc(C[N@H+]2CC[C@@H]3CCCC[C@@H]32)cs1 ZINC000092709792 345451005 /nfs/dbraw/zinc/45/10/05/345451005.db2.gz XHTLPABJIKUMFA-STQMWFEESA-N 1 1 221.369 3.513 20 0 BHADMO C[N@@H+](Cc1cncs1)C1CCCCCCC1 ZINC000092737024 644666747 /nfs/dbraw/zinc/66/67/47/644666747.db2.gz STXPRHOCBGKYSN-UHFFFAOYSA-N 1 1 238.400 3.688 20 0 BHADMO CC[N@@H+](CCC(F)(F)F)C[C@H]1CC=CCC1 ZINC000092737654 538107720 /nfs/dbraw/zinc/10/77/20/538107720.db2.gz KXHPITYDACYRKS-NSHDSACASA-N 1 1 235.293 3.617 20 0 BHADMO CC[N@@H+](CCC(F)(F)F)C[C@@H]1CC=CCC1 ZINC000092737655 538107604 /nfs/dbraw/zinc/10/76/04/538107604.db2.gz KXHPITYDACYRKS-LLVKDONJSA-N 1 1 235.293 3.617 20 0 BHADMO CCc1ccc(C[N@@H+](CC)CCC(F)(F)F)o1 ZINC000092753762 538107764 /nfs/dbraw/zinc/10/77/64/538107764.db2.gz DACGRJZCXYDMFZ-UHFFFAOYSA-N 1 1 249.276 3.616 20 0 BHADMO CCc1ccc(C[N@H+](CC)CCC(F)(F)F)o1 ZINC000092753762 538107763 /nfs/dbraw/zinc/10/77/63/538107763.db2.gz DACGRJZCXYDMFZ-UHFFFAOYSA-N 1 1 249.276 3.616 20 0 BHADMO CC[N@@H+](CCC(F)(F)F)Cc1cc(C)oc1C ZINC000092753814 644666060 /nfs/dbraw/zinc/66/60/60/644666060.db2.gz ZHPGEWYVBXSTON-UHFFFAOYSA-N 1 1 249.276 3.671 20 0 BHADMO CC[N@@H+](CCC(F)(F)F)Cc1ccsc1 ZINC000092753885 538107699 /nfs/dbraw/zinc/10/76/99/538107699.db2.gz GGYAEMJTJXZQPC-UHFFFAOYSA-N 1 1 237.290 3.522 20 0 BHADMO Clc1ccc(C[N@H+]2CCC[C@@H]2C2CCC2)o1 ZINC000092780742 345643248 /nfs/dbraw/zinc/64/32/48/345643248.db2.gz CJTPEGNTEVJUJF-GFCCVEGCSA-N 1 1 239.746 3.698 20 0 BHADMO Clc1ccc(C[N@H+]2CCC[C@H]2C2CCC2)o1 ZINC000092780744 345642997 /nfs/dbraw/zinc/64/29/97/345642997.db2.gz CJTPEGNTEVJUJF-LBPRGKRZSA-N 1 1 239.746 3.698 20 0 BHADMO c1csc(C[N@H+]2CCC[C@@H]2C2CCC2)c1 ZINC000092781291 360196487 /nfs/dbraw/zinc/19/64/87/360196487.db2.gz LAQBIWNTTJHQJO-CYBMUJFWSA-N 1 1 221.369 3.513 20 0 BHADMO c1csc(C[N@H+]2CCC[C@H]2C2CCC2)c1 ZINC000092781293 360196574 /nfs/dbraw/zinc/19/65/74/360196574.db2.gz LAQBIWNTTJHQJO-ZDUSSCGKSA-N 1 1 221.369 3.513 20 0 BHADMO c1cc(C[N@H+]2CCC[C@@H]2C2CCC2)cs1 ZINC000092781296 360196339 /nfs/dbraw/zinc/19/63/39/360196339.db2.gz NBBQMTHHRCRJGR-CYBMUJFWSA-N 1 1 221.369 3.513 20 0 BHADMO c1cc(C[N@H+]2CCC[C@H]2C2CCC2)cs1 ZINC000092781297 360196130 /nfs/dbraw/zinc/19/61/30/360196130.db2.gz NBBQMTHHRCRJGR-ZDUSSCGKSA-N 1 1 221.369 3.513 20 0 BHADMO C[N@@H+](CCC1CCCCC1)Cc1cncs1 ZINC000092784459 259351078 /nfs/dbraw/zinc/35/10/78/259351078.db2.gz IYPJFALLIUEJHN-UHFFFAOYSA-N 1 1 238.400 3.545 20 0 BHADMO C[C@@H]1CCC[C@H](C[N@@H+](C)CCC(F)(F)F)C1 ZINC000092795556 345643690 /nfs/dbraw/zinc/64/36/90/345643690.db2.gz NTJULJFVLSBYGA-MNOVXSKESA-N 1 1 237.309 3.697 20 0 BHADMO C[C@H]1CCC[C@H](C[N@@H+](C)CCC(F)(F)F)C1 ZINC000092795557 345643677 /nfs/dbraw/zinc/64/36/77/345643677.db2.gz NTJULJFVLSBYGA-QWRGUYRKSA-N 1 1 237.309 3.697 20 0 BHADMO C[C@@H]1CCC[C@@H](C[N@@H+](C)CCC(F)(F)F)C1 ZINC000092795558 345643649 /nfs/dbraw/zinc/64/36/49/345643649.db2.gz NTJULJFVLSBYGA-GHMZBOCLSA-N 1 1 237.309 3.697 20 0 BHADMO C[C@H]1CCC[C@@H](C[N@@H+](C)CCC(F)(F)F)C1 ZINC000092795559 345643971 /nfs/dbraw/zinc/64/39/71/345643971.db2.gz NTJULJFVLSBYGA-WDEREUQCSA-N 1 1 237.309 3.697 20 0 BHADMO C[C@@H](c1ccncc1)[N@@H+](C)C[C@H]1CCC[C@@H](C)C1 ZINC000092808039 360201618 /nfs/dbraw/zinc/20/16/18/360201618.db2.gz IMYGBSANIKSWFB-ILXRZTDVSA-N 1 1 246.398 3.901 20 0 BHADMO C[C@@H](c1ccncc1)[N@@H+](C)C[C@H]1CCC[C@H](C)C1 ZINC000092808044 360201100 /nfs/dbraw/zinc/20/11/00/360201100.db2.gz IMYGBSANIKSWFB-KKUMJFAQSA-N 1 1 246.398 3.901 20 0 BHADMO C[C@@H](c1ccncc1)[N@@H+](C)C[C@@H]1CCC[C@@H](C)C1 ZINC000092808045 360201670 /nfs/dbraw/zinc/20/16/70/360201670.db2.gz IMYGBSANIKSWFB-QLFBSQMISA-N 1 1 246.398 3.901 20 0 BHADMO C[C@@H](c1ccncc1)[N@@H+](C)C[C@@H]1CCC[C@H](C)C1 ZINC000092808047 360201113 /nfs/dbraw/zinc/20/11/13/360201113.db2.gz IMYGBSANIKSWFB-SOUVJXGZSA-N 1 1 246.398 3.901 20 0 BHADMO C[C@@H](c1ccccn1)[N@@H+](C)C[C@H]1CCC[C@@H](C)C1 ZINC000092808061 360200990 /nfs/dbraw/zinc/20/09/90/360200990.db2.gz FWCJWYMTCCTXNV-ILXRZTDVSA-N 1 1 246.398 3.901 20 0 BHADMO C[C@@H](c1ccccn1)[N@@H+](C)C[C@H]1CCC[C@H](C)C1 ZINC000092808063 360201625 /nfs/dbraw/zinc/20/16/25/360201625.db2.gz FWCJWYMTCCTXNV-KKUMJFAQSA-N 1 1 246.398 3.901 20 0 BHADMO C[C@@H](c1ccccn1)[N@@H+](C)C[C@@H]1CCC[C@@H](C)C1 ZINC000092808066 360200819 /nfs/dbraw/zinc/20/08/19/360200819.db2.gz FWCJWYMTCCTXNV-QLFBSQMISA-N 1 1 246.398 3.901 20 0 BHADMO C[C@@H](c1ccccn1)[N@@H+](C)C[C@@H]1CCC[C@H](C)C1 ZINC000092808068 360200743 /nfs/dbraw/zinc/20/07/43/360200743.db2.gz FWCJWYMTCCTXNV-SOUVJXGZSA-N 1 1 246.398 3.901 20 0 BHADMO CC[N@H+](Cc1ccoc1)Cc1ccc(Cl)o1 ZINC000092935747 538108218 /nfs/dbraw/zinc/10/82/18/538108218.db2.gz LLMASSFIAFJXHL-UHFFFAOYSA-N 1 1 239.702 3.548 20 0 BHADMO CC[N@@H+](Cc1ccoc1)Cc1ccc(Cl)o1 ZINC000092935747 538108217 /nfs/dbraw/zinc/10/82/17/538108217.db2.gz LLMASSFIAFJXHL-UHFFFAOYSA-N 1 1 239.702 3.548 20 0 BHADMO CC[N@H+](Cc1ccoc1)Cc1ccc(C)s1 ZINC000092935820 538108002 /nfs/dbraw/zinc/10/80/02/538108002.db2.gz JSGWUCMIEBXIRE-UHFFFAOYSA-N 1 1 235.352 3.672 20 0 BHADMO CC[N@@H+](Cc1ccoc1)Cc1sccc1C ZINC000092935858 538108254 /nfs/dbraw/zinc/10/82/54/538108254.db2.gz VWPDLMKWNMLHCI-UHFFFAOYSA-N 1 1 235.352 3.672 20 0 BHADMO CC[N@@H+](Cc1ccoc1)Cc1cc(C)oc1C ZINC000092935913 644673076 /nfs/dbraw/zinc/67/30/76/644673076.db2.gz SCQOULOHFMEBAL-UHFFFAOYSA-N 1 1 233.311 3.512 20 0 BHADMO CC[N@H+](Cc1ccoc1)Cc1cc(C)oc1C ZINC000092935913 644673074 /nfs/dbraw/zinc/67/30/74/644673074.db2.gz SCQOULOHFMEBAL-UHFFFAOYSA-N 1 1 233.311 3.512 20 0 BHADMO Cc1ccc(C[N@H+](C)Cc2occc2C)s1 ZINC000093049398 135587719 /nfs/dbraw/zinc/58/77/19/135587719.db2.gz NPMCVAPEDIASLO-UHFFFAOYSA-N 1 1 235.352 3.590 20 0 BHADMO Cc1ccc([C@@H]2CCC[N@H+]2Cc2ccco2)s1 ZINC000093102659 360218072 /nfs/dbraw/zinc/21/80/72/360218072.db2.gz XLXDXTWXVSOCQS-ZDUSSCGKSA-N 1 1 247.363 3.987 20 0 BHADMO Cc1ccc([C@H]2CCC[N@H+]2Cc2ccco2)s1 ZINC000093102660 360218114 /nfs/dbraw/zinc/21/81/14/360218114.db2.gz XLXDXTWXVSOCQS-CYBMUJFWSA-N 1 1 247.363 3.987 20 0 BHADMO Cc1ccc([C@@H]2CCC[N@H+]2Cc2cc[nH]c2)s1 ZINC000093102747 345657033 /nfs/dbraw/zinc/65/70/33/345657033.db2.gz RRDIPMPKAWLHCD-ZDUSSCGKSA-N 1 1 246.379 3.722 20 0 BHADMO Cc1ccc([C@H]2CCC[N@H+]2Cc2cc[nH]c2)s1 ZINC000093102748 345656661 /nfs/dbraw/zinc/65/66/61/345656661.db2.gz RRDIPMPKAWLHCD-CYBMUJFWSA-N 1 1 246.379 3.722 20 0 BHADMO C[C@@H]1CCC[C@H](C)[N@@H+]1Cc1ccsc1 ZINC000093102953 644677292 /nfs/dbraw/zinc/67/72/92/644677292.db2.gz PDLYASARQUSUAM-PHIMTYICSA-N 1 1 209.358 3.511 20 0 BHADMO CC[C@@H](C)[C@@H](C)[N@@H+](Cc1cncs1)C1CC1 ZINC000093132095 360220165 /nfs/dbraw/zinc/22/01/65/360220165.db2.gz JTSPOSYLGOUPSE-GHMZBOCLSA-N 1 1 238.400 3.542 20 0 BHADMO CC[C@H](C)[C@@H](C)[N@@H+](Cc1cncs1)C1CC1 ZINC000093132096 360220178 /nfs/dbraw/zinc/22/01/78/360220178.db2.gz JTSPOSYLGOUPSE-WDEREUQCSA-N 1 1 238.400 3.542 20 0 BHADMO CC[C@@H](C)[C@H](C)[N@@H+](Cc1cncs1)C1CC1 ZINC000093132097 360219865 /nfs/dbraw/zinc/21/98/65/360219865.db2.gz JTSPOSYLGOUPSE-MNOVXSKESA-N 1 1 238.400 3.542 20 0 BHADMO CC[C@H](C)[C@H](C)[N@@H+](Cc1cncs1)C1CC1 ZINC000093132098 360219210 /nfs/dbraw/zinc/21/92/10/360219210.db2.gz JTSPOSYLGOUPSE-QWRGUYRKSA-N 1 1 238.400 3.542 20 0 BHADMO CC[C@@H](C)[C@@H](C)[N@@H+](Cc1cccnc1C)C1CC1 ZINC000093132257 360220375 /nfs/dbraw/zinc/22/03/75/360220375.db2.gz YTGNONGAFVHPDM-TZMCWYRMSA-N 1 1 246.398 3.789 20 0 BHADMO CC[C@H](C)[C@@H](C)[N@@H+](Cc1cccnc1C)C1CC1 ZINC000093132258 360220365 /nfs/dbraw/zinc/22/03/65/360220365.db2.gz YTGNONGAFVHPDM-GXTWGEPZSA-N 1 1 246.398 3.789 20 0 BHADMO CC[C@@H](C)[C@H](C)[N@@H+](Cc1cccnc1C)C1CC1 ZINC000093132259 135590415 /nfs/dbraw/zinc/59/04/15/135590415.db2.gz YTGNONGAFVHPDM-OCCSQVGLSA-N 1 1 246.398 3.789 20 0 BHADMO CC[C@H](C)[C@H](C)[N@@H+](Cc1cccnc1C)C1CC1 ZINC000093132260 360219948 /nfs/dbraw/zinc/21/99/48/360219948.db2.gz YTGNONGAFVHPDM-JSGCOSHPSA-N 1 1 246.398 3.789 20 0 BHADMO Cc1cccnc1C[N@H+](C)C1CCCCCC1 ZINC000093157926 388827319 /nfs/dbraw/zinc/82/73/19/388827319.db2.gz BTOGGKMNHJINNC-UHFFFAOYSA-N 1 1 232.371 3.545 20 0 BHADMO Cc1cccnc1C[N@H+](C)[C@@H](C)c1ccccc1 ZINC000093158094 179372004 /nfs/dbraw/zinc/37/20/04/179372004.db2.gz BTFJSUHAXRPUOC-AWEZNQCLSA-N 1 1 240.350 3.583 20 0 BHADMO Cc1cccnc1C[N@H+](C)[C@H](C)c1ccccc1 ZINC000093158095 179373574 /nfs/dbraw/zinc/37/35/74/179373574.db2.gz BTFJSUHAXRPUOC-CQSZACIVSA-N 1 1 240.350 3.583 20 0 BHADMO Cc1cccnc1C[N@H+]1CCC[C@@H]2CCCC[C@@H]21 ZINC000093158159 488135058 /nfs/dbraw/zinc/13/50/58/488135058.db2.gz OJDANIYTMYKOKB-HOCLYGCPSA-N 1 1 244.382 3.545 20 0 BHADMO CCCCC[N@@H+](Cc1ncccc1C)C(C)C ZINC000093158881 388827612 /nfs/dbraw/zinc/82/76/12/388827612.db2.gz UFNYJYPNJKENRO-UHFFFAOYSA-N 1 1 234.387 3.791 20 0 BHADMO CCC(CC)C[N@@H+](CC)Cc1ncccc1C ZINC000093159002 388827548 /nfs/dbraw/zinc/82/75/48/388827548.db2.gz YTZACYHGFPMMLF-UHFFFAOYSA-N 1 1 234.387 3.648 20 0 BHADMO 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20 0 BHADMO CCC(C)(C)[N@@H+](C)Cc1cnc(C(C)C)s1 ZINC000093279297 345660436 /nfs/dbraw/zinc/66/04/36/345660436.db2.gz HIVPAOVMOPFGHK-UHFFFAOYSA-N 1 1 240.416 3.887 20 0 BHADMO CCC(C)(C)[N@@H+](C)Cc1ccc(C)s1 ZINC000093279354 345659953 /nfs/dbraw/zinc/65/99/53/345659953.db2.gz GILHOOLYBVBDPB-UHFFFAOYSA-N 1 1 211.374 3.677 20 0 BHADMO CCC(C)(C)[N@@H+](C)Cc1cc(C)c(C)cc1O ZINC000093279406 644684534 /nfs/dbraw/zinc/68/45/34/644684534.db2.gz ZNIZLSVJZMLCIK-UHFFFAOYSA-N 1 1 235.371 3.629 20 0 BHADMO CCC(C)(C)[N@@H+](C)Cc1sccc1C ZINC000093279418 345660232 /nfs/dbraw/zinc/66/02/32/345660232.db2.gz UUYYANZQJFADKM-UHFFFAOYSA-N 1 1 211.374 3.677 20 0 BHADMO CCC(C)(C)[N@@H+](C)CC1=Cc2ccccc2OC1 ZINC000093279469 345660319 /nfs/dbraw/zinc/66/03/19/345660319.db2.gz YLVIQRORAHGSDQ-UHFFFAOYSA-N 1 1 245.366 3.583 20 0 BHADMO CCC(C)(C)[N@@H+](C)Cc1cc(C)oc1C ZINC000093279503 643335098 /nfs/dbraw/zinc/33/50/98/643335098.db2.gz KGFJFIXCAFHBMR-UHFFFAOYSA-N 1 1 209.333 3.517 20 0 BHADMO 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CC(C)C[C@@H]([NH2+]Cc1ccon1)c1ccccc1 ZINC000093978123 384285410 /nfs/dbraw/zinc/28/54/10/384285410.db2.gz KPFSOQDNWCEJDT-OAHLLOKOSA-N 1 1 244.338 3.552 20 0 BHADMO CCc1ccccc1CNc1cc[nH+]cc1Cl ZINC000094267066 386446797 /nfs/dbraw/zinc/44/67/97/386446797.db2.gz CLENYUIULAXWAO-UHFFFAOYSA-N 1 1 246.741 3.910 20 0 BHADMO CC(C)C[N@@H+](Cc1cccc(N)c1)C1CCCC1 ZINC000094845909 353522573 /nfs/dbraw/zinc/52/25/73/353522573.db2.gz KREHTHZOSREQKH-UHFFFAOYSA-N 1 1 246.398 3.669 20 0 BHADMO C[N@@H+](Cc1cccc(N)c1)C1CCC(C)(C)CC1 ZINC000094857412 632670566 /nfs/dbraw/zinc/67/05/66/632670566.db2.gz GNLVSFQXXYOWSO-UHFFFAOYSA-N 1 1 246.398 3.669 20 0 BHADMO Cc1ccsc1CNc1[nH]c2ccccc2[nH+]1 ZINC000094882605 386461628 /nfs/dbraw/zinc/46/16/28/386461628.db2.gz PJURGEZTNBRUFD-UHFFFAOYSA-N 1 1 243.335 3.545 20 0 BHADMO Cc1cscc1CNc1[nH]c2ccccc2[nH+]1 ZINC000094883049 360325007 /nfs/dbraw/zinc/32/50/07/360325007.db2.gz DPDHGVBKTFCFOJ-UHFFFAOYSA-N 1 1 243.335 3.545 20 0 BHADMO c1ccc(CNc2cccc3cc[nH+]cc32)cc1 ZINC000094967221 384386871 /nfs/dbraw/zinc/38/68/71/384386871.db2.gz VGRMDNJWMHXCMD-UHFFFAOYSA-N 1 1 234.302 3.847 20 0 BHADMO C[C@@H](Cc1ccsc1)[N@@H+](C)C1CCCC1 ZINC000095442076 384908066 /nfs/dbraw/zinc/90/80/66/384908066.db2.gz MIJQTPUKHBGZBO-NSHDSACASA-N 1 1 223.385 3.554 20 0 BHADMO C[C@H](Cc1ccsc1)[N@@H+](C)C1CCCC1 ZINC000095442077 384906426 /nfs/dbraw/zinc/90/64/26/384906426.db2.gz MIJQTPUKHBGZBO-LLVKDONJSA-N 1 1 223.385 3.554 20 0 BHADMO CC[N@@H+](CCc1ccccc1)Cc1ccccc1 ZINC000095811143 355770919 /nfs/dbraw/zinc/77/09/19/355770919.db2.gz LNIJJBOEPKQGPF-UHFFFAOYSA-N 1 1 239.362 3.751 20 0 BHADMO C[C@@H](c1cccc(O)c1)[N@@H+](C)CC1CCCC1 ZINC000096477960 256645147 /nfs/dbraw/zinc/64/51/47/256645147.db2.gz YTPQQGMGQWMGPP-LBPRGKRZSA-N 1 1 233.355 3.575 20 0 BHADMO C[C@H](c1cccc(O)c1)[N@@H+](C)CC1CCCC1 ZINC000096477962 387035050 /nfs/dbraw/zinc/03/50/50/387035050.db2.gz YTPQQGMGQWMGPP-GFCCVEGCSA-N 1 1 233.355 3.575 20 0 BHADMO CCCCC[N@@H+](C)[C@@H](C)c1cccc(O)c1 ZINC000096687099 387047015 /nfs/dbraw/zinc/04/70/15/387047015.db2.gz YWHRANRISDTLSH-LBPRGKRZSA-N 1 1 221.344 3.575 20 0 BHADMO CCCCC[N@@H+](C)[C@H](C)c1cccc(O)c1 ZINC000096687100 387045957 /nfs/dbraw/zinc/04/59/57/387045957.db2.gz YWHRANRISDTLSH-GFCCVEGCSA-N 1 1 221.344 3.575 20 0 BHADMO Cc1cc(C[N@H+](C)[C@@H](C)C(C)(C)C)cc(C)c1O ZINC000096835446 343155316 /nfs/dbraw/zinc/15/53/16/343155316.db2.gz ZORMVDKCYOUWDW-ZDUSSCGKSA-N 1 1 249.398 3.875 20 0 BHADMO Cc1cc(C[N@H+](C)[C@H](C)C(C)(C)C)cc(C)c1O ZINC000096835447 343155293 /nfs/dbraw/zinc/15/52/93/343155293.db2.gz ZORMVDKCYOUWDW-CYBMUJFWSA-N 1 1 249.398 3.875 20 0 BHADMO CCCC[N@@H+](CC)Cc1cc(C)c(O)c(C)c1 ZINC000096835458 256646550 /nfs/dbraw/zinc/64/65/50/256646550.db2.gz FMWSCDRDMFXEPP-UHFFFAOYSA-N 1 1 235.371 3.631 20 0 BHADMO CC[C@@H]1CCCC[N@H+]1Cc1cc(C)c(O)c(C)c1 ZINC000096942578 256647286 /nfs/dbraw/zinc/64/72/86/256647286.db2.gz VXIYGZLCQPMSSB-OAHLLOKOSA-N 1 1 247.382 3.774 20 0 BHADMO CC[C@H]1CCCC[N@H+]1Cc1cc(C)c(O)c(C)c1 ZINC000096942579 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/nfs/dbraw/zinc/01/99/39/176019939.db2.gz OZVOFMYBUPHJRJ-HNNXBMFYSA-N 1 1 239.362 3.922 20 0 BHADMO C[C@H](c1ccccc1)[N@@H+](C)CCc1ccccc1 ZINC000096955964 177039266 /nfs/dbraw/zinc/03/92/66/177039266.db2.gz OZVOFMYBUPHJRJ-OAHLLOKOSA-N 1 1 239.362 3.922 20 0 BHADMO CC[C@@H]1CCCC[N@H+]1CCc1ccc(OC)cc1 ZINC000096969170 635461683 /nfs/dbraw/zinc/46/16/83/635461683.db2.gz QPHDGYNWTUKWKB-OAHLLOKOSA-N 1 1 247.382 3.502 20 0 BHADMO CC[C@H]1CCCC[N@H+]1CCc1ccc(OC)cc1 ZINC000096969171 635462993 /nfs/dbraw/zinc/46/29/93/635462993.db2.gz QPHDGYNWTUKWKB-HNNXBMFYSA-N 1 1 247.382 3.502 20 0 BHADMO COc1ccc(CC[N@@H+](C)C2CCCCC2)cc1 ZINC000096969183 635462345 /nfs/dbraw/zinc/46/23/45/635462345.db2.gz XECPAEMICIPTRP-UHFFFAOYSA-N 1 1 247.382 3.502 20 0 BHADMO CC(C)[N@@H+](C)Cc1cccc2ccccc21 ZINC000096969887 635462117 /nfs/dbraw/zinc/46/21/17/635462117.db2.gz DUPFCUUEFMUGNL-UHFFFAOYSA-N 1 1 213.324 3.680 20 0 BHADMO CC(C)[N@@H+](C)Cc1ccccc1C(F)(F)F ZINC000096969899 387232540 /nfs/dbraw/zinc/23/25/40/387232540.db2.gz KLQXTRGMXWLTRU-UHFFFAOYSA-N 1 1 231.261 3.546 20 0 BHADMO CCCC[N@@H+](CC)Cc1nc2ccccc2s1 ZINC000096970254 385263390 /nfs/dbraw/zinc/26/33/90/385263390.db2.gz QYAWVYSINYDOEW-UHFFFAOYSA-N 1 1 248.395 3.918 20 0 BHADMO CCC[N@H+](Cc1ccc(F)c(F)c1)CC1CC1 ZINC000096970333 386411400 /nfs/dbraw/zinc/41/14/00/386411400.db2.gz ZUVCKBZBMDCZJU-UHFFFAOYSA-N 1 1 239.309 3.587 20 0 BHADMO CCOc1ccc(C[N@@H+](C)CCC(C)C)cc1 ZINC000096970677 386412689 /nfs/dbraw/zinc/41/26/89/386412689.db2.gz HNONCLMWRAKTNB-UHFFFAOYSA-N 1 1 235.371 3.563 20 0 BHADMO CC[N@@H+](CCc1ccccc1)Cc1cccs1 ZINC000096981578 386410717 /nfs/dbraw/zinc/41/07/17/386410717.db2.gz CKNHZPKYUYEVIR-UHFFFAOYSA-N 1 1 245.391 3.813 20 0 BHADMO Cc1ccsc1C[N@@H+](C)CCc1ccccc1 ZINC000096981841 386412567 /nfs/dbraw/zinc/41/25/67/386412567.db2.gz UHIZEODYJRKMGP-UHFFFAOYSA-N 1 1 245.391 3.731 20 0 BHADMO CCCCC[N@@H+](C)[C@@H](C)c1ccccc1 ZINC000096982197 537906015 /nfs/dbraw/zinc/90/60/15/537906015.db2.gz CJNIEHRWXFODEH-ZDUSSCGKSA-N 1 1 205.345 3.870 20 0 BHADMO CCCCC[N@@H+](C)[C@H](C)c1ccccc1 ZINC000096982198 537906238 /nfs/dbraw/zinc/90/62/38/537906238.db2.gz CJNIEHRWXFODEH-CYBMUJFWSA-N 1 1 205.345 3.870 20 0 BHADMO C[C@@H](c1cccs1)[N@@H+](C)CCc1ccccc1 ZINC000096990626 176033383 /nfs/dbraw/zinc/03/33/83/176033383.db2.gz TXDVGOSMGLMCAN-ZDUSSCGKSA-N 1 1 245.391 3.984 20 0 BHADMO C[C@H](c1cccs1)[N@@H+](C)CCc1ccccc1 ZINC000096990627 177049392 /nfs/dbraw/zinc/04/93/92/177049392.db2.gz TXDVGOSMGLMCAN-CYBMUJFWSA-N 1 1 245.391 3.984 20 0 BHADMO CC(C)CC[N@H+]1CCC[C@@H]1c1ccccc1 ZINC000097027086 487685091 /nfs/dbraw/zinc/68/50/91/487685091.db2.gz NZQCTAQCQDITAJ-OAHLLOKOSA-N 1 1 217.356 3.870 20 0 BHADMO CC(C)CC[N@H+]1CCC[C@H]1c1ccccc1 ZINC000097027087 487685025 /nfs/dbraw/zinc/68/50/25/487685025.db2.gz NZQCTAQCQDITAJ-HNNXBMFYSA-N 1 1 217.356 3.870 20 0 BHADMO COc1ccc([C@H](C)[N@@H+](C)CCC(C)C)cc1 ZINC000097150424 487689875 /nfs/dbraw/zinc/68/98/75/487689875.db2.gz CXYGSYMFBWTEOV-ZDUSSCGKSA-N 1 1 235.371 3.734 20 0 BHADMO COc1ccc([C@@H](C)[N@@H+](C)CCC(C)C)cc1 ZINC000097150425 487689889 /nfs/dbraw/zinc/68/98/89/487689889.db2.gz CXYGSYMFBWTEOV-CYBMUJFWSA-N 1 1 235.371 3.734 20 0 BHADMO CC[C@@H]1CCC[N@@H+](Cc2ccc(F)c(F)c2)C1 ZINC000097254493 355846360 /nfs/dbraw/zinc/84/63/60/355846360.db2.gz ZSVOGLAQBLZBNP-LLVKDONJSA-N 1 1 239.309 3.587 20 0 BHADMO CC[C@H]1CCC[N@@H+](Cc2ccc(F)c(F)c2)C1 ZINC000097254495 386439774 /nfs/dbraw/zinc/43/97/74/386439774.db2.gz ZSVOGLAQBLZBNP-NSHDSACASA-N 1 1 239.309 3.587 20 0 BHADMO C[N@@H+](CCc1ccc(F)cc1)Cc1cccs1 ZINC000097268977 384117070 /nfs/dbraw/zinc/11/70/70/384117070.db2.gz YBMMNFJCYPPVQT-UHFFFAOYSA-N 1 1 249.354 3.562 20 0 BHADMO Cc1occc1C[N@H+](C)[C@@H](C)c1ccccc1 ZINC000097270857 360367856 /nfs/dbraw/zinc/36/78/56/360367856.db2.gz HJSOYQAKJXSZGP-LBPRGKRZSA-N 1 1 229.323 3.781 20 0 BHADMO Cc1occc1C[N@H+](C)[C@H](C)c1ccccc1 ZINC000097270858 360367289 /nfs/dbraw/zinc/36/72/89/360367289.db2.gz HJSOYQAKJXSZGP-GFCCVEGCSA-N 1 1 229.323 3.781 20 0 BHADMO C[C@@H](c1ccccc1)[N@@H+](C)CC1CCCC1 ZINC000097356880 176020583 /nfs/dbraw/zinc/02/05/83/176020583.db2.gz LZKZXXILEUGFKK-ZDUSSCGKSA-N 1 1 217.356 3.870 20 0 BHADMO C[C@H](c1ccccc1)[N@@H+](C)CC1CCCC1 ZINC000097356881 177037620 /nfs/dbraw/zinc/03/76/20/177037620.db2.gz LZKZXXILEUGFKK-CYBMUJFWSA-N 1 1 217.356 3.870 20 0 BHADMO CC[N@@H+](Cc1ccc(F)c(F)c1)C1CCCC1 ZINC000097357935 344732964 /nfs/dbraw/zinc/73/29/64/344732964.db2.gz QGGJYWROXNAOGG-UHFFFAOYSA-N 1 1 239.309 3.729 20 0 BHADMO CCCCC[N@@H+](CCc1ccncc1)C(C)C ZINC000097474017 387247295 /nfs/dbraw/zinc/24/72/95/387247295.db2.gz TUCVZULLENYDBK-UHFFFAOYSA-N 1 1 234.387 3.525 20 0 BHADMO CSCC[N@@H+](C)Cc1cccc2ccccc21 ZINC000097474540 387246845 /nfs/dbraw/zinc/24/68/45/387246845.db2.gz QAUWJISURXZQCB-UHFFFAOYSA-N 1 1 245.391 3.635 20 0 BHADMO CSCC[N@@H+](C)[C@@H](C)c1cccc(Cl)c1 ZINC000097475980 387246962 /nfs/dbraw/zinc/24/69/62/387246962.db2.gz RONLZAJNKDONBY-JTQLQIEISA-N 1 1 243.803 3.696 20 0 BHADMO CSCC[N@@H+](C)[C@H](C)c1cccc(Cl)c1 ZINC000097475981 387248023 /nfs/dbraw/zinc/24/80/23/387248023.db2.gz RONLZAJNKDONBY-SNVBAGLBSA-N 1 1 243.803 3.696 20 0 BHADMO CSCC[N@@H+](C)[C@@H](C)c1ccccc1Cl ZINC000097475987 387246874 /nfs/dbraw/zinc/24/68/74/387246874.db2.gz PXFHNTAQCLXLCR-JTQLQIEISA-N 1 1 243.803 3.696 20 0 BHADMO CSCC[N@@H+](C)[C@H](C)c1ccccc1Cl ZINC000097475988 175493356 /nfs/dbraw/zinc/49/33/56/175493356.db2.gz PXFHNTAQCLXLCR-SNVBAGLBSA-N 1 1 243.803 3.696 20 0 BHADMO CC(C)[N@H+](Cc1cccc(Cl)c1)CC1CC1 ZINC000097489786 188148803 /nfs/dbraw/zinc/14/88/03/188148803.db2.gz PPIODJPHIWIZSD-UHFFFAOYSA-N 1 1 237.774 3.960 20 0 BHADMO CC[N@@H+](CCc1ccc(OC)cc1)C1CCCC1 ZINC000097491326 386465013 /nfs/dbraw/zinc/46/50/13/386465013.db2.gz CEHYHSPDKFDPPH-UHFFFAOYSA-N 1 1 247.382 3.502 20 0 BHADMO CC(C)[N@@H+](C)Cc1cc(Cl)cc(Cl)c1 ZINC000097492012 384223865 /nfs/dbraw/zinc/22/38/65/384223865.db2.gz CJNHWPPBJUBLMU-UHFFFAOYSA-N 1 1 232.154 3.834 20 0 BHADMO c1cc(C[N@H+](CC2CC2)C2CCCCC2)ccn1 ZINC000097600556 183338782 /nfs/dbraw/zinc/33/87/82/183338782.db2.gz XSQOAKBUXDCONR-UHFFFAOYSA-N 1 1 244.382 3.626 20 0 BHADMO Cc1ccc(NCCCCC(C)C)[nH+]c1 ZINC000097635690 636189580 /nfs/dbraw/zinc/18/95/80/636189580.db2.gz HTPJIGZGTFSLEC-UHFFFAOYSA-N 1 1 206.333 3.628 20 0 BHADMO CC[C@@H]1CCC[N@@H+](Cc2cc(C)c(O)c(C)c2)C1 ZINC000097658620 386474888 /nfs/dbraw/zinc/47/48/88/386474888.db2.gz HKBISCSHRDDKDT-CQSZACIVSA-N 1 1 247.382 3.631 20 0 BHADMO CC[C@H]1CCC[N@@H+](Cc2cc(C)c(O)c(C)c2)C1 ZINC000097658622 386475708 /nfs/dbraw/zinc/47/57/08/386475708.db2.gz HKBISCSHRDDKDT-AWEZNQCLSA-N 1 1 247.382 3.631 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)Cc1cc(C)c(O)c(C)c1 ZINC000097658658 386475537 /nfs/dbraw/zinc/47/55/37/386475537.db2.gz LVWHLDINUIPQCM-CYBMUJFWSA-N 1 1 235.371 3.629 20 0 BHADMO CCC[C@H](C)[N@@H+](C)Cc1cc(C)c(O)c(C)c1 ZINC000097658660 386475477 /nfs/dbraw/zinc/47/54/77/386475477.db2.gz LVWHLDINUIPQCM-ZDUSSCGKSA-N 1 1 235.371 3.629 20 0 BHADMO CCCC[N@@H+](C)Cc1cc(Cl)nc(Cl)c1 ZINC000098129942 631684857 /nfs/dbraw/zinc/68/48/57/631684857.db2.gz GJHCFMLOFUYOFN-UHFFFAOYSA-N 1 1 247.169 3.620 20 0 BHADMO CC[N@@H+](Cc1cnc(C)s1)C1CCCCC1 ZINC000098132522 360389291 /nfs/dbraw/zinc/38/92/91/360389291.db2.gz LTWZPMSFSBJOMB-UHFFFAOYSA-N 1 1 238.400 3.606 20 0 BHADMO CCCCC[N@@H+](Cc1cnc(C)s1)C(C)C ZINC000098132645 360389777 /nfs/dbraw/zinc/38/97/77/360389777.db2.gz MOHVGCDCCOAIBS-UHFFFAOYSA-N 1 1 240.416 3.852 20 0 BHADMO CCCC[N@H+]1CCc2ccccc2[C@@H]1CC ZINC000101226585 350164968 /nfs/dbraw/zinc/16/49/68/350164968.db2.gz WCHTUDGSCKBZLK-HNNXBMFYSA-N 1 1 217.356 3.796 20 0 BHADMO CCCC[N@H+]1CCc2ccccc2[C@H]1CC ZINC000101226587 350164939 /nfs/dbraw/zinc/16/49/39/350164939.db2.gz WCHTUDGSCKBZLK-OAHLLOKOSA-N 1 1 217.356 3.796 20 0 BHADMO C[N@H+](CCc1ccncc1)CCC1CCCCC1 ZINC000101566060 323160032 /nfs/dbraw/zinc/16/00/32/323160032.db2.gz MPGZXSYIFCYYIX-UHFFFAOYSA-N 1 1 246.398 3.526 20 0 BHADMO CC[N@@H+](Cc1ccoc1)Cc1cccc(C)c1 ZINC000102408453 357388974 /nfs/dbraw/zinc/38/89/74/357388974.db2.gz UJHPXYKFQWRFSB-UHFFFAOYSA-N 1 1 229.323 3.610 20 0 BHADMO CC[N@@H+](Cc1ccoc1)Cc1ccc(C)cc1 ZINC000102408722 357389168 /nfs/dbraw/zinc/38/91/68/357389168.db2.gz DKDJIWGMSPXKGP-UHFFFAOYSA-N 1 1 229.323 3.610 20 0 BHADMO CC[N@@H+](Cc1ccoc1)[C@@H](C)c1ccccc1 ZINC000102517888 357477247 /nfs/dbraw/zinc/47/72/47/357477247.db2.gz NWWGQSAQXWGBPR-ZDUSSCGKSA-N 1 1 229.323 3.863 20 0 BHADMO CC[N@@H+](Cc1ccoc1)[C@H](C)c1ccccc1 ZINC000102517894 357477587 /nfs/dbraw/zinc/47/75/87/357477587.db2.gz NWWGQSAQXWGBPR-CYBMUJFWSA-N 1 1 229.323 3.863 20 0 BHADMO CC(C)[N@@H+](Cc1ccco1)Cc1ccccc1 ZINC000102673840 384576116 /nfs/dbraw/zinc/57/61/16/384576116.db2.gz KACVNIXQMPNBCB-UHFFFAOYSA-N 1 1 229.323 3.690 20 0 BHADMO C[N@@H+](C/C=C\c1ccccc1)Cc1ccsc1 ZINC000102675670 357785407 /nfs/dbraw/zinc/78/54/07/357785407.db2.gz PXQMXIMCQHKQRW-YVMONPNESA-N 1 1 243.375 3.893 20 0 BHADMO C[C@@H](c1ccccc1)[N@@H+](C)Cc1ccsc1 ZINC000102675709 176021068 /nfs/dbraw/zinc/02/10/68/176021068.db2.gz CVIGSMQOBAKFDZ-LBPRGKRZSA-N 1 1 231.364 3.941 20 0 BHADMO C[C@H](c1ccccc1)[N@@H+](C)Cc1ccsc1 ZINC000102675711 177038894 /nfs/dbraw/zinc/03/88/94/177038894.db2.gz CVIGSMQOBAKFDZ-GFCCVEGCSA-N 1 1 231.364 3.941 20 0 BHADMO Cc1cc(C[N@H+](C(C)C)C2CCCCC2)no1 ZINC000102768767 384575801 /nfs/dbraw/zinc/57/58/01/384575801.db2.gz VKXYYDMPUWTGMN-UHFFFAOYSA-N 1 1 236.359 3.526 20 0 BHADMO Cc1ccc(C[N@H+](C)Cc2ccccc2)s1 ZINC000102774579 384575696 /nfs/dbraw/zinc/57/56/96/384575696.db2.gz BQIZFJHQVLQTOV-UHFFFAOYSA-N 1 1 231.364 3.689 20 0 BHADMO COCCCCC[N@H+]1CCC[C@@H]1c1ccccc1 ZINC000103225383 174178924 /nfs/dbraw/zinc/17/89/24/174178924.db2.gz AIOXRKLIFPBICA-MRXNPFEDSA-N 1 1 247.382 3.640 20 0 BHADMO COCCCCC[N@H+]1CCC[C@H]1c1ccccc1 ZINC000103225386 174178477 /nfs/dbraw/zinc/17/84/77/174178477.db2.gz AIOXRKLIFPBICA-INIZCTEOSA-N 1 1 247.382 3.640 20 0 BHADMO CCC[N@@H+](CCCCCOC)Cc1ccccc1 ZINC000103225447 323245989 /nfs/dbraw/zinc/24/59/89/323245989.db2.gz ZUXOKDCRBVGWKC-UHFFFAOYSA-N 1 1 249.398 3.715 20 0 BHADMO CC[N@@H+](CCCCCOC)Cc1ccccc1C ZINC000103225905 323246241 /nfs/dbraw/zinc/24/62/41/323246241.db2.gz MCBKAOLJTDPXAA-UHFFFAOYSA-N 1 1 249.398 3.634 20 0 BHADMO COCCCCC[N@@H+](Cc1ccccc1)C(C)C ZINC000103226213 174177561 /nfs/dbraw/zinc/17/75/61/174177561.db2.gz PYXNXFGTCJEYRP-UHFFFAOYSA-N 1 1 249.398 3.714 20 0 BHADMO COCCCCC[N@@H+](C)[C@H](C)c1ccc(C)cc1 ZINC000103226508 323246445 /nfs/dbraw/zinc/24/64/45/323246445.db2.gz UVWUULSMWSJFHM-OAHLLOKOSA-N 1 1 249.398 3.805 20 0 BHADMO COCCCCC[N@@H+](C)[C@@H](C)c1ccc(C)cc1 ZINC000103226510 323246432 /nfs/dbraw/zinc/24/64/32/323246432.db2.gz UVWUULSMWSJFHM-HNNXBMFYSA-N 1 1 249.398 3.805 20 0 BHADMO COCCCCC[N@@H+](C)[C@@H](C)c1cccs1 ZINC000103226599 174176345 /nfs/dbraw/zinc/17/63/45/174176345.db2.gz CPPXVAHLRFRUJR-LBPRGKRZSA-N 1 1 241.400 3.558 20 0 BHADMO COCCCCC[N@@H+](C)[C@H](C)c1cccs1 ZINC000103226601 174175467 /nfs/dbraw/zinc/17/54/67/174175467.db2.gz CPPXVAHLRFRUJR-GFCCVEGCSA-N 1 1 241.400 3.558 20 0 BHADMO c1csc(CC[N@@H+](C2CC2)C2CCCC2)c1 ZINC000103465952 585104786 /nfs/dbraw/zinc/10/47/86/585104786.db2.gz HUGAVSATPGFIFQ-UHFFFAOYSA-N 1 1 235.396 3.698 20 0 BHADMO Cc1ccc(C[N@H+]2CCC[C@@H]2c2ccc[nH]2)cc1 ZINC000103468971 384774232 /nfs/dbraw/zinc/77/42/32/384774232.db2.gz VKJFYODRPXSREL-MRXNPFEDSA-N 1 1 240.350 3.660 20 0 BHADMO Cc1ccc(C[N@H+]2CCC[C@H]2c2ccc[nH]2)cc1 ZINC000103468972 384774993 /nfs/dbraw/zinc/77/49/93/384774993.db2.gz VKJFYODRPXSREL-INIZCTEOSA-N 1 1 240.350 3.660 20 0 BHADMO CC(C)[N@@H+](CCc1ccncc1)C1CCCCC1 ZINC000103479131 384776403 /nfs/dbraw/zinc/77/64/03/384776403.db2.gz MTPZQHPPGFTNSD-UHFFFAOYSA-N 1 1 246.398 3.667 20 0 BHADMO CC(C)[N@@H+](CCc1ccccn1)C1CCCCC1 ZINC000103479134 384776956 /nfs/dbraw/zinc/77/69/56/384776956.db2.gz LXAGZHJNFJPXIG-UHFFFAOYSA-N 1 1 246.398 3.667 20 0 BHADMO CC[C@@H](C)[N@@H+](C)Cc1cc(F)cc2cccnc21 ZINC000104686070 323285987 /nfs/dbraw/zinc/28/59/87/323285987.db2.gz LPQBBFUPOIDYRB-LLVKDONJSA-N 1 1 246.329 3.604 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1cc(F)cc2cccnc21 ZINC000104686073 323285805 /nfs/dbraw/zinc/28/58/05/323285805.db2.gz LPQBBFUPOIDYRB-NSHDSACASA-N 1 1 246.329 3.604 20 0 BHADMO CC[C@@H](C)[N@@H+](C)Cc1ccc(OC(F)F)cc1 ZINC000104688239 323285611 /nfs/dbraw/zinc/28/56/11/323285611.db2.gz CUMMSQQZRRXKET-SNVBAGLBSA-N 1 1 243.297 3.518 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1ccc(OC(F)F)cc1 ZINC000104688242 323285590 /nfs/dbraw/zinc/28/55/90/323285590.db2.gz CUMMSQQZRRXKET-JTQLQIEISA-N 1 1 243.297 3.518 20 0 BHADMO CCCCc1nc(C[N@@H+](C)[C@@H](C)CC)cs1 ZINC000104688264 384703878 /nfs/dbraw/zinc/70/38/78/384703878.db2.gz OCWXEXZTRXIVLC-NSHDSACASA-N 1 1 240.416 3.716 20 0 BHADMO CCCCc1nc(C[N@@H+](C)[C@H](C)CC)cs1 ZINC000104688266 188160397 /nfs/dbraw/zinc/16/03/97/188160397.db2.gz OCWXEXZTRXIVLC-LLVKDONJSA-N 1 1 240.416 3.716 20 0 BHADMO CCC[N@H+]1CCc2[nH]c3ccc(Cl)cc3c2C1 ZINC000104723688 323288101 /nfs/dbraw/zinc/28/81/01/323288101.db2.gz SMHQEYNVIYXPNL-UHFFFAOYSA-N 1 1 248.757 3.589 20 0 BHADMO CCC[N@@H+]1CCc2[nH]c3ccc(Cl)cc3c2C1 ZINC000104723688 323288099 /nfs/dbraw/zinc/28/80/99/323288099.db2.gz SMHQEYNVIYXPNL-UHFFFAOYSA-N 1 1 248.757 3.589 20 0 BHADMO CC(C)[N@H+]1CCc2[nH]c3ccc(Cl)cc3c2C1 ZINC000104724206 167027735 /nfs/dbraw/zinc/02/77/35/167027735.db2.gz WFOCWAZBIMJMQD-UHFFFAOYSA-N 1 1 248.757 3.588 20 0 BHADMO CC(C)[N@@H+]1CCc2[nH]c3ccc(Cl)cc3c2C1 ZINC000104724206 167027733 /nfs/dbraw/zinc/02/77/33/167027733.db2.gz WFOCWAZBIMJMQD-UHFFFAOYSA-N 1 1 248.757 3.588 20 0 BHADMO c1ccc(C[N@H+]2CCC[C@@H]2C2CCCCC2)nc1 ZINC000104946818 323300341 /nfs/dbraw/zinc/30/03/41/323300341.db2.gz SGHSUXMTQBVRSP-MRXNPFEDSA-N 1 1 244.382 3.626 20 0 BHADMO c1ccc(C[N@H+]2CCC[C@H]2C2CCCCC2)nc1 ZINC000104946820 323300219 /nfs/dbraw/zinc/30/02/19/323300219.db2.gz SGHSUXMTQBVRSP-INIZCTEOSA-N 1 1 244.382 3.626 20 0 BHADMO CC[N@@H+](Cc1ccccn1)[C@@H](C)c1ccccc1 ZINC000104949071 346548830 /nfs/dbraw/zinc/54/88/30/346548830.db2.gz ILALQZCUMHWSHA-AWEZNQCLSA-N 1 1 240.350 3.665 20 0 BHADMO CC[N@@H+](Cc1ccccn1)[C@H](C)c1ccccc1 ZINC000104949076 346548647 /nfs/dbraw/zinc/54/86/47/346548647.db2.gz ILALQZCUMHWSHA-CQSZACIVSA-N 1 1 240.350 3.665 20 0 BHADMO C[N@@H+](Cc1ccccn1)C1CCCCCCC1 ZINC000104949779 645255588 /nfs/dbraw/zinc/25/55/88/645255588.db2.gz JMAYATQURRZSFE-UHFFFAOYSA-N 1 1 232.371 3.626 20 0 BHADMO c1ccc(C[N@H+](CC2CC2)C2CCCCC2)nc1 ZINC000104959527 183396595 /nfs/dbraw/zinc/39/65/95/183396595.db2.gz JLKCNGJNZHYJGO-UHFFFAOYSA-N 1 1 244.382 3.626 20 0 BHADMO CC[C@@H](C)[C@@H](C)[N@@H+](CCCCCOC)C1CC1 ZINC000104967086 358552841 /nfs/dbraw/zinc/55/28/41/358552841.db2.gz GBHWCJHMJBLVKD-ZIAGYGMSSA-N 1 1 241.419 3.702 20 0 BHADMO CC[C@H](C)[C@@H](C)[N@@H+](CCCCCOC)C1CC1 ZINC000104967089 358553113 /nfs/dbraw/zinc/55/31/13/358553113.db2.gz GBHWCJHMJBLVKD-UONOGXRCSA-N 1 1 241.419 3.702 20 0 BHADMO CC[C@@H](C)[C@H](C)[N@@H+](CCCCCOC)C1CC1 ZINC000104967093 358552876 /nfs/dbraw/zinc/55/28/76/358552876.db2.gz GBHWCJHMJBLVKD-KGLIPLIRSA-N 1 1 241.419 3.702 20 0 BHADMO CC[C@H](C)[C@H](C)[N@@H+](CCCCCOC)C1CC1 ZINC000104967095 358553096 /nfs/dbraw/zinc/55/30/96/358553096.db2.gz GBHWCJHMJBLVKD-KBPBESRZSA-N 1 1 241.419 3.702 20 0 BHADMO CC[C@@H](C)[C@@H](C)[N@@H+](CCc1ccncc1)C1CC1 ZINC000104967831 384854894 /nfs/dbraw/zinc/85/48/94/384854894.db2.gz QMWMBQPUGAGWRS-ZIAGYGMSSA-N 1 1 246.398 3.523 20 0 BHADMO CC[C@H](C)[C@@H](C)[N@@H+](CCc1ccncc1)C1CC1 ZINC000104967836 171361761 /nfs/dbraw/zinc/36/17/61/171361761.db2.gz QMWMBQPUGAGWRS-UONOGXRCSA-N 1 1 246.398 3.523 20 0 BHADMO CC[C@@H](C)[C@H](C)[N@@H+](CCc1ccncc1)C1CC1 ZINC000104967842 384852823 /nfs/dbraw/zinc/85/28/23/384852823.db2.gz QMWMBQPUGAGWRS-KGLIPLIRSA-N 1 1 246.398 3.523 20 0 BHADMO CC[C@H](C)[C@H](C)[N@@H+](CCc1ccncc1)C1CC1 ZINC000104967846 171385758 /nfs/dbraw/zinc/38/57/58/171385758.db2.gz QMWMBQPUGAGWRS-KBPBESRZSA-N 1 1 246.398 3.523 20 0 BHADMO CC[C@@H](C)[C@@H](C)[N@@H+](CCc1ccccn1)C1CC1 ZINC000104967922 384726344 /nfs/dbraw/zinc/72/63/44/384726344.db2.gz CXLNDEFYUOOYNL-ZIAGYGMSSA-N 1 1 246.398 3.523 20 0 BHADMO CC[C@H](C)[C@@H](C)[N@@H+](CCc1ccccn1)C1CC1 ZINC000104967925 171361543 /nfs/dbraw/zinc/36/15/43/171361543.db2.gz CXLNDEFYUOOYNL-UONOGXRCSA-N 1 1 246.398 3.523 20 0 BHADMO CC[C@@H](C)[C@H](C)[N@@H+](CCc1ccccn1)C1CC1 ZINC000104967928 384727216 /nfs/dbraw/zinc/72/72/16/384727216.db2.gz CXLNDEFYUOOYNL-KGLIPLIRSA-N 1 1 246.398 3.523 20 0 BHADMO CC[C@H](C)[C@H](C)[N@@H+](CCc1ccccn1)C1CC1 ZINC000104967929 171386446 /nfs/dbraw/zinc/38/64/46/171386446.db2.gz CXLNDEFYUOOYNL-KBPBESRZSA-N 1 1 246.398 3.523 20 0 BHADMO Cc1[nH+]cn(Cc2cccc3ccccc32)c1C ZINC000106440703 188166897 /nfs/dbraw/zinc/16/68/97/188166897.db2.gz RDBUNQKYUNSJTK-UHFFFAOYSA-N 1 1 236.318 3.701 20 0 BHADMO Cc1[nH+]cn(Cc2ccc(C(C)(C)C)cc2)c1C ZINC000106440729 387956873 /nfs/dbraw/zinc/95/68/73/387956873.db2.gz WMSZVQGRJKOLSF-UHFFFAOYSA-N 1 1 242.366 3.846 20 0 BHADMO Cc1nc(C)c([C@@H](C)[N@H+](C)CCC(C)C)s1 ZINC000106876028 385538939 /nfs/dbraw/zinc/53/89/39/385538939.db2.gz QBHNQXOTVKHHEL-LLVKDONJSA-N 1 1 240.416 3.799 20 0 BHADMO Cc1nc(C)c([C@H](C)[N@H+](C)CCC(C)C)s1 ZINC000106876030 385537942 /nfs/dbraw/zinc/53/79/42/385537942.db2.gz QBHNQXOTVKHHEL-NSHDSACASA-N 1 1 240.416 3.799 20 0 BHADMO CC(C)=CC[N@H+](C)[C@H](C)c1sc(C)nc1C ZINC000106876105 384937898 /nfs/dbraw/zinc/93/78/98/384937898.db2.gz XPSGUXIIFKLSIO-LLVKDONJSA-N 1 1 238.400 3.719 20 0 BHADMO CC(C)=CC[N@H+](C)[C@@H](C)c1sc(C)nc1C ZINC000106876106 384936437 /nfs/dbraw/zinc/93/64/37/384936437.db2.gz XPSGUXIIFKLSIO-NSHDSACASA-N 1 1 238.400 3.719 20 0 BHADMO CCCC[N@@H+](C)[C@@H](C)c1sc(C)nc1C ZINC000106876549 384937350 /nfs/dbraw/zinc/93/73/50/384937350.db2.gz ABFCFTQMXADUAA-JTQLQIEISA-N 1 1 226.389 3.553 20 0 BHADMO CCCC[N@@H+](C)[C@H](C)c1sc(C)nc1C ZINC000106876552 384935367 /nfs/dbraw/zinc/93/53/67/384935367.db2.gz ABFCFTQMXADUAA-SNVBAGLBSA-N 1 1 226.389 3.553 20 0 BHADMO Cc1nc(C)c([C@@H](C)[N@@H+](C)C/C=C/Cl)s1 ZINC000106936523 384944463 /nfs/dbraw/zinc/94/44/63/384944463.db2.gz DPXBWGPTDUUSJH-VUHVRTRXSA-N 1 1 244.791 3.505 20 0 BHADMO Cc1nc(C)c([C@@H](C)[N@H+](C)C/C=C/Cl)s1 ZINC000106936523 384944460 /nfs/dbraw/zinc/94/44/60/384944460.db2.gz DPXBWGPTDUUSJH-VUHVRTRXSA-N 1 1 244.791 3.505 20 0 BHADMO Cc1nc(C)c([C@H](C)[N@@H+](C)C/C=C/Cl)s1 ZINC000106936524 384944991 /nfs/dbraw/zinc/94/49/91/384944991.db2.gz DPXBWGPTDUUSJH-CYNONHLPSA-N 1 1 244.791 3.505 20 0 BHADMO Cc1nc(C)c([C@H](C)[N@H+](C)C/C=C/Cl)s1 ZINC000106936524 384944985 /nfs/dbraw/zinc/94/49/85/384944985.db2.gz DPXBWGPTDUUSJH-CYNONHLPSA-N 1 1 244.791 3.505 20 0 BHADMO CC(C)n1ccnc1C[N@@H+](C)C1CCCCCC1 ZINC000107298102 385561929 /nfs/dbraw/zinc/56/19/29/385561929.db2.gz UJLBFFXGJWZERI-UHFFFAOYSA-N 1 1 249.402 3.619 20 0 BHADMO Cc1cc(C)cc([C@@H](C)[NH2+]Cc2cscn2)c1 ZINC000107320012 588346871 /nfs/dbraw/zinc/34/68/71/588346871.db2.gz ZHCDYAWWDPCAFO-GFCCVEGCSA-N 1 1 246.379 3.611 20 0 BHADMO Cc1cc(C)cc([C@H](C)[NH2+]Cc2cscn2)c1 ZINC000107320014 588347019 /nfs/dbraw/zinc/34/70/19/588347019.db2.gz ZHCDYAWWDPCAFO-LBPRGKRZSA-N 1 1 246.379 3.611 20 0 BHADMO Cc1cc(C)cc([C@@H](C)[NH2+]Cc2nccs2)c1 ZINC000107320115 384962663 /nfs/dbraw/zinc/96/26/63/384962663.db2.gz WCWZCDYJDIFIMD-GFCCVEGCSA-N 1 1 246.379 3.611 20 0 BHADMO Cc1cc(C)cc([C@H](C)[NH2+]Cc2nccs2)c1 ZINC000107320118 384961573 /nfs/dbraw/zinc/96/15/73/384961573.db2.gz WCWZCDYJDIFIMD-LBPRGKRZSA-N 1 1 246.379 3.611 20 0 BHADMO CC[C@](C)([NH2+]Cc1cscn1)c1ccccc1 ZINC000107718083 588400844 /nfs/dbraw/zinc/40/08/44/588400844.db2.gz HBACDXKTIDXGKO-AWEZNQCLSA-N 1 1 246.379 3.558 20 0 BHADMO CC[C@@](C)([NH2+]Cc1cscn1)c1ccccc1 ZINC000107718087 588400913 /nfs/dbraw/zinc/40/09/13/588400913.db2.gz HBACDXKTIDXGKO-CQSZACIVSA-N 1 1 246.379 3.558 20 0 BHADMO Cc1ccc[nH+]c1NCc1cccc2cccnc21 ZINC000107786905 188345193 /nfs/dbraw/zinc/34/51/93/188345193.db2.gz OHMZEQFCWQWZFI-UHFFFAOYSA-N 1 1 249.317 3.550 20 0 BHADMO Cc1cc[nH+]c(NCc2cccc3cccnc32)c1 ZINC000107789472 385584299 /nfs/dbraw/zinc/58/42/99/385584299.db2.gz PBSFEMRIZGAIFU-UHFFFAOYSA-N 1 1 249.317 3.550 20 0 BHADMO Cc1cccc(NCc2cccc3cccnc32)[nH+]1 ZINC000107789772 179150401 /nfs/dbraw/zinc/15/04/01/179150401.db2.gz VOHYRDTXHRJFCK-UHFFFAOYSA-N 1 1 249.317 3.550 20 0 BHADMO COc1cccc(C[N@@H+](C2CC2)C2CCCC2)c1 ZINC000107791061 385002363 /nfs/dbraw/zinc/00/23/63/385002363.db2.gz OIJSVBRTBWMSLO-UHFFFAOYSA-N 1 1 245.366 3.602 20 0 BHADMO CC[N@@H+](Cc1cc(C)c(O)c(C)c1)C1CCCC1 ZINC000108105901 388014606 /nfs/dbraw/zinc/01/46/06/388014606.db2.gz YNKOTXZKQVMVMA-UHFFFAOYSA-N 1 1 247.382 3.774 20 0 BHADMO C(=C\c1ccccc1)\C[N@H+]1CCc2ccccc2C1 ZINC000108190035 369380127 /nfs/dbraw/zinc/38/01/27/369380127.db2.gz NGTBVPMVXAYHJZ-TWGQIWQCSA-N 1 1 249.357 3.758 20 0 BHADMO Cc1ncc(C[N@H+](C(C)C)C2CCCC2)s1 ZINC000108364660 180138033 /nfs/dbraw/zinc/13/80/33/180138033.db2.gz XLLZEFNMHYJMPW-UHFFFAOYSA-N 1 1 238.400 3.605 20 0 BHADMO CCc1[nH+]ccn1C[C@@H]1CCCc2ccccc21 ZINC000108658121 172025255 /nfs/dbraw/zinc/02/52/55/172025255.db2.gz KADOPSGLUGUZPT-AWEZNQCLSA-N 1 1 240.350 3.566 20 0 BHADMO CCc1[nH+]ccn1C[C@H]1CCCc2ccccc21 ZINC000108658125 172027371 /nfs/dbraw/zinc/02/73/71/172027371.db2.gz KADOPSGLUGUZPT-CQSZACIVSA-N 1 1 240.350 3.566 20 0 BHADMO CCc1[nH+]ccn1Cc1cccc2ccccc21 ZINC000108658235 172027557 /nfs/dbraw/zinc/02/75/57/172027557.db2.gz NMNJAQSPJPVQIS-UHFFFAOYSA-N 1 1 236.318 3.647 20 0 BHADMO CCC[N@@H+](C)Cn1ccc(=S)c2ccccc21 ZINC000109315507 588543457 /nfs/dbraw/zinc/54/34/57/588543457.db2.gz VDZHKKFVSAHPBY-UHFFFAOYSA-N 1 1 246.379 3.670 20 0 BHADMO Cc1cc(C[N@@H+]2CCC[C@@H]2C(C)C)cc(C)c1O ZINC000109477947 384526129 /nfs/dbraw/zinc/52/61/29/384526129.db2.gz UWQUVUNIRXVFSK-OAHLLOKOSA-N 1 1 247.382 3.629 20 0 BHADMO Cc1cc(C[N@@H+]2CCC[C@H]2C(C)C)cc(C)c1O ZINC000109477950 384525839 /nfs/dbraw/zinc/52/58/39/384525839.db2.gz UWQUVUNIRXVFSK-HNNXBMFYSA-N 1 1 247.382 3.629 20 0 BHADMO C[N@@H+](Cc1ccc(F)cc1F)[C@H]1C=CCCC1 ZINC000110929540 323155298 /nfs/dbraw/zinc/15/52/98/323155298.db2.gz SXYIHKCULRHTDB-ZDUSSCGKSA-N 1 1 237.293 3.505 20 0 BHADMO C[N@@H+](Cc1ccc(F)cc1F)[C@@H]1C=CCCC1 ZINC000110929542 323155281 /nfs/dbraw/zinc/15/52/81/323155281.db2.gz SXYIHKCULRHTDB-CYBMUJFWSA-N 1 1 237.293 3.505 20 0 BHADMO C[C@@H](c1ccc(F)cc1)[N@@H+](C)[C@H]1C=CCCC1 ZINC000110938981 323154844 /nfs/dbraw/zinc/15/48/44/323154844.db2.gz LRHCAMNHZDYNDA-WFASDCNBSA-N 1 1 233.330 3.927 20 0 BHADMO C[C@H](c1ccc(F)cc1)[N@@H+](C)[C@H]1C=CCCC1 ZINC000110938984 323154838 /nfs/dbraw/zinc/15/48/38/323154838.db2.gz LRHCAMNHZDYNDA-DOMZBBRYSA-N 1 1 233.330 3.927 20 0 BHADMO c1ccc([C@@H]2CCC[N@H+]2[C@H]2C=CCCC2)cc1 ZINC000111190309 370103804 /nfs/dbraw/zinc/10/38/04/370103804.db2.gz AHUWYSKSRZTDSF-HOTGVXAUSA-N 1 1 227.351 3.932 20 0 BHADMO c1ccc([C@H]2CCC[N@H+]2[C@H]2C=CCCC2)cc1 ZINC000111190311 370104271 /nfs/dbraw/zinc/10/42/71/370104271.db2.gz AHUWYSKSRZTDSF-JKSUJKDBSA-N 1 1 227.351 3.932 20 0 BHADMO C[N@@H+]([C@@H]1CCc2ccccc21)[C@H]1C=CCCC1 ZINC000111190490 370103565 /nfs/dbraw/zinc/10/35/65/370103565.db2.gz JGHAETURACUPES-GOEBONIOSA-N 1 1 227.351 3.714 20 0 BHADMO C[N@@H+]([C@@H]1CCc2ccccc21)[C@@H]1C=CCCC1 ZINC000111190492 370104427 /nfs/dbraw/zinc/10/44/27/370104427.db2.gz JGHAETURACUPES-GDBMZVCRSA-N 1 1 227.351 3.714 20 0 BHADMO Cc1cccc(C[N@H+](C)[C@@H](C)c2ccncc2)c1 ZINC000111205373 179069015 /nfs/dbraw/zinc/06/90/15/179069015.db2.gz CJBXDDOLRJNELT-AWEZNQCLSA-N 1 1 240.350 3.583 20 0 BHADMO Cc1cccc(C[N@H+](C)[C@H](C)c2ccncc2)c1 ZINC000111205374 179069992 /nfs/dbraw/zinc/06/99/92/179069992.db2.gz CJBXDDOLRJNELT-CQSZACIVSA-N 1 1 240.350 3.583 20 0 BHADMO C[C@@H](c1cccc(O)c1)[N@@H+](C)Cc1ccccc1 ZINC000111239270 176019487 /nfs/dbraw/zinc/01/94/87/176019487.db2.gz UCXGVKPIGHYQTM-ZDUSSCGKSA-N 1 1 241.334 3.585 20 0 BHADMO C[C@H](c1cccc(O)c1)[N@@H+](C)Cc1ccccc1 ZINC000111239272 177037476 /nfs/dbraw/zinc/03/74/76/177037476.db2.gz UCXGVKPIGHYQTM-CYBMUJFWSA-N 1 1 241.334 3.585 20 0 BHADMO CC[C@@H](C)C[N@@H+](C)Cc1cccc2cccnc21 ZINC000111253423 385499113 /nfs/dbraw/zinc/49/91/13/385499113.db2.gz VXXSPISSGKNBDM-CYBMUJFWSA-N 1 1 242.366 3.713 20 0 BHADMO CC[C@H](C)C[N@@H+](C)Cc1cccc2cccnc21 ZINC000111253424 171273860 /nfs/dbraw/zinc/27/38/60/171273860.db2.gz VXXSPISSGKNBDM-ZDUSSCGKSA-N 1 1 242.366 3.713 20 0 BHADMO C[C@@H](c1cccc(F)c1)[N@@H+](C)CC1CCC1 ZINC000111295872 176017926 /nfs/dbraw/zinc/01/79/26/176017926.db2.gz WCFPWWJFCXYRAU-NSHDSACASA-N 1 1 221.319 3.619 20 0 BHADMO C[C@H](c1cccc(F)c1)[N@@H+](C)CC1CCC1 ZINC000111295874 177036106 /nfs/dbraw/zinc/03/61/06/177036106.db2.gz WCFPWWJFCXYRAU-LLVKDONJSA-N 1 1 221.319 3.619 20 0 BHADMO C[C@@H](c1ccccc1F)[N@@H+](C)CC1CCC1 ZINC000111295995 176025014 /nfs/dbraw/zinc/02/50/14/176025014.db2.gz SHZONTZPCZFTQD-NSHDSACASA-N 1 1 221.319 3.619 20 0 BHADMO C[C@H](c1ccccc1F)[N@@H+](C)CC1CCC1 ZINC000111295996 177041479 /nfs/dbraw/zinc/04/14/79/177041479.db2.gz SHZONTZPCZFTQD-LLVKDONJSA-N 1 1 221.319 3.619 20 0 BHADMO CC(C)[N@H+]1CC[C@H](c2ccc(Cl)cc2)C1 ZINC000111306645 323158689 /nfs/dbraw/zinc/15/86/89/323158689.db2.gz STQNJBYALHYJAN-LBPRGKRZSA-N 1 1 223.747 3.538 20 0 BHADMO CC(C)[N@H+]1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC000111306647 323158709 /nfs/dbraw/zinc/15/87/09/323158709.db2.gz STQNJBYALHYJAN-GFCCVEGCSA-N 1 1 223.747 3.538 20 0 BHADMO CCCC[N@@H+](C)[C@@H]1CCCc2nc(C)sc21 ZINC000111311572 487773167 /nfs/dbraw/zinc/77/31/67/487773167.db2.gz DCXJVDAGEZEIDA-GFCCVEGCSA-N 1 1 238.400 3.561 20 0 BHADMO CCCC[N@@H+](C)[C@H]1CCCc2nc(C)sc21 ZINC000111311575 487772646 /nfs/dbraw/zinc/77/26/46/487772646.db2.gz DCXJVDAGEZEIDA-LBPRGKRZSA-N 1 1 238.400 3.561 20 0 BHADMO c1ccc(C[N@H+]2CCCC3(CCCCC3)C2)nc1 ZINC000111323408 183397137 /nfs/dbraw/zinc/39/71/37/183397137.db2.gz LWNBOSXTZMFOOR-UHFFFAOYSA-N 1 1 244.382 3.628 20 0 BHADMO Cc1cc(C[N@H+]2CCCC3(CCCCC3)C2)no1 ZINC000111323677 387542297 /nfs/dbraw/zinc/54/22/97/387542297.db2.gz GCFDTLPLKOQWPW-UHFFFAOYSA-N 1 1 248.370 3.529 20 0 BHADMO CCc1[nH+]ccn1Cc1ccc(C(C)(C)C)cc1 ZINC000111550923 323161294 /nfs/dbraw/zinc/16/12/94/323161294.db2.gz RYSLFXRYAGZHRO-UHFFFAOYSA-N 1 1 242.366 3.791 20 0 BHADMO CCCC[C@@H](CC)Cn1cc[nH+]c1CC ZINC000111551071 323161397 /nfs/dbraw/zinc/16/13/97/323161397.db2.gz IPJNRZVJNOWVOY-GFCCVEGCSA-N 1 1 208.349 3.662 20 0 BHADMO CCCC[C@H](CC)Cn1cc[nH+]c1CC ZINC000111551072 323161307 /nfs/dbraw/zinc/16/13/07/323161307.db2.gz IPJNRZVJNOWVOY-LBPRGKRZSA-N 1 1 208.349 3.662 20 0 BHADMO CCCc1nc(C[N@@H+](C)C[C@@H](C)CC)cs1 ZINC000111692228 385981636 /nfs/dbraw/zinc/98/16/36/385981636.db2.gz CZFDHJFISQVOBD-NSHDSACASA-N 1 1 240.416 3.574 20 0 BHADMO CCCc1nc(C[N@@H+](C)C[C@H](C)CC)cs1 ZINC000111692230 385980948 /nfs/dbraw/zinc/98/09/48/385980948.db2.gz CZFDHJFISQVOBD-LLVKDONJSA-N 1 1 240.416 3.574 20 0 BHADMO CC(C)CC[N@@H+](CCC(=O)C(C)(C)C)C1CC1 ZINC000111828980 588771344 /nfs/dbraw/zinc/77/13/44/588771344.db2.gz YKOBPCBKBFJYTG-UHFFFAOYSA-N 1 1 239.403 3.502 20 0 BHADMO CC(C)(C)[C@@H]1CCC[N@@H+](Cc2ccccn2)CC1 ZINC000112635493 188364459 /nfs/dbraw/zinc/36/44/59/188364459.db2.gz KPFVZXBVAFCUKI-CQSZACIVSA-N 1 1 246.398 3.730 20 0 BHADMO CC(C)(C)[C@H]1CCC[N@@H+](Cc2ccccn2)CC1 ZINC000112635494 188187469 /nfs/dbraw/zinc/18/74/69/188187469.db2.gz KPFVZXBVAFCUKI-AWEZNQCLSA-N 1 1 246.398 3.730 20 0 BHADMO Cc1ccc([C@@H]2CSCC[N@@H+]2CC(C)C)cc1 ZINC000112636026 323171345 /nfs/dbraw/zinc/17/13/45/323171345.db2.gz SGFYHZBWHRGQQI-HNNXBMFYSA-N 1 1 249.423 3.741 20 0 BHADMO Cc1ccc([C@H]2CSCC[N@@H+]2CC(C)C)cc1 ZINC000112636028 323171366 /nfs/dbraw/zinc/17/13/66/323171366.db2.gz SGFYHZBWHRGQQI-OAHLLOKOSA-N 1 1 249.423 3.741 20 0 BHADMO CCCCC[N@H+]1C[C@H](c2ccccc2)OC[C@@H]1C ZINC000112646166 370340137 /nfs/dbraw/zinc/34/01/37/370340137.db2.gz ZTXBJDHDJRKDKW-GOEBONIOSA-N 1 1 247.382 3.639 20 0 BHADMO CCCCC[N@H+]1C[C@@H](c2ccccc2)OC[C@@H]1C ZINC000112646169 370340594 /nfs/dbraw/zinc/34/05/94/370340594.db2.gz ZTXBJDHDJRKDKW-HOCLYGCPSA-N 1 1 247.382 3.639 20 0 BHADMO CCCCC[N@@H+]1CC=C(c2ccc(O)cc2)CC1 ZINC000112646301 370340602 /nfs/dbraw/zinc/34/06/02/370340602.db2.gz LASZULSQOKTEAS-UHFFFAOYSA-N 1 1 245.366 3.672 20 0 BHADMO CCCCCC[N@H+]1CCN(C)c2ccccc2C1 ZINC000112679213 588811793 /nfs/dbraw/zinc/81/17/93/588811793.db2.gz SFDPRVNIIGMQBW-UHFFFAOYSA-N 1 1 246.398 3.519 20 0 BHADMO CCCCCC[N@@H+](C)[C@@H](C)c1cccc(O)c1 ZINC000112680040 588811973 /nfs/dbraw/zinc/81/19/73/588811973.db2.gz BPXPLEWDKLHGPC-ZDUSSCGKSA-N 1 1 235.371 3.965 20 0 BHADMO CCCCCC[N@@H+](C)[C@H](C)c1cccc(O)c1 ZINC000112680041 588811826 /nfs/dbraw/zinc/81/18/26/588811826.db2.gz BPXPLEWDKLHGPC-CYBMUJFWSA-N 1 1 235.371 3.965 20 0 BHADMO CC(C)(C)CC[N@H+]1CCC[C@@H]1c1ccc[nH]1 ZINC000112697054 383942308 /nfs/dbraw/zinc/94/23/08/383942308.db2.gz KRZFESBJGZORBT-CYBMUJFWSA-N 1 1 220.360 3.588 20 0 BHADMO CC(C)(C)CC[N@H+]1CCC[C@H]1c1ccc[nH]1 ZINC000112697055 383941632 /nfs/dbraw/zinc/94/16/32/383941632.db2.gz KRZFESBJGZORBT-ZDUSSCGKSA-N 1 1 220.360 3.588 20 0 BHADMO C[C@@H](c1ccco1)[N@@H+](C)CCC(C)(C)C ZINC000112697255 344649886 /nfs/dbraw/zinc/64/98/86/344649886.db2.gz NENRGIYZDUPUGH-NSHDSACASA-N 1 1 209.333 3.709 20 0 BHADMO C[C@H](c1ccco1)[N@@H+](C)CCC(C)(C)C ZINC000112697256 370345295 /nfs/dbraw/zinc/34/52/95/370345295.db2.gz NENRGIYZDUPUGH-LLVKDONJSA-N 1 1 209.333 3.709 20 0 BHADMO CCCO[C@@H]1CCC[N@@H+](CCC(C)(C)C)CC1 ZINC000112698058 169310730 /nfs/dbraw/zinc/31/07/30/169310730.db2.gz MHDXIMJXPBAWPF-CQSZACIVSA-N 1 1 241.419 3.704 20 0 BHADMO CCCO[C@H]1CCC[N@@H+](CCC(C)(C)C)CC1 ZINC000112698059 169311568 /nfs/dbraw/zinc/31/15/68/169311568.db2.gz MHDXIMJXPBAWPF-AWEZNQCLSA-N 1 1 241.419 3.704 20 0 BHADMO CC(C)=CC[N@H+](Cc1cccc(O)c1)CC1CC1 ZINC000112978670 323172594 /nfs/dbraw/zinc/17/25/94/323172594.db2.gz JJEVHRFZQJBSKJ-UHFFFAOYSA-N 1 1 245.366 3.570 20 0 BHADMO Cc1[nH+]cn(Cc2ccc(CC(C)C)cc2)c1C ZINC000112980650 588822125 /nfs/dbraw/zinc/82/21/25/588822125.db2.gz JUELZRIEQKISTK-UHFFFAOYSA-N 1 1 242.366 3.747 20 0 BHADMO Cc1ccc(C[N@H+]2CCCC(C)(C)C2)cc1 ZINC000113071970 353150667 /nfs/dbraw/zinc/15/06/67/353150667.db2.gz SSLWKGZUDNAZCE-UHFFFAOYSA-N 1 1 217.356 3.617 20 0 BHADMO C[C@@H](c1cccc(O)c1)[N@@H+](C)CC1CCCCC1 ZINC000113750592 323191629 /nfs/dbraw/zinc/19/16/29/323191629.db2.gz QTNGYWBJKOBOFD-ZDUSSCGKSA-N 1 1 247.382 3.965 20 0 BHADMO C[C@H](c1cccc(O)c1)[N@@H+](C)CC1CCCCC1 ZINC000113750595 323191780 /nfs/dbraw/zinc/19/17/80/323191780.db2.gz QTNGYWBJKOBOFD-CYBMUJFWSA-N 1 1 247.382 3.965 20 0 BHADMO Cc1cccc(N2CCC[C@@H]2c2cccs2)[nH+]1 ZINC000114183654 179121407 /nfs/dbraw/zinc/12/14/07/179121407.db2.gz PKLVMORURNHIBM-GFCCVEGCSA-N 1 1 244.363 3.793 20 0 BHADMO Cc1cccc(N2CCC[C@H]2c2cccs2)[nH+]1 ZINC000114183656 179121415 /nfs/dbraw/zinc/12/14/15/179121415.db2.gz PKLVMORURNHIBM-LBPRGKRZSA-N 1 1 244.363 3.793 20 0 BHADMO Cc1cc(C[NH2+]Cc2ccccc2Cl)c(C)o1 ZINC000114505275 588874850 /nfs/dbraw/zinc/87/48/50/588874850.db2.gz KLYKBMYQKCITQB-UHFFFAOYSA-N 1 1 249.741 3.840 20 0 BHADMO CCCC[N@@H+](CC)Cc1ccc(C)s1 ZINC000114630647 344692100 /nfs/dbraw/zinc/69/21/00/344692100.db2.gz HOWSWYHAOLNKNT-UHFFFAOYSA-N 1 1 211.374 3.679 20 0 BHADMO Cc1ccc([C@@H]2CCC[N@@H+]2CC(C)C)s1 ZINC000114733542 323195935 /nfs/dbraw/zinc/19/59/35/323195935.db2.gz ADXUEYOUFRNHQK-LBPRGKRZSA-N 1 1 223.385 3.849 20 0 BHADMO Cc1ccc([C@H]2CCC[N@@H+]2CC(C)C)s1 ZINC000114733544 323195901 /nfs/dbraw/zinc/19/59/01/323195901.db2.gz ADXUEYOUFRNHQK-GFCCVEGCSA-N 1 1 223.385 3.849 20 0 BHADMO Cc1ccc([C@@H]2CCC[N@@H+]2C(C)C)s1 ZINC000114733589 387081261 /nfs/dbraw/zinc/08/12/61/387081261.db2.gz KLIANRVYVFWYJT-NSHDSACASA-N 1 1 209.358 3.602 20 0 BHADMO Cc1ccc([C@H]2CCC[N@@H+]2C(C)C)s1 ZINC000114733591 387081236 /nfs/dbraw/zinc/08/12/36/387081236.db2.gz KLIANRVYVFWYJT-LLVKDONJSA-N 1 1 209.358 3.602 20 0 BHADMO Cc1c2ccccc2oc1C[NH2+]Cc1ccco1 ZINC000115620439 387731631 /nfs/dbraw/zinc/73/16/31/387731631.db2.gz RBIVNPOKUUSOSW-UHFFFAOYSA-N 1 1 241.290 3.624 20 0 BHADMO C[C@@H]1C[C@H](c2ccccc2)C[N@H+]1C/C=C/Cl ZINC000115739565 588925252 /nfs/dbraw/zinc/92/52/52/588925252.db2.gz FHRFWQOXYLEVQE-MZMNXDGSSA-N 1 1 235.758 3.617 20 0 BHADMO C[C@@H]1C[C@@H](c2ccccc2)C[N@H+]1C/C=C/Cl ZINC000115739570 588925367 /nfs/dbraw/zinc/92/53/67/588925367.db2.gz FHRFWQOXYLEVQE-VMIDCOPPSA-N 1 1 235.758 3.617 20 0 BHADMO C[C@@H](C[N@@H+](C)Cc1ccco1)c1ccccc1 ZINC000116876650 388072230 /nfs/dbraw/zinc/07/22/30/388072230.db2.gz LUCPYTHYHJRDAM-ZDUSSCGKSA-N 1 1 229.323 3.515 20 0 BHADMO C[C@H](C[N@@H+](C)Cc1ccco1)c1ccccc1 ZINC000116876652 388071654 /nfs/dbraw/zinc/07/16/54/388071654.db2.gz LUCPYTHYHJRDAM-CYBMUJFWSA-N 1 1 229.323 3.515 20 0 BHADMO C[C@@H](C[N@@H+](C)[C@@H](C)C1CC1)c1ccccc1 ZINC000116877847 344737404 /nfs/dbraw/zinc/73/74/04/344737404.db2.gz ICCJMIPMVWFQAM-STQMWFEESA-N 1 1 217.356 3.520 20 0 BHADMO C[C@H](C[N@@H+](C)[C@@H](C)C1CC1)c1ccccc1 ZINC000116877849 344737388 /nfs/dbraw/zinc/73/73/88/344737388.db2.gz ICCJMIPMVWFQAM-OLZOCXBDSA-N 1 1 217.356 3.520 20 0 BHADMO CC[N@@H+](C[C@@H](C)c1ccccc1)C(C)C ZINC000116878151 388072652 /nfs/dbraw/zinc/07/26/52/388072652.db2.gz VTUCGNGLZNJQBV-CYBMUJFWSA-N 1 1 205.345 3.520 20 0 BHADMO CC[N@@H+](C[C@H](C)c1ccccc1)C(C)C ZINC000116878152 388072542 /nfs/dbraw/zinc/07/25/42/388072542.db2.gz VTUCGNGLZNJQBV-ZDUSSCGKSA-N 1 1 205.345 3.520 20 0 BHADMO COCCCCC[N@@H+](C(C)C)C1CCCCC1 ZINC000116878276 388072360 /nfs/dbraw/zinc/07/23/60/388072360.db2.gz QTVPIIDVADTAGA-UHFFFAOYSA-N 1 1 241.419 3.846 20 0 BHADMO Cc1ccc(F)c(C[NH2+]Cc2ccccc2F)c1 ZINC000116912177 388073782 /nfs/dbraw/zinc/07/37/82/388073782.db2.gz QBWWEUROGCNGIN-UHFFFAOYSA-N 1 1 247.288 3.563 20 0 BHADMO CC[C@@H](C)[N@@H+](CCCCOC)Cc1ccccc1 ZINC000117871095 387030530 /nfs/dbraw/zinc/03/05/30/387030530.db2.gz QQMZGZTVTHZUJE-OAHLLOKOSA-N 1 1 249.398 3.714 20 0 BHADMO CC[C@H](C)[N@@H+](CCCCOC)Cc1ccccc1 ZINC000117871098 171313958 /nfs/dbraw/zinc/31/39/58/171313958.db2.gz QQMZGZTVTHZUJE-HNNXBMFYSA-N 1 1 249.398 3.714 20 0 BHADMO COCCCC[N@@H+](C)[C@H](C)c1cc(C)ccc1C ZINC000117875215 388092580 /nfs/dbraw/zinc/09/25/80/388092580.db2.gz KIEAQQGSUVVVPH-OAHLLOKOSA-N 1 1 249.398 3.723 20 0 BHADMO COCCCC[N@@H+](C)[C@@H](C)c1cc(C)ccc1C ZINC000117875218 388092358 /nfs/dbraw/zinc/09/23/58/388092358.db2.gz KIEAQQGSUVVVPH-HNNXBMFYSA-N 1 1 249.398 3.723 20 0 BHADMO CCCCC[N@H+]1CCC[C@H](c2nccs2)C1 ZINC000117876246 387031690 /nfs/dbraw/zinc/03/16/90/387031690.db2.gz FIDNRQHJSKBAIX-LBPRGKRZSA-N 1 1 238.400 3.513 20 0 BHADMO CCCCC[N@H+]1CCC[C@@H](c2nccs2)C1 ZINC000117876249 387030396 /nfs/dbraw/zinc/03/03/96/387030396.db2.gz FIDNRQHJSKBAIX-GFCCVEGCSA-N 1 1 238.400 3.513 20 0 BHADMO CCCCC[N@@H+](C)[C@@H](C)c1sc(C)nc1C ZINC000117881164 386033064 /nfs/dbraw/zinc/03/30/64/386033064.db2.gz KYVGVKYRSVYUJK-NSHDSACASA-N 1 1 240.416 3.943 20 0 BHADMO CCCCC[N@@H+](C)[C@H](C)c1sc(C)nc1C ZINC000117881167 386033085 /nfs/dbraw/zinc/03/30/85/386033085.db2.gz KYVGVKYRSVYUJK-LLVKDONJSA-N 1 1 240.416 3.943 20 0 BHADMO COCCCC[N@@H+](C)[C@H](c1ccccc1)C(C)C ZINC000117883191 388091972 /nfs/dbraw/zinc/09/19/72/388091972.db2.gz MYSSIBLHKUIDDG-INIZCTEOSA-N 1 1 249.398 3.742 20 0 BHADMO COCCCC[N@@H+](C)[C@@H](c1ccccc1)C(C)C ZINC000117883193 388092283 /nfs/dbraw/zinc/09/22/83/388092283.db2.gz MYSSIBLHKUIDDG-MRXNPFEDSA-N 1 1 249.398 3.742 20 0 BHADMO Clc1cccc(C[NH+]2CCCC2)c1Cl ZINC000118046038 387038986 /nfs/dbraw/zinc/03/89/86/387038986.db2.gz OFRAAOZARGRLFX-UHFFFAOYSA-N 1 1 230.138 3.589 20 0 BHADMO Cc1cccc([C@@H](C)[N@@H+](C)Cc2cccnc2)c1 ZINC000119042854 179178837 /nfs/dbraw/zinc/17/88/37/179178837.db2.gz KPIFBTSSDABEHS-CQSZACIVSA-N 1 1 240.350 3.583 20 0 BHADMO Cc1cccc([C@H](C)[N@@H+](C)Cc2cccnc2)c1 ZINC000119042928 179193123 /nfs/dbraw/zinc/19/31/23/179193123.db2.gz KPIFBTSSDABEHS-AWEZNQCLSA-N 1 1 240.350 3.583 20 0 BHADMO C[C@@H](c1ccco1)[N@@H+](CC1CCC1)C1CC1 ZINC000119112451 388104581 /nfs/dbraw/zinc/10/45/81/388104581.db2.gz BDIFBXXHXQLACT-NSHDSACASA-N 1 1 219.328 3.605 20 0 BHADMO C[C@H](c1ccco1)[N@@H+](CC1CCC1)C1CC1 ZINC000119112563 388104762 /nfs/dbraw/zinc/10/47/62/388104762.db2.gz BDIFBXXHXQLACT-LLVKDONJSA-N 1 1 219.328 3.605 20 0 BHADMO CSCCC[N@@H+]([C@@H](C)c1ccco1)C1CC1 ZINC000119132797 384238088 /nfs/dbraw/zinc/23/80/88/384238088.db2.gz MCSMBYKEDGYNAP-NSHDSACASA-N 1 1 239.384 3.558 20 0 BHADMO CSCCC[N@@H+]([C@H](C)c1ccco1)C1CC1 ZINC000119132930 384238369 /nfs/dbraw/zinc/23/83/69/384238369.db2.gz MCSMBYKEDGYNAP-LLVKDONJSA-N 1 1 239.384 3.558 20 0 BHADMO CCCC[N@@H+]([C@@H](C)c1ccco1)C1CC1 ZINC000119182183 388106605 /nfs/dbraw/zinc/10/66/05/388106605.db2.gz OXKVBPXROIAPGN-NSHDSACASA-N 1 1 207.317 3.605 20 0 BHADMO CCCC[N@@H+]([C@H](C)c1ccco1)C1CC1 ZINC000119182290 388106986 /nfs/dbraw/zinc/10/69/86/388106986.db2.gz OXKVBPXROIAPGN-LLVKDONJSA-N 1 1 207.317 3.605 20 0 BHADMO CCSCC[N@@H+]([C@@H](C)c1ccco1)C1CC1 ZINC000119183481 384244898 /nfs/dbraw/zinc/24/48/98/384244898.db2.gz WLQHGYLWVHCENL-NSHDSACASA-N 1 1 239.384 3.558 20 0 BHADMO CCSCC[N@@H+]([C@H](C)c1ccco1)C1CC1 ZINC000119183619 384245143 /nfs/dbraw/zinc/24/51/43/384245143.db2.gz WLQHGYLWVHCENL-LLVKDONJSA-N 1 1 239.384 3.558 20 0 BHADMO CC(C)=CC[N@H+]([C@@H](C)c1ccco1)C1CC1 ZINC000119236777 388112241 /nfs/dbraw/zinc/11/22/41/388112241.db2.gz CUCNMBYBRZBCOF-LBPRGKRZSA-N 1 1 219.328 3.771 20 0 BHADMO CC(C)=CC[N@H+]([C@H](C)c1ccco1)C1CC1 ZINC000119236867 388112166 /nfs/dbraw/zinc/11/21/66/388112166.db2.gz CUCNMBYBRZBCOF-GFCCVEGCSA-N 1 1 219.328 3.771 20 0 BHADMO C[C@@H](c1ccc(Cl)cc1)[N@@H+](C)CCCF ZINC000119268747 176014248 /nfs/dbraw/zinc/01/42/48/176014248.db2.gz JAQCURQJCOCIDJ-JTQLQIEISA-N 1 1 229.726 3.692 20 0 BHADMO C[C@H](c1ccc(Cl)cc1)[N@@H+](C)CCCF ZINC000119268910 177033466 /nfs/dbraw/zinc/03/34/66/177033466.db2.gz JAQCURQJCOCIDJ-SNVBAGLBSA-N 1 1 229.726 3.692 20 0 BHADMO CC(C)C[C@@H]1CCC[N@H+]([C@@H](C)c2ccccn2)C1 ZINC000119352204 388112827 /nfs/dbraw/zinc/11/28/27/388112827.db2.gz LNXWJOIKWKZYTA-GJZGRUSLSA-N 1 1 246.398 3.901 20 0 BHADMO CC(C)C[C@H]1CCC[N@H+]([C@@H](C)c2ccccn2)C1 ZINC000119352328 388113328 /nfs/dbraw/zinc/11/33/28/388113328.db2.gz LNXWJOIKWKZYTA-LSDHHAIUSA-N 1 1 246.398 3.901 20 0 BHADMO Cc1ccoc1C[N@H+](C)[C@@H](C)c1ccccc1 ZINC000119379167 387125332 /nfs/dbraw/zinc/12/53/32/387125332.db2.gz DXVKBGJSIJXWLH-ZDUSSCGKSA-N 1 1 229.323 3.781 20 0 BHADMO Cc1ccoc1C[N@H+](C)[C@H](C)c1ccccc1 ZINC000119379315 387124458 /nfs/dbraw/zinc/12/44/58/387124458.db2.gz DXVKBGJSIJXWLH-CYBMUJFWSA-N 1 1 229.323 3.781 20 0 BHADMO Cc1ccsc1C[N@H+](C)CC(C)(C)C ZINC000119438446 387134843 /nfs/dbraw/zinc/13/48/43/387134843.db2.gz KGZJMCHKUZRPKL-UHFFFAOYSA-N 1 1 211.374 3.534 20 0 BHADMO CC[N@@H+](Cc1nc(C(C)(C)C)cs1)C(C)C ZINC000119562122 387139715 /nfs/dbraw/zinc/13/97/15/387139715.db2.gz IIEHJFKLWCIRKN-UHFFFAOYSA-N 1 1 240.416 3.671 20 0 BHADMO CC(C)[N@@H+](CCc1cccs1)C1CCC1 ZINC000119700840 589324685 /nfs/dbraw/zinc/32/46/85/589324685.db2.gz HIYQDRYGZGADKC-UHFFFAOYSA-N 1 1 223.385 3.554 20 0 BHADMO CC(C)[N@@H+](Cc1ccc(F)cc1)C1CCC1 ZINC000119716630 385150514 /nfs/dbraw/zinc/15/05/14/385150514.db2.gz LRCPPTZTKNBODX-UHFFFAOYSA-N 1 1 221.319 3.589 20 0 BHADMO CCC(CC)C[N@@H+](CC)Cc1cccnc1C ZINC000119804659 168350022 /nfs/dbraw/zinc/35/00/22/168350022.db2.gz LEHPJPLRBJRVIW-UHFFFAOYSA-N 1 1 234.387 3.648 20 0 BHADMO CCC(CC)C[N@@H+](CC)Cc1scnc1C ZINC000119805079 387147306 /nfs/dbraw/zinc/14/73/06/387147306.db2.gz OCKYYAHPPSAWET-UHFFFAOYSA-N 1 1 240.416 3.710 20 0 BHADMO CC[N@@H+](Cc1cccs1)Cc1occc1C ZINC000119999121 353693683 /nfs/dbraw/zinc/69/36/83/353693683.db2.gz BNNXWEMGUJCFSF-UHFFFAOYSA-N 1 1 235.352 3.672 20 0 BHADMO FCCC[N@@H+](Cc1ccco1)Cc1ccccc1 ZINC000120059165 387153910 /nfs/dbraw/zinc/15/39/10/387153910.db2.gz KXYUAOVPGFUWBK-UHFFFAOYSA-N 1 1 247.313 3.641 20 0 BHADMO C[N@@H+](Cc1ccsc1)C1CCCCC1 ZINC000120078814 387157775 /nfs/dbraw/zinc/15/77/75/387157775.db2.gz RCBCNGURQAKLFD-UHFFFAOYSA-N 1 1 209.358 3.513 20 0 BHADMO COc1ccc(C[N@@H+](C2CC2)C2CCCC2)cc1 ZINC000120079008 387175396 /nfs/dbraw/zinc/17/53/96/387175396.db2.gz XWOHTNGGGSXQSX-UHFFFAOYSA-N 1 1 245.366 3.602 20 0 BHADMO c1csc(C[N@@H+](C2CC2)C2CCCC2)c1 ZINC000120081751 387176811 /nfs/dbraw/zinc/17/68/11/387176811.db2.gz KCBGBRZBKMVOTM-UHFFFAOYSA-N 1 1 221.369 3.655 20 0 BHADMO COc1ccccc1C[N@@H+](C1CC1)C1CCCC1 ZINC000120083897 387179489 /nfs/dbraw/zinc/17/94/89/387179489.db2.gz FNLGRIMLDIPMBY-UHFFFAOYSA-N 1 1 245.366 3.602 20 0 BHADMO Oc1cccc(C[N@@H+](CC2CC2)C2CCCC2)c1 ZINC000120085259 343107214 /nfs/dbraw/zinc/10/72/14/343107214.db2.gz VDZIQZUKNALVFE-UHFFFAOYSA-N 1 1 245.366 3.547 20 0 BHADMO CC[N@@H+](Cc1nccs1)[C@@H]1CCCC[C@@H]1C ZINC000120087979 387178303 /nfs/dbraw/zinc/17/83/03/387178303.db2.gz OMFJGNDIVKJWHF-NWDGAFQWSA-N 1 1 238.400 3.544 20 0 BHADMO CC[N@@H+](Cc1nccs1)[C@H]1CCCC[C@@H]1C ZINC000120088132 387178636 /nfs/dbraw/zinc/17/86/36/387178636.db2.gz OMFJGNDIVKJWHF-RYUDHWBXSA-N 1 1 238.400 3.544 20 0 BHADMO C[C@@H]1C[N@H+](C2CCCC2)[C@@H]1c1ccccc1 ZINC000120107606 387173107 /nfs/dbraw/zinc/17/31/07/387173107.db2.gz ZYUQZPIGHGTGMU-DOMZBBRYSA-N 1 1 215.340 3.622 20 0 BHADMO C[C@H]1C[N@H+](C2CCCC2)[C@@H]1c1ccccc1 ZINC000120107731 387173736 /nfs/dbraw/zinc/17/37/36/387173736.db2.gz ZYUQZPIGHGTGMU-WFASDCNBSA-N 1 1 215.340 3.622 20 0 BHADMO CC[N@@H+](CCCCCOC)[C@@H]1CCCC[C@@H]1C ZINC000120120404 387174335 /nfs/dbraw/zinc/17/43/35/387174335.db2.gz XOPRIIQESSBCOQ-LSDHHAIUSA-N 1 1 241.419 3.704 20 0 BHADMO CC[N@@H+](CCCCCOC)[C@H]1CCCC[C@@H]1C ZINC000120120565 387173320 /nfs/dbraw/zinc/17/33/20/387173320.db2.gz XOPRIIQESSBCOQ-GJZGRUSLSA-N 1 1 241.419 3.704 20 0 BHADMO c1csc([C@@H]2CCC[N@@H+]2C2CCCC2)c1 ZINC000120124645 384329521 /nfs/dbraw/zinc/32/95/21/384329521.db2.gz ITOIDDVRMDEHPY-LBPRGKRZSA-N 1 1 221.369 3.828 20 0 BHADMO c1csc([C@H]2CCC[N@@H+]2C2CCCC2)c1 ZINC000120124810 384329155 /nfs/dbraw/zinc/32/91/55/384329155.db2.gz ITOIDDVRMDEHPY-GFCCVEGCSA-N 1 1 221.369 3.828 20 0 BHADMO c1cc([C@@H]2CCC[N@@H+]2C2CCCC2)cs1 ZINC000120130477 183360662 /nfs/dbraw/zinc/36/06/62/183360662.db2.gz LTSYDVKOCAGVHA-ZDUSSCGKSA-N 1 1 221.369 3.828 20 0 BHADMO c1cc([C@H]2CCC[N@@H+]2C2CCCC2)cs1 ZINC000120130632 384328610 /nfs/dbraw/zinc/32/86/10/384328610.db2.gz LTSYDVKOCAGVHA-CYBMUJFWSA-N 1 1 221.369 3.828 20 0 BHADMO C[C@@H](c1ccco1)[N@@H+](C1CC1)C1CCCC1 ZINC000120132197 343110000 /nfs/dbraw/zinc/11/00/00/343110000.db2.gz LUPCFFAPYUXKCB-NSHDSACASA-N 1 1 219.328 3.748 20 0 BHADMO C[C@H](c1ccco1)[N@@H+](C1CC1)C1CCCC1 ZINC000120132344 343109957 /nfs/dbraw/zinc/10/99/57/343109957.db2.gz LUPCFFAPYUXKCB-LLVKDONJSA-N 1 1 219.328 3.748 20 0 BHADMO COc1ccccc1[C@@H]1CCC[N@H+]1C1CCCC1 ZINC000120136881 343109945 /nfs/dbraw/zinc/10/99/45/343109945.db2.gz PWLQXCYYFOXHLG-HNNXBMFYSA-N 1 1 245.366 3.775 20 0 BHADMO COc1ccccc1[C@H]1CCC[N@H+]1C1CCCC1 ZINC000120137034 343109936 /nfs/dbraw/zinc/10/99/36/343109936.db2.gz PWLQXCYYFOXHLG-OAHLLOKOSA-N 1 1 245.366 3.775 20 0 BHADMO Cc1nc(C)c([C@@H](C)[N@@H+](C)C2CCCC2)s1 ZINC000120139084 343109716 /nfs/dbraw/zinc/10/97/16/343109716.db2.gz UAMJDHHNAVXKKR-SNVBAGLBSA-N 1 1 238.400 3.695 20 0 BHADMO Cc1nc(C)c([C@H](C)[N@@H+](C)C2CCCC2)s1 ZINC000120139252 343109969 /nfs/dbraw/zinc/10/99/69/343109969.db2.gz UAMJDHHNAVXKKR-JTQLQIEISA-N 1 1 238.400 3.695 20 0 BHADMO c1csc([C@@H]2CCCC[N@@H+]2C2CCCC2)n1 ZINC000120157265 387190910 /nfs/dbraw/zinc/19/09/10/387190910.db2.gz KEYVJLYOEIFQQW-LBPRGKRZSA-N 1 1 236.384 3.613 20 0 BHADMO c1csc([C@H]2CCCC[N@@H+]2C2CCCC2)n1 ZINC000120157385 387191484 /nfs/dbraw/zinc/19/14/84/387191484.db2.gz KEYVJLYOEIFQQW-GFCCVEGCSA-N 1 1 236.384 3.613 20 0 BHADMO CC(C)C[N@H+]1CCCCC[C@@H]1c1ccncc1 ZINC000120170942 357037615 /nfs/dbraw/zinc/03/76/15/357037615.db2.gz VHCNUHPMNGCQQC-OAHLLOKOSA-N 1 1 232.371 3.655 20 0 BHADMO CC(C)C[N@H+]1CCCCC[C@H]1c1ccncc1 ZINC000120171131 357037815 /nfs/dbraw/zinc/03/78/15/357037815.db2.gz VHCNUHPMNGCQQC-HNNXBMFYSA-N 1 1 232.371 3.655 20 0 BHADMO C[N@H+](Cc1cscn1)CC1CCCCCC1 ZINC000120258861 387179441 /nfs/dbraw/zinc/17/94/41/387179441.db2.gz LBCRFJHBPXJXKS-UHFFFAOYSA-N 1 1 238.400 3.545 20 0 BHADMO CCCCC[N@@H+](Cc1cncnc1)[C@@H](C)CCC ZINC000120283253 490059754 /nfs/dbraw/zinc/05/97/54/490059754.db2.gz VZTRLCWJVRCEIV-AWEZNQCLSA-N 1 1 249.402 3.657 20 0 BHADMO CCCCC[N@@H+](Cc1cncnc1)[C@H](C)CCC ZINC000120283457 490059598 /nfs/dbraw/zinc/05/95/98/490059598.db2.gz VZTRLCWJVRCEIV-CQSZACIVSA-N 1 1 249.402 3.657 20 0 BHADMO CCCC[N@@H+](CC)Cc1csc(C2CC2)n1 ZINC000120391090 387234462 /nfs/dbraw/zinc/23/44/62/387234462.db2.gz ILCIYSZYEYGAMA-UHFFFAOYSA-N 1 1 238.400 3.643 20 0 BHADMO CCCCC[N@@H+](Cc1csc(C)n1)C(C)C ZINC000120446067 387247215 /nfs/dbraw/zinc/24/72/15/387247215.db2.gz JZLNIEPLONWUND-UHFFFAOYSA-N 1 1 240.416 3.852 20 0 BHADMO C[N@H+](Cc1ccsc1)C[C@H]1CC=CCC1 ZINC000120453577 387247452 /nfs/dbraw/zinc/24/74/52/387247452.db2.gz NQEBCTAUAZJDPV-LBPRGKRZSA-N 1 1 221.369 3.536 20 0 BHADMO C[N@H+](Cc1ccsc1)C[C@@H]1CC=CCC1 ZINC000120453735 387247098 /nfs/dbraw/zinc/24/70/98/387247098.db2.gz NQEBCTAUAZJDPV-GFCCVEGCSA-N 1 1 221.369 3.536 20 0 BHADMO Cc1ccc(C[N@H+](C)Cc2ccsc2)s1 ZINC000120461904 387248225 /nfs/dbraw/zinc/24/82/25/387248225.db2.gz RDJMNEMRBDFIAE-UHFFFAOYSA-N 1 1 237.393 3.750 20 0 BHADMO CCc1ccc(C[N@@H+](C)Cc2ccsc2)o1 ZINC000120470325 490062380 /nfs/dbraw/zinc/06/23/80/490062380.db2.gz FWHGLRDIWMRBGP-UHFFFAOYSA-N 1 1 235.352 3.536 20 0 BHADMO CCc1ccc(C[N@H+](C)Cc2ccsc2)o1 ZINC000120470325 490062376 /nfs/dbraw/zinc/06/23/76/490062376.db2.gz FWHGLRDIWMRBGP-UHFFFAOYSA-N 1 1 235.352 3.536 20 0 BHADMO Cc1cc(F)ccc1C[N@@H+](C)Cc1ccsc1 ZINC000120475287 178085945 /nfs/dbraw/zinc/08/59/45/178085945.db2.gz BJSLQJQYALMQHB-UHFFFAOYSA-N 1 1 249.354 3.828 20 0 BHADMO Cc1cc(C[N@@H+](C)Cc2ccsc2)c(C)o1 ZINC000120478263 589417415 /nfs/dbraw/zinc/41/74/15/589417415.db2.gz MMUTVLPAQBVAOE-UHFFFAOYSA-N 1 1 235.352 3.590 20 0 BHADMO Cc1cc(C[N@H+](C)Cc2ccsc2)c(C)o1 ZINC000120478263 589417414 /nfs/dbraw/zinc/41/74/14/589417414.db2.gz MMUTVLPAQBVAOE-UHFFFAOYSA-N 1 1 235.352 3.590 20 0 BHADMO Cc1[nH+]ccn1CCSc1ccc(C)c(C)c1 ZINC000120495458 387250146 /nfs/dbraw/zinc/25/01/46/387250146.db2.gz YVAVHHCEGDZTDE-UHFFFAOYSA-N 1 1 246.379 3.601 20 0 BHADMO CC(C)c1nc([C@@H](C)[NH2+]C/C=C/Cl)cs1 ZINC000120585431 589440557 /nfs/dbraw/zinc/44/05/57/589440557.db2.gz CIUMJJSJFJIWTB-XNPJLODASA-N 1 1 244.791 3.670 20 0 BHADMO CC(C)c1nc([C@H](C)[NH2+]C/C=C/Cl)cs1 ZINC000120585567 589440500 /nfs/dbraw/zinc/44/05/00/589440500.db2.gz CIUMJJSJFJIWTB-MOVJSRMASA-N 1 1 244.791 3.670 20 0 BHADMO CC(C)=CC[NH2+][C@H](C)c1csc(C(C)C)n1 ZINC000120611476 385390257 /nfs/dbraw/zinc/39/02/57/385390257.db2.gz DKWHTKMQASHXSW-LLVKDONJSA-N 1 1 238.400 3.883 20 0 BHADMO CC(C)=CC[NH2+][C@@H](C)c1csc(C(C)C)n1 ZINC000120611642 385390448 /nfs/dbraw/zinc/39/04/48/385390448.db2.gz DKWHTKMQASHXSW-NSHDSACASA-N 1 1 238.400 3.883 20 0 BHADMO Cc1nc(C[N@H+](C(C)C)C2CCCC2)cs1 ZINC000120649029 387260071 /nfs/dbraw/zinc/26/00/71/387260071.db2.gz DETGBHHLHWXIJF-UHFFFAOYSA-N 1 1 238.400 3.605 20 0 BHADMO CC[C@@H]1CCCC[C@@H]1[N@@H+](C)Cc1nccs1 ZINC000120781741 343134456 /nfs/dbraw/zinc/13/44/56/343134456.db2.gz JCWFPFHYILUYMM-NEPJUHHUSA-N 1 1 238.400 3.544 20 0 BHADMO CC[C@H]1CCCC[C@@H]1[N@@H+](C)Cc1nccs1 ZINC000120781884 343134408 /nfs/dbraw/zinc/13/44/08/343134408.db2.gz JCWFPFHYILUYMM-RYUDHWBXSA-N 1 1 238.400 3.544 20 0 BHADMO CC[C@@H]1CCCC[C@H]1[N@@H+](C)Cc1nccs1 ZINC000120782002 344901549 /nfs/dbraw/zinc/90/15/49/344901549.db2.gz JCWFPFHYILUYMM-VXGBXAGGSA-N 1 1 238.400 3.544 20 0 BHADMO CC[C@H]1CCCC[C@H]1[N@@H+](C)Cc1nccs1 ZINC000120782180 343133394 /nfs/dbraw/zinc/13/33/94/343133394.db2.gz JCWFPFHYILUYMM-NWDGAFQWSA-N 1 1 238.400 3.544 20 0 BHADMO Cc1ccc(C[N@H+](C(C)C)C2CCC2)s1 ZINC000120819782 387276068 /nfs/dbraw/zinc/27/60/68/387276068.db2.gz MSWYEVWRMKVFKD-UHFFFAOYSA-N 1 1 223.385 3.819 20 0 BHADMO CC[N@@H+](CCCF)Cc1ccccc1Cl ZINC000120820630 387275871 /nfs/dbraw/zinc/27/58/71/387275871.db2.gz SCGGBAGERYXDMN-UHFFFAOYSA-N 1 1 229.726 3.522 20 0 BHADMO CCC(CC)C[N@@H+](CC)Cc1csc(C)n1 ZINC000120832418 168350627 /nfs/dbraw/zinc/35/06/27/168350627.db2.gz JALGHUIKCROLIM-UHFFFAOYSA-N 1 1 240.416 3.710 20 0 BHADMO CC[C@@H]1CCCC[C@@H]1[N@@H+](C)CCCCCOC ZINC000120840143 387198519 /nfs/dbraw/zinc/19/85/19/387198519.db2.gz AUVSMFSUWFHCIA-CABCVRRESA-N 1 1 241.419 3.704 20 0 BHADMO CC[C@H]1CCCC[C@@H]1[N@@H+](C)CCCCCOC ZINC000120840304 387200039 /nfs/dbraw/zinc/20/00/39/387200039.db2.gz AUVSMFSUWFHCIA-GJZGRUSLSA-N 1 1 241.419 3.704 20 0 BHADMO CC[C@@H]1CCCC[C@H]1[N@@H+](C)CCCCCOC ZINC000120840512 387198355 /nfs/dbraw/zinc/19/83/55/387198355.db2.gz AUVSMFSUWFHCIA-HUUCEWRRSA-N 1 1 241.419 3.704 20 0 BHADMO CC[C@H]1CCCC[C@H]1[N@@H+](C)CCCCCOC ZINC000120840650 387199610 /nfs/dbraw/zinc/19/96/10/387199610.db2.gz AUVSMFSUWFHCIA-LSDHHAIUSA-N 1 1 241.419 3.704 20 0 BHADMO C[C@@H](C1CC1)[N@@H+](CCc1cccs1)C1CC1 ZINC000120951540 589479236 /nfs/dbraw/zinc/47/92/36/589479236.db2.gz OKUCEOZVSOZNMP-NSHDSACASA-N 1 1 235.396 3.554 20 0 BHADMO C[C@H](C1CC1)[N@@H+](CCc1cccs1)C1CC1 ZINC000120951693 589479168 /nfs/dbraw/zinc/47/91/68/589479168.db2.gz OKUCEOZVSOZNMP-LLVKDONJSA-N 1 1 235.396 3.554 20 0 BHADMO CCC[C@@H]1CCC[N@H+]([C@@H](C)c2ccccn2)C1 ZINC000120993450 387286522 /nfs/dbraw/zinc/28/65/22/387286522.db2.gz SXIJDTLLWBZDNF-UONOGXRCSA-N 1 1 232.371 3.655 20 0 BHADMO CCC[C@H]1CCC[N@H+]([C@@H](C)c2ccccn2)C1 ZINC000120993617 387287631 /nfs/dbraw/zinc/28/76/31/387287631.db2.gz SXIJDTLLWBZDNF-KBPBESRZSA-N 1 1 232.371 3.655 20 0 BHADMO CC[N@@H+](C)[C@@H](C)c1sc(C(C)C)nc1C ZINC000120998479 384390800 /nfs/dbraw/zinc/39/08/00/384390800.db2.gz HQHRGQHOECAVQB-JTQLQIEISA-N 1 1 226.389 3.588 20 0 BHADMO CC[N@@H+](C)[C@H](C)c1sc(C(C)C)nc1C ZINC000120998621 384392550 /nfs/dbraw/zinc/39/25/50/384392550.db2.gz HQHRGQHOECAVQB-SNVBAGLBSA-N 1 1 226.389 3.588 20 0 BHADMO Cc1ccc[nH+]c1NCc1coc2ccccc12 ZINC000121054869 179395590 /nfs/dbraw/zinc/39/55/90/179395590.db2.gz QFQOCZJBEJYRSX-UHFFFAOYSA-N 1 1 238.290 3.748 20 0 BHADMO Cc1cccc(NCc2coc3ccccc23)[nH+]1 ZINC000121060717 179151492 /nfs/dbraw/zinc/15/14/92/179151492.db2.gz KBEXTASNSLFFIV-UHFFFAOYSA-N 1 1 238.290 3.748 20 0 BHADMO CCC[N@@H+](C)[C@@H](C)c1sc(C(C)C)nc1C ZINC000121063430 169086893 /nfs/dbraw/zinc/08/68/93/169086893.db2.gz TWIOBUKVPSVXEY-NSHDSACASA-N 1 1 240.416 3.978 20 0 BHADMO CCC[N@@H+](C)[C@H](C)c1sc(C(C)C)nc1C ZINC000121063597 169085535 /nfs/dbraw/zinc/08/55/35/169085535.db2.gz TWIOBUKVPSVXEY-LLVKDONJSA-N 1 1 240.416 3.978 20 0 BHADMO c1csc(CC[N@H+]2CC[C@@H]3CCCC[C@@H]32)c1 ZINC000121081967 589497741 /nfs/dbraw/zinc/49/77/41/589497741.db2.gz PCNAJVDMSCSDAN-JSGCOSHPSA-N 1 1 235.396 3.555 20 0 BHADMO C[N@@H+](CCCF)Cc1csc2ccccc12 ZINC000121235525 384404335 /nfs/dbraw/zinc/40/43/35/384404335.db2.gz ZKNRDZHESZVVRD-UHFFFAOYSA-N 1 1 237.343 3.693 20 0 BHADMO Cc1ccc[nH+]c1NCc1cc2ccccc2o1 ZINC000121265758 188178016 /nfs/dbraw/zinc/17/80/16/188178016.db2.gz AIQQJUSYFWDTSW-UHFFFAOYSA-N 1 1 238.290 3.748 20 0 BHADMO C[C@@H](C1CC1)[N@@H+](CCCF)Cc1ccccc1 ZINC000121329841 324010954 /nfs/dbraw/zinc/01/09/54/324010954.db2.gz PUXNXOKSHJTQBD-ZDUSSCGKSA-N 1 1 235.346 3.647 20 0 BHADMO C[C@H](C1CC1)[N@@H+](CCCF)Cc1ccccc1 ZINC000121329996 324011572 /nfs/dbraw/zinc/01/15/72/324011572.db2.gz PUXNXOKSHJTQBD-CYBMUJFWSA-N 1 1 235.346 3.647 20 0 BHADMO CC(C)[N@@H+](Cc1ccc2ncccc2c1)C1CC1 ZINC000121338749 187295778 /nfs/dbraw/zinc/29/57/78/187295778.db2.gz MKMIAHFDZORRDQ-UHFFFAOYSA-N 1 1 240.350 3.608 20 0 BHADMO CC(C)[N@@H+](C/C=C/c1ccc(F)cc1)C1CC1 ZINC000121348771 324012598 /nfs/dbraw/zinc/01/25/98/324012598.db2.gz QWOLALBUCMPSPB-ONEGZZNKSA-N 1 1 233.330 3.712 20 0 BHADMO C[C@@H](c1ccccn1)[N@H+]1CC[C@]2(CC[C@@H](C)C2)C1 ZINC000121389591 176027564 /nfs/dbraw/zinc/02/75/64/176027564.db2.gz AYJKVZBUPZRADD-YCPHGPKFSA-N 1 1 244.382 3.655 20 0 BHADMO C[C@@H](c1ccccn1)[N@H+]1CC[C@@]2(CC[C@@H](C)C2)C1 ZINC000121389923 176028325 /nfs/dbraw/zinc/02/83/25/176028325.db2.gz AYJKVZBUPZRADD-IJEWVQPXSA-N 1 1 244.382 3.655 20 0 BHADMO CC[N@@H+](CCCF)Cc1cccc(Cl)c1 ZINC000121395808 487857475 /nfs/dbraw/zinc/85/74/75/487857475.db2.gz JDRHFPVFMGWFHW-UHFFFAOYSA-N 1 1 229.726 3.522 20 0 BHADMO FCCC[N@@H+](Cc1ccc(Cl)cc1)C1CC1 ZINC000121485392 387355492 /nfs/dbraw/zinc/35/54/92/387355492.db2.gz UXNXVPWMEZRKLL-UHFFFAOYSA-N 1 1 241.737 3.664 20 0 BHADMO FCCC[N@H+]1CCC[C@H]1c1cccc(Cl)c1 ZINC000121491427 324015356 /nfs/dbraw/zinc/01/53/56/324015356.db2.gz FCVJMMGYUMVKDY-ZDUSSCGKSA-N 1 1 241.737 3.837 20 0 BHADMO FCCC[N@H+]1CCC[C@@H]1c1cccc(Cl)c1 ZINC000121491541 324015369 /nfs/dbraw/zinc/01/53/69/324015369.db2.gz FCVJMMGYUMVKDY-CYBMUJFWSA-N 1 1 241.737 3.837 20 0 BHADMO C[C@@H](c1cccc(Cl)c1)[N@@H+](C)CCCF ZINC000121514743 176016465 /nfs/dbraw/zinc/01/64/65/176016465.db2.gz CNTQTBSFBFKJKP-JTQLQIEISA-N 1 1 229.726 3.692 20 0 BHADMO C[C@H](c1cccc(Cl)c1)[N@@H+](C)CCCF ZINC000121514874 177036428 /nfs/dbraw/zinc/03/64/28/177036428.db2.gz CNTQTBSFBFKJKP-SNVBAGLBSA-N 1 1 229.726 3.692 20 0 BHADMO C[C@@H](c1ccccc1Cl)[N@@H+](C)CCCF ZINC000121515711 176023964 /nfs/dbraw/zinc/02/39/64/176023964.db2.gz WSUVTTHGYGRDMX-JTQLQIEISA-N 1 1 229.726 3.692 20 0 BHADMO C[C@H](c1ccccc1Cl)[N@@H+](C)CCCF ZINC000121515870 177041464 /nfs/dbraw/zinc/04/14/64/177041464.db2.gz WSUVTTHGYGRDMX-SNVBAGLBSA-N 1 1 229.726 3.692 20 0 BHADMO FCCC[N@H+]1CCC[C@H]1c1ccccc1Cl ZINC000121530702 324012389 /nfs/dbraw/zinc/01/23/89/324012389.db2.gz JKZWBBHPTXZMSU-ZDUSSCGKSA-N 1 1 241.737 3.837 20 0 BHADMO FCCC[N@H+]1CCC[C@@H]1c1ccccc1Cl ZINC000121530837 324012695 /nfs/dbraw/zinc/01/26/95/324012695.db2.gz JKZWBBHPTXZMSU-CYBMUJFWSA-N 1 1 241.737 3.837 20 0 BHADMO CC[C@@H](C)C[N@H+]1CC[C@H](c2ccccc2OC)C1 ZINC000121671781 324019648 /nfs/dbraw/zinc/01/96/48/324019648.db2.gz VDMRBEOTUILPPD-KGLIPLIRSA-N 1 1 247.382 3.531 20 0 BHADMO CC[C@H](C)C[N@H+]1CC[C@H](c2ccccc2OC)C1 ZINC000121671960 324019823 /nfs/dbraw/zinc/01/98/23/324019823.db2.gz VDMRBEOTUILPPD-KBPBESRZSA-N 1 1 247.382 3.531 20 0 BHADMO C[C@@H](c1nc2ccccc2s1)[N@@H+](C)CC1CC1 ZINC000121778315 176039600 /nfs/dbraw/zinc/03/96/00/176039600.db2.gz HVBZKDLFJFWYAQ-JTQLQIEISA-N 1 1 246.379 3.699 20 0 BHADMO C[C@H](c1nc2ccccc2s1)[N@@H+](C)CC1CC1 ZINC000121778470 177054720 /nfs/dbraw/zinc/05/47/20/177054720.db2.gz HVBZKDLFJFWYAQ-SNVBAGLBSA-N 1 1 246.379 3.699 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@@H](C)c2ccccc2)cn1 ZINC000121862364 387424812 /nfs/dbraw/zinc/42/48/12/387424812.db2.gz GONNTYLKXNPTAQ-AWEZNQCLSA-N 1 1 240.350 3.583 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@H](C)c2ccccc2)cn1 ZINC000121862543 387425027 /nfs/dbraw/zinc/42/50/27/387425027.db2.gz GONNTYLKXNPTAQ-CQSZACIVSA-N 1 1 240.350 3.583 20 0 BHADMO CC[N@@H+](CCCF)[C@@H](C)c1ccc(F)cc1 ZINC000121930168 387440489 /nfs/dbraw/zinc/44/04/89/387440489.db2.gz VCZCQCNZVJXJNQ-NSHDSACASA-N 1 1 227.298 3.568 20 0 BHADMO CC[N@@H+](CCCF)[C@H](C)c1ccc(F)cc1 ZINC000121930332 387439431 /nfs/dbraw/zinc/43/94/31/387439431.db2.gz VCZCQCNZVJXJNQ-LLVKDONJSA-N 1 1 227.298 3.568 20 0 BHADMO CCc1nc(C)c([C@@H](C)[N@@H+](C)CC(C)C)s1 ZINC000121958132 357158610 /nfs/dbraw/zinc/15/86/10/357158610.db2.gz PEWAKZQAPSVDEL-LLVKDONJSA-N 1 1 240.416 3.663 20 0 BHADMO CCc1nc(C)c([C@H](C)[N@@H+](C)CC(C)C)s1 ZINC000121958296 357158423 /nfs/dbraw/zinc/15/84/23/357158423.db2.gz PEWAKZQAPSVDEL-NSHDSACASA-N 1 1 240.416 3.663 20 0 BHADMO Cc1ccc(C[N@H+](C)C2CCCCCC2)cn1 ZINC000121979142 387446412 /nfs/dbraw/zinc/44/64/12/387446412.db2.gz CFEFTCPWZNCTSP-UHFFFAOYSA-N 1 1 232.371 3.545 20 0 BHADMO Cc1ncccc1C[N@H+](C)C1CCCCCC1 ZINC000122068367 180218836 /nfs/dbraw/zinc/21/88/36/180218836.db2.gz ACUVJOJWSSWVCW-UHFFFAOYSA-N 1 1 232.371 3.545 20 0 BHADMO CCCC[N@@H+](C)[C@@H](C)c1sc(CC)nc1C ZINC000122107404 387485928 /nfs/dbraw/zinc/48/59/28/387485928.db2.gz YHGPFBIKNFKQHW-NSHDSACASA-N 1 1 240.416 3.807 20 0 BHADMO CCCC[N@@H+](C)[C@H](C)c1sc(CC)nc1C ZINC000122107624 387486167 /nfs/dbraw/zinc/48/61/67/387486167.db2.gz YHGPFBIKNFKQHW-LLVKDONJSA-N 1 1 240.416 3.807 20 0 BHADMO FCCC[N@H+](Cc1ccccc1)CC1CCC1 ZINC000122109069 387484575 /nfs/dbraw/zinc/48/45/75/387484575.db2.gz QRPQCYZNGMTJPC-UHFFFAOYSA-N 1 1 235.346 3.648 20 0 BHADMO Cc1ccc(C[N@H+](CCCF)C(C)C)s1 ZINC000122113610 384457303 /nfs/dbraw/zinc/45/73/03/384457303.db2.gz JJAIUNLCCIPPRQ-UHFFFAOYSA-N 1 1 229.364 3.627 20 0 BHADMO Cc1ccoc1C[N@H+](C)[C@@H](C)c1ccc(F)cc1 ZINC000122185942 387487589 /nfs/dbraw/zinc/48/75/89/387487589.db2.gz CYPXIJMWJZVUTK-LBPRGKRZSA-N 1 1 247.313 3.920 20 0 BHADMO Cc1ccoc1C[N@H+](C)[C@H](C)c1ccc(F)cc1 ZINC000122186191 387488153 /nfs/dbraw/zinc/48/81/53/387488153.db2.gz CYPXIJMWJZVUTK-GFCCVEGCSA-N 1 1 247.313 3.920 20 0 BHADMO CCCCC[N@@H+](Cc1ccc(C)nc1)C(C)C ZINC000122229770 387501326 /nfs/dbraw/zinc/50/13/26/387501326.db2.gz BUURRYWPUXDUNV-UHFFFAOYSA-N 1 1 234.387 3.791 20 0 BHADMO CCCCCC[N@@H+](Cc1ccncc1)C1CC1 ZINC000122275038 589574021 /nfs/dbraw/zinc/57/40/21/589574021.db2.gz WXJBRKVTXVTAOQ-UHFFFAOYSA-N 1 1 232.371 3.626 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@@H](C)c2cccs2)cn1 ZINC000122348959 387514673 /nfs/dbraw/zinc/51/46/73/387514673.db2.gz VPNUPMPSUWZXNP-LBPRGKRZSA-N 1 1 246.379 3.645 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@H](C)c2cccs2)cn1 ZINC000122349190 387513404 /nfs/dbraw/zinc/51/34/04/387513404.db2.gz VPNUPMPSUWZXNP-GFCCVEGCSA-N 1 1 246.379 3.645 20 0 BHADMO CC1(C)CC[C@H](Nc2cc[nH+]cc2Cl)C1 ZINC000122370490 324041739 /nfs/dbraw/zinc/04/17/39/324041739.db2.gz OOONIZJJLMHTRX-VIFPVBQESA-N 1 1 224.735 3.726 20 0 BHADMO CC1(C)CC[C@@H](Nc2cc[nH+]cc2Cl)C1 ZINC000122370739 324041940 /nfs/dbraw/zinc/04/19/40/324041940.db2.gz OOONIZJJLMHTRX-SECBINFHSA-N 1 1 224.735 3.726 20 0 BHADMO CCCc1[nH+]ccn1CCCCc1ccccc1 ZINC000122413011 324044011 /nfs/dbraw/zinc/04/40/11/324044011.db2.gz MXTNDKDCHQUPTP-UHFFFAOYSA-N 1 1 242.366 3.859 20 0 BHADMO Cc1[nH+]cn(CCCCc2ccccc2)c1C ZINC000122420200 180286400 /nfs/dbraw/zinc/28/64/00/180286400.db2.gz BVSXVDMJDSYMOW-UHFFFAOYSA-N 1 1 228.339 3.523 20 0 BHADMO CCSCC[N@H+]1CCC[C@@H]1c1cccs1 ZINC000122502804 384485252 /nfs/dbraw/zinc/48/52/52/384485252.db2.gz AJWYABUEOQAFIS-LLVKDONJSA-N 1 1 241.425 3.638 20 0 BHADMO CCSCC[N@H+]1CCC[C@H]1c1cccs1 ZINC000122503039 384486070 /nfs/dbraw/zinc/48/60/70/384486070.db2.gz AJWYABUEOQAFIS-NSHDSACASA-N 1 1 241.425 3.638 20 0 BHADMO CCSCC[N@@H+](C)Cc1ccc(Cl)s1 ZINC000122510573 387544861 /nfs/dbraw/zinc/54/48/61/387544861.db2.gz IYGLDCYNFWBIBO-UHFFFAOYSA-N 1 1 249.832 3.586 20 0 BHADMO CC[C@H]([NH2+]Cc1ccc(C)o1)c1ccccc1F ZINC000122523836 411434276 /nfs/dbraw/zinc/43/42/76/411434276.db2.gz NKJMMEXLIDPUEJ-HNNXBMFYSA-N 1 1 247.313 3.968 20 0 BHADMO CC[C@@H]([NH2+]Cc1ccc(C)o1)c1ccccc1F ZINC000122524066 410294840 /nfs/dbraw/zinc/29/48/40/410294840.db2.gz NKJMMEXLIDPUEJ-OAHLLOKOSA-N 1 1 247.313 3.968 20 0 BHADMO CCSCC[N@H+]1CCC[C@@H]1c1ccccc1 ZINC000122643412 387571385 /nfs/dbraw/zinc/57/13/85/387571385.db2.gz QZPLVPKJBWTGAP-CQSZACIVSA-N 1 1 235.396 3.577 20 0 BHADMO CCSCC[N@H+]1CCC[C@H]1c1ccccc1 ZINC000122643710 387571559 /nfs/dbraw/zinc/57/15/59/387571559.db2.gz QZPLVPKJBWTGAP-AWEZNQCLSA-N 1 1 235.396 3.577 20 0 BHADMO C[C@@H](C1CC1)[N@@H+](C/C(Cl)=C/Cl)C1CC1 ZINC000122732221 589625362 /nfs/dbraw/zinc/62/53/62/589625362.db2.gz FUDTZSMWTLGGIN-KZSPTFSBSA-N 1 1 234.170 3.568 20 0 BHADMO C[C@@H](C1CC1)[N@H+](C/C(Cl)=C/Cl)C1CC1 ZINC000122732221 589625360 /nfs/dbraw/zinc/62/53/60/589625360.db2.gz FUDTZSMWTLGGIN-KZSPTFSBSA-N 1 1 234.170 3.568 20 0 BHADMO C[C@H](C1CC1)[N@@H+](C/C(Cl)=C/Cl)C1CC1 ZINC000122732424 589625240 /nfs/dbraw/zinc/62/52/40/589625240.db2.gz FUDTZSMWTLGGIN-NDVARNPJSA-N 1 1 234.170 3.568 20 0 BHADMO C[C@H](C1CC1)[N@H+](C/C(Cl)=C/Cl)C1CC1 ZINC000122732424 589625239 /nfs/dbraw/zinc/62/52/39/589625239.db2.gz FUDTZSMWTLGGIN-NDVARNPJSA-N 1 1 234.170 3.568 20 0 BHADMO CCSCC[N@H+]1CCC[C@@H]1c1ccsc1 ZINC000122800720 384511243 /nfs/dbraw/zinc/51/12/43/384511243.db2.gz BEFVTNJMWXUFHA-GFCCVEGCSA-N 1 1 241.425 3.638 20 0 BHADMO CCSCC[N@H+]1CCC[C@H]1c1ccsc1 ZINC000122800965 384509968 /nfs/dbraw/zinc/50/99/68/384509968.db2.gz BEFVTNJMWXUFHA-LBPRGKRZSA-N 1 1 241.425 3.638 20 0 BHADMO CCSCC[N@@H+](C)[C@@H](C)c1ccccc1F ZINC000122841550 387607232 /nfs/dbraw/zinc/60/72/32/387607232.db2.gz XYZCNOPVOVFYJT-NSHDSACASA-N 1 1 241.375 3.572 20 0 BHADMO CCSCC[N@@H+](C)[C@H](C)c1ccccc1F ZINC000122841736 387607701 /nfs/dbraw/zinc/60/77/01/387607701.db2.gz XYZCNOPVOVFYJT-LLVKDONJSA-N 1 1 241.375 3.572 20 0 BHADMO CC[C@@H](c1ccccc1)[N@@H+](C)Cc1cc(C)on1 ZINC000122858250 344978276 /nfs/dbraw/zinc/97/82/76/344978276.db2.gz HLFLFCZDYIDXER-HNNXBMFYSA-N 1 1 244.338 3.566 20 0 BHADMO CC[C@@H](c1ccccc1)[N@H+](C)Cc1cc(C)on1 ZINC000122858250 344978274 /nfs/dbraw/zinc/97/82/74/344978274.db2.gz HLFLFCZDYIDXER-HNNXBMFYSA-N 1 1 244.338 3.566 20 0 BHADMO CC[C@H](c1ccccc1)[N@@H+](C)Cc1cc(C)on1 ZINC000122858422 384515848 /nfs/dbraw/zinc/51/58/48/384515848.db2.gz HLFLFCZDYIDXER-OAHLLOKOSA-N 1 1 244.338 3.566 20 0 BHADMO CC[C@H](c1ccccc1)[N@H+](C)Cc1cc(C)on1 ZINC000122858422 384515846 /nfs/dbraw/zinc/51/58/46/384515846.db2.gz HLFLFCZDYIDXER-OAHLLOKOSA-N 1 1 244.338 3.566 20 0 BHADMO CC(C)(C)[C@H]([NH2+]Cc1ccon1)c1ccccc1 ZINC000122878580 384517731 /nfs/dbraw/zinc/51/77/31/384517731.db2.gz NNBHGTYOGNTUMF-CQSZACIVSA-N 1 1 244.338 3.552 20 0 BHADMO CC(C)(C)[C@@H]([NH2+]Cc1ccon1)c1ccccc1 ZINC000122878801 384515614 /nfs/dbraw/zinc/51/56/14/384515614.db2.gz NNBHGTYOGNTUMF-AWEZNQCLSA-N 1 1 244.338 3.552 20 0 BHADMO C[N@H+](Cc1cc2ccccc2s1)CC1CC1 ZINC000122898059 324060882 /nfs/dbraw/zinc/06/08/82/324060882.db2.gz AABYJQWRBQPFPG-UHFFFAOYSA-N 1 1 231.364 3.743 20 0 BHADMO Cc1oc2ccccc2c1C[N@@H+](C)CC1CC1 ZINC000122920359 387615872 /nfs/dbraw/zinc/61/58/72/387615872.db2.gz ZBRRHJJHBDIZRD-UHFFFAOYSA-N 1 1 229.323 3.583 20 0 BHADMO C[C@@H]1CC[N@@H+](CCCCC(F)(F)F)C[C@@H]1C ZINC000122935128 324065781 /nfs/dbraw/zinc/06/57/81/324065781.db2.gz JTOVSWUEXNRQQW-MNOVXSKESA-N 1 1 237.309 3.697 20 0 BHADMO C[C@H]1C[N@H+](CCCCC(F)(F)F)CC[C@@H]1C ZINC000122935335 324065599 /nfs/dbraw/zinc/06/55/99/324065599.db2.gz JTOVSWUEXNRQQW-QWRGUYRKSA-N 1 1 237.309 3.697 20 0 BHADMO C[C@@H](c1ccccc1)[N@H+]1CCC2(CCC2)C1 ZINC000122944279 176020921 /nfs/dbraw/zinc/02/09/21/176020921.db2.gz DQMWYMFPRZYTAI-ZDUSSCGKSA-N 1 1 215.340 3.624 20 0 BHADMO C[C@H](c1ccccc1)[N@H+]1CCC2(CCC2)C1 ZINC000122944533 177038570 /nfs/dbraw/zinc/03/85/70/177038570.db2.gz DQMWYMFPRZYTAI-CYBMUJFWSA-N 1 1 215.340 3.624 20 0 BHADMO C[C@@H](c1ccco1)[N@@H+](C)CCc1ccccc1 ZINC000122961563 176031664 /nfs/dbraw/zinc/03/16/64/176031664.db2.gz ODJNEJSQCDDQTN-ZDUSSCGKSA-N 1 1 229.323 3.515 20 0 BHADMO C[C@H](c1ccco1)[N@@H+](C)CCc1ccccc1 ZINC000122961717 177048094 /nfs/dbraw/zinc/04/80/94/177048094.db2.gz ODJNEJSQCDDQTN-CYBMUJFWSA-N 1 1 229.323 3.515 20 0 BHADMO Cc1cnc(C[NH2+][C@H](C)c2ccccc2C)s1 ZINC000122976791 387621699 /nfs/dbraw/zinc/62/16/99/387621699.db2.gz AITIFUJIWSUVFY-GFCCVEGCSA-N 1 1 246.379 3.611 20 0 BHADMO Cc1cnc(C[NH2+][C@@H](C)c2ccccc2C)s1 ZINC000122977014 387620713 /nfs/dbraw/zinc/62/07/13/387620713.db2.gz AITIFUJIWSUVFY-LBPRGKRZSA-N 1 1 246.379 3.611 20 0 BHADMO COc1cccc([C@H](C)[N@H+]2CCC3(CCC3)C2)c1 ZINC000123005499 175292516 /nfs/dbraw/zinc/29/25/16/175292516.db2.gz DGDRCEHRBUMGMR-ZDUSSCGKSA-N 1 1 245.366 3.632 20 0 BHADMO COc1cccc([C@@H](C)[N@H+]2CCC3(CCC3)C2)c1 ZINC000123005716 175287051 /nfs/dbraw/zinc/28/70/51/175287051.db2.gz DGDRCEHRBUMGMR-CYBMUJFWSA-N 1 1 245.366 3.632 20 0 BHADMO CC(C)c1nc(C[N@@H+]2[C@H](C)CC[C@@H]2C)cs1 ZINC000123006567 387634525 /nfs/dbraw/zinc/63/45/25/387634525.db2.gz KFULJMIULOMVJM-PHIMTYICSA-N 1 1 238.400 3.639 20 0 BHADMO C[C@@H]1CC[C@H](C)[N@@H+]1Cc1cccc2cccnc21 ZINC000123014252 177187341 /nfs/dbraw/zinc/18/73/41/177187341.db2.gz HQIQLTGCYHETDJ-BETUJISGSA-N 1 1 240.350 3.608 20 0 BHADMO Cc1ccc([C@@H](C)[N@@H+](C)Cc2ccco2)cc1 ZINC000123059499 387641292 /nfs/dbraw/zinc/64/12/92/387641292.db2.gz FBZNSFFHMNKZDL-CYBMUJFWSA-N 1 1 229.323 3.781 20 0 BHADMO Cc1ccc([C@H](C)[N@@H+](C)Cc2ccco2)cc1 ZINC000123059721 387641801 /nfs/dbraw/zinc/64/18/01/387641801.db2.gz FBZNSFFHMNKZDL-ZDUSSCGKSA-N 1 1 229.323 3.781 20 0 BHADMO CC[N@@H+](C/C(Cl)=C/Cl)C1CCCC1 ZINC000123261809 589683389 /nfs/dbraw/zinc/68/33/89/589683389.db2.gz WHBLBQCUVRFWNU-CLFYSBASSA-N 1 1 222.159 3.570 20 0 BHADMO C[C@@H](c1ccccc1F)[N@H+]1CCC2(CCC2)C1 ZINC000123273880 176025331 /nfs/dbraw/zinc/02/53/31/176025331.db2.gz SLEOECDLQLSYSL-LBPRGKRZSA-N 1 1 233.330 3.763 20 0 BHADMO C[C@H](c1ccccc1F)[N@H+]1CCC2(CCC2)C1 ZINC000123274087 177041587 /nfs/dbraw/zinc/04/15/87/177041587.db2.gz SLEOECDLQLSYSL-GFCCVEGCSA-N 1 1 233.330 3.763 20 0 BHADMO Cc1ccc(C)c([C@@H](C)[N@@H+](C)CCCF)c1 ZINC000123369331 324268776 /nfs/dbraw/zinc/26/87/76/324268776.db2.gz QBCIVSAAODDUCY-CYBMUJFWSA-N 1 1 223.335 3.656 20 0 BHADMO Cc1ccc(C)c([C@H](C)[N@@H+](C)CCCF)c1 ZINC000123369551 324268641 /nfs/dbraw/zinc/26/86/41/324268641.db2.gz QBCIVSAAODDUCY-ZDUSSCGKSA-N 1 1 223.335 3.656 20 0 BHADMO C[N@@H+](CCc1cccs1)Cc1cccc(F)c1 ZINC000123499394 342716353 /nfs/dbraw/zinc/71/63/53/342716353.db2.gz SHBSUMOAWMCJAU-UHFFFAOYSA-N 1 1 249.354 3.562 20 0 BHADMO CC(C)C[C@@H]1CCCC[N@H+]1CCc1ccncc1 ZINC000123608401 188257442 /nfs/dbraw/zinc/25/74/42/188257442.db2.gz AVYZTSYOGFXIOM-INIZCTEOSA-N 1 1 246.398 3.525 20 0 BHADMO CC(C)C[C@H]1CCCC[N@H+]1CCc1ccncc1 ZINC000123608677 188084049 /nfs/dbraw/zinc/08/40/49/188084049.db2.gz AVYZTSYOGFXIOM-MRXNPFEDSA-N 1 1 246.398 3.525 20 0 BHADMO C[N@@H+](CCc1ccc(Cl)cc1)Cc1ccco1 ZINC000123623203 387588454 /nfs/dbraw/zinc/58/84/54/387588454.db2.gz LNOATWYDCGDOPY-UHFFFAOYSA-N 1 1 249.741 3.608 20 0 BHADMO C[C@H]([NH2+][C@@H]1CSc2ccccc21)c1ccco1 ZINC000123630543 387587829 /nfs/dbraw/zinc/58/78/29/387587829.db2.gz DMYBLRMWSIOVLF-CMPLNLGQSA-N 1 1 245.347 3.777 20 0 BHADMO C[C@H]([NH2+][C@H]1CSc2ccccc21)c1ccco1 ZINC000123630726 387589144 /nfs/dbraw/zinc/58/91/44/387589144.db2.gz DMYBLRMWSIOVLF-JQWIXIFHSA-N 1 1 245.347 3.777 20 0 BHADMO C[C@@H]([NH2+][C@@H]1CSc2ccccc21)c1ccco1 ZINC000123630898 175919060 /nfs/dbraw/zinc/91/90/60/175919060.db2.gz DMYBLRMWSIOVLF-ZYHUDNBSSA-N 1 1 245.347 3.777 20 0 BHADMO C[C@@H]([NH2+][C@H]1CSc2ccccc21)c1ccco1 ZINC000123631037 387587995 /nfs/dbraw/zinc/58/79/95/387587995.db2.gz DMYBLRMWSIOVLF-PWSUYJOCSA-N 1 1 245.347 3.777 20 0 BHADMO C(=C/c1ccccc1)\C[N@H+]1CCC2(CCC2)C1 ZINC000123640437 343463091 /nfs/dbraw/zinc/46/30/91/343463091.db2.gz YMUUAJDTBZKTOA-XBXARRHUSA-N 1 1 227.351 3.576 20 0 BHADMO CC(C)C[C@@H]1CCCC[N@H+]1CCc1ccccn1 ZINC000123650136 388656409 /nfs/dbraw/zinc/65/64/09/388656409.db2.gz SKZJBOJIMNIHFI-INIZCTEOSA-N 1 1 246.398 3.525 20 0 BHADMO CC(C)C[C@H]1CCCC[N@H+]1CCc1ccccn1 ZINC000123650395 388656375 /nfs/dbraw/zinc/65/63/75/388656375.db2.gz SKZJBOJIMNIHFI-MRXNPFEDSA-N 1 1 246.398 3.525 20 0 BHADMO c1coc(C[N@H+]2CCC[C@H]2c2ccccc2)c1 ZINC000123661330 387590512 /nfs/dbraw/zinc/59/05/12/387590512.db2.gz SKOGLZVCSCOFOT-HNNXBMFYSA-N 1 1 227.307 3.617 20 0 BHADMO c1coc(C[N@H+]2CCC[C@@H]2c2ccccc2)c1 ZINC000123661531 387590587 /nfs/dbraw/zinc/59/05/87/387590587.db2.gz SKOGLZVCSCOFOT-OAHLLOKOSA-N 1 1 227.307 3.617 20 0 BHADMO Cc1ccoc1C[N@H+]1CCC[C@@H]1c1ccccc1 ZINC000123662590 387590203 /nfs/dbraw/zinc/59/02/03/387590203.db2.gz HZONBAQNTLZXAJ-OAHLLOKOSA-N 1 1 241.334 3.925 20 0 BHADMO Cc1ccoc1C[N@H+]1CCC[C@H]1c1ccccc1 ZINC000123662796 387590190 /nfs/dbraw/zinc/59/01/90/387590190.db2.gz HZONBAQNTLZXAJ-HNNXBMFYSA-N 1 1 241.334 3.925 20 0 BHADMO CC(C)CC[N@@H+](C)[C@@H](C)c1cccs1 ZINC000123681094 490488436 /nfs/dbraw/zinc/48/84/36/490488436.db2.gz LFKQPLITFPSRNI-NSHDSACASA-N 1 1 211.374 3.787 20 0 BHADMO CC(C)CC[N@@H+](C)[C@H](C)c1cccs1 ZINC000123681346 490254838 /nfs/dbraw/zinc/25/48/38/490254838.db2.gz LFKQPLITFPSRNI-LLVKDONJSA-N 1 1 211.374 3.787 20 0 BHADMO c1ccc2c(c1)cc[nH+]c2NC1CCCC1 ZINC000123771615 324602205 /nfs/dbraw/zinc/60/22/05/324602205.db2.gz GUEZKTKOZSSWLH-UHFFFAOYSA-N 1 1 212.296 3.589 20 0 BHADMO CC[N@@H+](Cc1cc(C)nc2ccccc12)C1CC1 ZINC000123854629 345019286 /nfs/dbraw/zinc/01/92/86/345019286.db2.gz XEOFWBXPGFVHSK-UHFFFAOYSA-N 1 1 240.350 3.528 20 0 BHADMO c1ccc2c(c1)CC[C@@H]2[N@@H+](CC1CC1)C1CC1 ZINC000123898797 387598201 /nfs/dbraw/zinc/59/82/01/387598201.db2.gz WJKWWAYFOFVSNY-INIZCTEOSA-N 1 1 227.351 3.548 20 0 BHADMO c1ccc2c(c1)CC[C@H]2[N@@H+](CC1CC1)C1CC1 ZINC000123899019 387597774 /nfs/dbraw/zinc/59/77/74/387597774.db2.gz WJKWWAYFOFVSNY-MRXNPFEDSA-N 1 1 227.351 3.548 20 0 BHADMO Fc1ccc([C@H]2CCC[N@H+]2Cc2ccco2)cc1 ZINC000124081780 387606578 /nfs/dbraw/zinc/60/65/78/387606578.db2.gz YSZHMEZIUOGMTP-OAHLLOKOSA-N 1 1 245.297 3.756 20 0 BHADMO Fc1ccc([C@@H]2CCC[N@H+]2Cc2ccco2)cc1 ZINC000124082005 387605913 /nfs/dbraw/zinc/60/59/13/387605913.db2.gz YSZHMEZIUOGMTP-HNNXBMFYSA-N 1 1 245.297 3.756 20 0 BHADMO CC[N@@H+](Cc1cc(C)nc2ccccc12)C(C)C ZINC000124276949 358514806 /nfs/dbraw/zinc/51/48/06/358514806.db2.gz XQKHMRUFRJQYLC-UHFFFAOYSA-N 1 1 242.366 3.774 20 0 BHADMO C[C@@H]1CCC[N@H+]1Cc1cc2cc(F)ccc2o1 ZINC000124292665 176108746 /nfs/dbraw/zinc/10/87/46/176108746.db2.gz JPGPOZDLPKCWBT-SNVBAGLBSA-N 1 1 233.286 3.556 20 0 BHADMO C[C@H]1CCC[N@H+]1Cc1cc2cc(F)ccc2o1 ZINC000124292899 177110555 /nfs/dbraw/zinc/11/05/55/177110555.db2.gz JPGPOZDLPKCWBT-JTQLQIEISA-N 1 1 233.286 3.556 20 0 BHADMO C/C(=C\c1ccccc1)C[N@@H+]1CCC[C@H]1C ZINC000124352923 388662295 /nfs/dbraw/zinc/66/22/95/388662295.db2.gz KSOWVPOSWZHDIT-YPDDLIOESA-N 1 1 215.340 3.574 20 0 BHADMO C/C(=C\c1ccccc1)C[N@@H+]1CCC[C@@H]1C ZINC000124353148 384976063 /nfs/dbraw/zinc/97/60/63/384976063.db2.gz KSOWVPOSWZHDIT-CMPYXILNSA-N 1 1 215.340 3.574 20 0 BHADMO CC[N@@H+](Cc1cccs1)C1CCCC1 ZINC000124372617 358516832 /nfs/dbraw/zinc/51/68/32/358516832.db2.gz CDSGUONFGBDMSZ-UHFFFAOYSA-N 1 1 209.358 3.513 20 0 BHADMO CC[C@@H](C)[N@@H+](C)Cc1cc(C)nc2ccccc12 ZINC000124421748 388662543 /nfs/dbraw/zinc/66/25/43/388662543.db2.gz KDXVYEYQILTVSH-CYBMUJFWSA-N 1 1 242.366 3.774 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1cc(C)nc2ccccc12 ZINC000124422001 388662177 /nfs/dbraw/zinc/66/21/77/388662177.db2.gz KDXVYEYQILTVSH-ZDUSSCGKSA-N 1 1 242.366 3.774 20 0 BHADMO C[N@@H+](CCCC1CCCC1)CCc1ccccn1 ZINC000124437008 387617473 /nfs/dbraw/zinc/61/74/73/387617473.db2.gz SVQCEUBJRHCKPV-UHFFFAOYSA-N 1 1 246.398 3.526 20 0 BHADMO CC[N@H+]1CCCC[C@@H]1c1ccc(C)cc1 ZINC000124505895 371194419 /nfs/dbraw/zinc/19/44/19/371194419.db2.gz RVRVQWOPIPLSHZ-CQSZACIVSA-N 1 1 203.329 3.542 20 0 BHADMO CC[N@H+]1CCCC[C@H]1c1ccc(C)cc1 ZINC000124506159 371194104 /nfs/dbraw/zinc/19/41/04/371194104.db2.gz RVRVQWOPIPLSHZ-AWEZNQCLSA-N 1 1 203.329 3.542 20 0 BHADMO COCCC[N@H+]1CCCC[C@H]1c1ccc(C)cc1 ZINC000124521303 388663658 /nfs/dbraw/zinc/66/36/58/388663658.db2.gz LJWUGRHMNLHQMU-INIZCTEOSA-N 1 1 247.382 3.559 20 0 BHADMO COCCC[N@H+]1CCCC[C@@H]1c1ccc(C)cc1 ZINC000124521531 388663338 /nfs/dbraw/zinc/66/33/38/388663338.db2.gz LJWUGRHMNLHQMU-MRXNPFEDSA-N 1 1 247.382 3.559 20 0 BHADMO C[N@H+]1CCC[C@@H]1CCSC1CCCCC1 ZINC000124522764 173028453 /nfs/dbraw/zinc/02/84/53/173028453.db2.gz BQSAGBDPFMHNOR-GFCCVEGCSA-N 1 1 227.417 3.537 20 0 BHADMO C[N@H+]1CCC[C@H]1CCSC1CCCCC1 ZINC000124523026 173054657 /nfs/dbraw/zinc/05/46/57/173054657.db2.gz BQSAGBDPFMHNOR-LBPRGKRZSA-N 1 1 227.417 3.537 20 0 BHADMO CC[C@@H]1CC[C@H](C)[N@H+]1Cc1cnc(Cl)s1 ZINC000124600175 171053452 /nfs/dbraw/zinc/05/34/52/171053452.db2.gz IGWHIWCSFFTFOG-DTWKUNHWSA-N 1 1 244.791 3.559 20 0 BHADMO CC[C@H]1CC[C@H](C)[N@H+]1Cc1cnc(Cl)s1 ZINC000124600358 384655580 /nfs/dbraw/zinc/65/55/80/384655580.db2.gz IGWHIWCSFFTFOG-IUCAKERBSA-N 1 1 244.791 3.559 20 0 BHADMO CC[C@@H]1CC[C@@H](C)[N@H+]1Cc1cnc(Cl)s1 ZINC000124600588 171037341 /nfs/dbraw/zinc/03/73/41/171037341.db2.gz IGWHIWCSFFTFOG-RKDXNWHRSA-N 1 1 244.791 3.559 20 0 BHADMO CC[C@H]1CC[C@@H](C)[N@H+]1Cc1cnc(Cl)s1 ZINC000124600858 384655747 /nfs/dbraw/zinc/65/57/47/384655747.db2.gz IGWHIWCSFFTFOG-BDAKNGLRSA-N 1 1 244.791 3.559 20 0 BHADMO c1cncc(C[N@H+](CCC2CCCC2)C2CC2)c1 ZINC000124745115 387631792 /nfs/dbraw/zinc/63/17/92/387631792.db2.gz QRFDNHKSOKXXCC-UHFFFAOYSA-N 1 1 244.382 3.626 20 0 BHADMO c1cc(C[N@H+](CCC2CCCC2)C2CC2)ccn1 ZINC000124901809 183338661 /nfs/dbraw/zinc/33/86/61/183338661.db2.gz ONCALNKESFDVFT-UHFFFAOYSA-N 1 1 244.382 3.626 20 0 BHADMO Cc1cc([NH2+]CC(C)(C)C)ccc1N(C)C ZINC000124907880 590097673 /nfs/dbraw/zinc/09/76/73/590097673.db2.gz PERKUDKWEZEATP-UHFFFAOYSA-N 1 1 220.360 3.519 20 0 BHADMO CC[N@H+](Cc1ccc2ccccc2n1)CC(C)C ZINC000124988001 323139731 /nfs/dbraw/zinc/13/97/31/323139731.db2.gz WRGZTGWJOCVVOZ-UHFFFAOYSA-N 1 1 242.366 3.713 20 0 BHADMO C[C@@H](c1cccnc1)[N@@H+](C)CC1CCC(C)CC1 ZINC000125002598 168153661 /nfs/dbraw/zinc/15/36/61/168153661.db2.gz JDYBWLFIBUEQRH-SLTAFYQDSA-N 1 1 246.398 3.901 20 0 BHADMO C[C@H](c1cccnc1)[N@@H+](C)CC1CCC(C)CC1 ZINC000125002804 168153530 /nfs/dbraw/zinc/15/35/30/168153530.db2.gz JDYBWLFIBUEQRH-SHARSMKWSA-N 1 1 246.398 3.901 20 0 BHADMO CCCC[N@@H+](CC)Cc1ncc(C(C)(C)C)o1 ZINC000125069126 388668625 /nfs/dbraw/zinc/66/86/25/388668625.db2.gz PITIIDPDNNRVMA-UHFFFAOYSA-N 1 1 238.375 3.594 20 0 BHADMO Cl/C=C(/Cl)C[N@H+]1CC[C@@H]2CCCC[C@@H]21 ZINC000125306778 590161103 /nfs/dbraw/zinc/16/11/03/590161103.db2.gz OAANVCRIXKEZLC-YCPUKSTGSA-N 1 1 234.170 3.570 20 0 BHADMO COCC[N@H+]1CCC[C@H]1c1ccc(C(C)C)cc1 ZINC000125360496 388671299 /nfs/dbraw/zinc/67/12/99/388671299.db2.gz YEOTWSQRNIPGSG-INIZCTEOSA-N 1 1 247.382 3.593 20 0 BHADMO COCC[N@H+]1CCC[C@@H]1c1ccc(C(C)C)cc1 ZINC000125360776 324067962 /nfs/dbraw/zinc/06/79/62/324067962.db2.gz YEOTWSQRNIPGSG-MRXNPFEDSA-N 1 1 247.382 3.593 20 0 BHADMO Cc1ccoc1C[N@@H+](Cc1ccccc1)C1CC1 ZINC000125430008 387657033 /nfs/dbraw/zinc/65/70/33/387657033.db2.gz BDSZNOQADPQOFQ-UHFFFAOYSA-N 1 1 241.334 3.753 20 0 BHADMO c1cc([C@@H]2CCC[N@@H+]2CC2CCCCC2)ccn1 ZINC000125477584 183359752 /nfs/dbraw/zinc/35/97/52/183359752.db2.gz BAHDNBLHOSDIHN-INIZCTEOSA-N 1 1 244.382 3.799 20 0 BHADMO c1cc([C@H]2CCC[N@@H+]2CC2CCCCC2)ccn1 ZINC000125477810 387656752 /nfs/dbraw/zinc/65/67/52/387656752.db2.gz BAHDNBLHOSDIHN-MRXNPFEDSA-N 1 1 244.382 3.799 20 0 BHADMO CCCCCC[N@H+]1CCC[C@@H]1c1ccncc1 ZINC000125505254 590166729 /nfs/dbraw/zinc/16/67/29/590166729.db2.gz RDKIICSKBVMKMX-OAHLLOKOSA-N 1 1 232.371 3.799 20 0 BHADMO CCCCCC[N@H+]1CCC[C@H]1c1ccncc1 ZINC000125505482 590166892 /nfs/dbraw/zinc/16/68/92/590166892.db2.gz RDKIICSKBVMKMX-HNNXBMFYSA-N 1 1 232.371 3.799 20 0 BHADMO c1cc([C@@H]2CCC[N@@H+]2CCC2CCCC2)ccn1 ZINC000125537078 183360463 /nfs/dbraw/zinc/36/04/63/183360463.db2.gz CYJWCXJAUOSKAP-INIZCTEOSA-N 1 1 244.382 3.799 20 0 BHADMO c1cc([C@H]2CCC[N@@H+]2CCC2CCCC2)ccn1 ZINC000125537328 183364565 /nfs/dbraw/zinc/36/45/65/183364565.db2.gz CYJWCXJAUOSKAP-MRXNPFEDSA-N 1 1 244.382 3.799 20 0 BHADMO CC(C)[N@H+](Cc1cccnc1)CC1CCCCC1 ZINC000125690963 387663243 /nfs/dbraw/zinc/66/32/43/387663243.db2.gz LPEYGPSUEJSFKJ-UHFFFAOYSA-N 1 1 246.398 3.872 20 0 BHADMO CCC(CC)C[N@@H+](CC)Cc1cnc(C)s1 ZINC000125713807 168350489 /nfs/dbraw/zinc/35/04/89/168350489.db2.gz UVFBGYMIHTXJIT-UHFFFAOYSA-N 1 1 240.416 3.710 20 0 BHADMO CC(C)[N@@H+](CCC1CCCC1)Cc1cccnc1 ZINC000125721229 387663055 /nfs/dbraw/zinc/66/30/55/387663055.db2.gz NBXWQYYNBKMYQB-UHFFFAOYSA-N 1 1 246.398 3.872 20 0 BHADMO CCC(CC)C[N@@H+](C)Cc1ccc(Cl)nc1 ZINC000125765436 590188478 /nfs/dbraw/zinc/18/84/78/590188478.db2.gz FWHSTRHNSPJVAF-UHFFFAOYSA-N 1 1 240.778 3.603 20 0 BHADMO C[C@@H](c1ccc(Cl)cc1)[N@@H+](C)CC1CC1 ZINC000125799935 388678549 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CCCCCC[N@H+]1CCC[C@H]1c1c(C)n[nH]c1C ZINC000130655626 591495204 /nfs/dbraw/zinc/49/52/04/591495204.db2.gz NRMGPPJDBGCKAW-AWEZNQCLSA-N 1 1 249.402 3.744 20 0 BHADMO CCCC[N@@H+](CC)CCCCC(F)(F)F ZINC000130660263 323011751 /nfs/dbraw/zinc/01/17/51/323011751.db2.gz ZAAFVCGPIDTARW-UHFFFAOYSA-N 1 1 225.298 3.841 20 0 BHADMO CCC[N@@H+](CCCCC(F)(F)F)CC1CC1 ZINC000130664201 325078571 /nfs/dbraw/zinc/07/85/71/325078571.db2.gz ISRLWFJWPJDEAO-UHFFFAOYSA-N 1 1 237.309 3.841 20 0 BHADMO C[C@@H](C[N@@H+](C)CCC(C)(C)C)c1nccs1 ZINC000130689378 325080583 /nfs/dbraw/zinc/08/05/83/325080583.db2.gz UYDFOAQWHVQVJI-NSHDSACASA-N 1 1 240.416 3.615 20 0 BHADMO C[C@H](C[N@@H+](C)CCC(C)(C)C)c1nccs1 ZINC000130689557 325080454 /nfs/dbraw/zinc/08/04/54/325080454.db2.gz UYDFOAQWHVQVJI-LLVKDONJSA-N 1 1 240.416 3.615 20 0 BHADMO Cc1ccc([C@@H](C)[N@@H+](C)Cc2cncs2)cc1 ZINC000130796372 385284391 /nfs/dbraw/zinc/28/43/91/385284391.db2.gz OUJUGJBILWUBQB-GFCCVEGCSA-N 1 1 246.379 3.645 20 0 BHADMO Cc1ccc([C@H](C)[N@@H+](C)Cc2cncs2)cc1 ZINC000130796610 385284615 /nfs/dbraw/zinc/28/46/15/385284615.db2.gz OUJUGJBILWUBQB-LBPRGKRZSA-N 1 1 246.379 3.645 20 0 BHADMO Cc1ccc([C@@H](C)[N@@H+](C)Cc2ccn(C)c2)cc1 ZINC000130802100 325090465 /nfs/dbraw/zinc/09/04/65/325090465.db2.gz RXPVOLXMXCVEOX-CQSZACIVSA-N 1 1 242.366 3.527 20 0 BHADMO Cc1ccc([C@H](C)[N@@H+](C)Cc2ccn(C)c2)cc1 ZINC000130802326 325090421 /nfs/dbraw/zinc/09/04/21/325090421.db2.gz RXPVOLXMXCVEOX-AWEZNQCLSA-N 1 1 242.366 3.527 20 0 BHADMO Cc1ccc([C@@H](C)[N@@H+](C)Cc2cccn2C)cc1 ZINC000130818455 325091517 /nfs/dbraw/zinc/09/15/17/325091517.db2.gz JXJCLWGLSZTLMS-CQSZACIVSA-N 1 1 242.366 3.527 20 0 BHADMO Cc1ccc([C@H](C)[N@@H+](C)Cc2cccn2C)cc1 ZINC000130818650 325091707 /nfs/dbraw/zinc/09/17/07/325091707.db2.gz JXJCLWGLSZTLMS-AWEZNQCLSA-N 1 1 242.366 3.527 20 0 BHADMO COCc1ccc([C@H]2CCC[N@H+]2CC=C(C)C)o1 ZINC000130822605 358648854 /nfs/dbraw/zinc/64/88/54/358648854.db2.gz MKYSEUGTDFXYMK-CQSZACIVSA-N 1 1 249.354 3.529 20 0 BHADMO 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Cc1cc(C[N@H+](C)[C@H](C)c2ccco2)ccc1F ZINC000131078968 325113272 /nfs/dbraw/zinc/11/32/72/325113272.db2.gz UYGYGTGRJCYOET-GFCCVEGCSA-N 1 1 247.313 3.920 20 0 BHADMO CCc1ccc(C[N@@H+](C)[C@@H](C)c2ccco2)o1 ZINC000131080118 385307431 /nfs/dbraw/zinc/30/74/31/385307431.db2.gz KOXRJWWMEZFCSD-NSHDSACASA-N 1 1 233.311 3.628 20 0 BHADMO CCc1ccc(C[N@H+](C)[C@@H](C)c2ccco2)o1 ZINC000131080118 385307425 /nfs/dbraw/zinc/30/74/25/385307425.db2.gz KOXRJWWMEZFCSD-NSHDSACASA-N 1 1 233.311 3.628 20 0 BHADMO CCc1ccc(C[N@@H+](C)[C@H](C)c2ccco2)o1 ZINC000131080368 385307919 /nfs/dbraw/zinc/30/79/19/385307919.db2.gz KOXRJWWMEZFCSD-LLVKDONJSA-N 1 1 233.311 3.628 20 0 BHADMO CCc1ccc(C[N@H+](C)[C@H](C)c2ccco2)o1 ZINC000131080368 385307911 /nfs/dbraw/zinc/30/79/11/385307911.db2.gz KOXRJWWMEZFCSD-LLVKDONJSA-N 1 1 233.311 3.628 20 0 BHADMO Cc1ccc(CNc2cccc3cc[nH+]cc32)o1 ZINC000131085898 325113412 /nfs/dbraw/zinc/11/34/12/325113412.db2.gz QHVHLXOELJYOBC-UHFFFAOYSA-N 1 1 238.290 3.748 20 0 BHADMO C[C@@H]1CCC[C@@H]1Nc1cccc2cc[nH+]cc21 ZINC000131088057 325113780 /nfs/dbraw/zinc/11/37/80/325113780.db2.gz ZFQHLUCPCLSGBB-RISCZKNCSA-N 1 1 226.323 3.835 20 0 BHADMO C[C@H]1CCC[C@@H]1Nc1cccc2cc[nH+]cc21 ZINC000131088235 325113975 /nfs/dbraw/zinc/11/39/75/325113975.db2.gz ZFQHLUCPCLSGBB-FZMZJTMJSA-N 1 1 226.323 3.835 20 0 BHADMO C[C@@H]1CCC[C@H]1Nc1cccc2cc[nH+]cc21 ZINC000131088459 325113936 /nfs/dbraw/zinc/11/39/36/325113936.db2.gz ZFQHLUCPCLSGBB-BXUZGUMPSA-N 1 1 226.323 3.835 20 0 BHADMO C[C@H]1CCC[C@H]1Nc1cccc2cc[nH+]cc21 ZINC000131088669 325113632 /nfs/dbraw/zinc/11/36/32/325113632.db2.gz ZFQHLUCPCLSGBB-SMDDNHRTSA-N 1 1 226.323 3.835 20 0 BHADMO C[C@@H]1CC[C@H](Nc2cccc3cc[nH+]cc32)C1 ZINC000131088881 325113797 /nfs/dbraw/zinc/11/37/97/325113797.db2.gz GKBCRSRKHNPGRA-YPMHNXCESA-N 1 1 226.323 3.835 20 0 BHADMO C[C@H]1CC[C@H](Nc2cccc3cc[nH+]cc32)C1 ZINC000131089087 325114029 /nfs/dbraw/zinc/11/40/29/325114029.db2.gz GKBCRSRKHNPGRA-AAEUAGOBSA-N 1 1 226.323 3.835 20 0 BHADMO C[C@@H]1CC[C@@H](Nc2cccc3cc[nH+]cc32)C1 ZINC000131089295 325114088 /nfs/dbraw/zinc/11/40/88/325114088.db2.gz GKBCRSRKHNPGRA-DGCLKSJQSA-N 1 1 226.323 3.835 20 0 BHADMO C[C@H]1CC[C@@H](Nc2cccc3cc[nH+]cc32)C1 ZINC000131089499 325113723 /nfs/dbraw/zinc/11/37/23/325113723.db2.gz GKBCRSRKHNPGRA-WCQYABFASA-N 1 1 226.323 3.835 20 0 BHADMO c1cc2cc[nH+]cc2c(N[C@@H]2CCCSC2)c1 ZINC000131091313 325113929 /nfs/dbraw/zinc/11/39/29/325113929.db2.gz NYHURSCLUKSLRU-GFCCVEGCSA-N 1 1 244.363 3.542 20 0 BHADMO c1cc2cc[nH+]cc2c(N[C@H]2CCCSC2)c1 ZINC000131091524 325114066 /nfs/dbraw/zinc/11/40/66/325114066.db2.gz NYHURSCLUKSLRU-LBPRGKRZSA-N 1 1 244.363 3.542 20 0 BHADMO CC[C@H](Nc1cccc2cc[nH+]cc21)C1CC1 ZINC000131092615 325113657 /nfs/dbraw/zinc/11/36/57/325113657.db2.gz MEINRHDBIDKEMF-AWEZNQCLSA-N 1 1 226.323 3.835 20 0 BHADMO CC[C@@H](Nc1cccc2cc[nH+]cc21)C1CC1 ZINC000131092845 325113714 /nfs/dbraw/zinc/11/37/14/325113714.db2.gz MEINRHDBIDKEMF-CQSZACIVSA-N 1 1 226.323 3.835 20 0 BHADMO Cc1cc(F)ccc1C[N@H+](C)[C@@H](C)c1ccco1 ZINC000131094511 325114769 /nfs/dbraw/zinc/11/47/69/325114769.db2.gz JNXIXQHBSHWGNR-LBPRGKRZSA-N 1 1 247.313 3.920 20 0 BHADMO Cc1cc(F)ccc1C[N@H+](C)[C@H](C)c1ccco1 ZINC000131094735 325114337 /nfs/dbraw/zinc/11/43/37/325114337.db2.gz JNXIXQHBSHWGNR-GFCCVEGCSA-N 1 1 247.313 3.920 20 0 BHADMO C[C@H](Nc1cccc2cc[nH+]cc21)c1cccnc1 ZINC000131102796 325116213 /nfs/dbraw/zinc/11/62/13/325116213.db2.gz QHTDKBJHFMSHSY-LBPRGKRZSA-N 1 1 249.317 3.803 20 0 BHADMO C[C@@H](Nc1cccc2cc[nH+]cc21)c1cccnc1 ZINC000131103035 325115847 /nfs/dbraw/zinc/11/58/47/325115847.db2.gz QHTDKBJHFMSHSY-GFCCVEGCSA-N 1 1 249.317 3.803 20 0 BHADMO Cc1cc(C[N@H+](C)[C@@H](C)c2ccco2)c(C)o1 ZINC000131104374 591553716 /nfs/dbraw/zinc/55/37/16/591553716.db2.gz BUGQLZJCTIVDIL-NSHDSACASA-N 1 1 233.311 3.682 20 0 BHADMO Cc1cc(C[N@@H+](C)[C@@H](C)c2ccco2)c(C)o1 ZINC000131104374 591553715 /nfs/dbraw/zinc/55/37/15/591553715.db2.gz BUGQLZJCTIVDIL-NSHDSACASA-N 1 1 233.311 3.682 20 0 BHADMO 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ZINC000131125471 325120329 /nfs/dbraw/zinc/12/03/29/325120329.db2.gz PBOFXQJKKYATDH-UHFFFAOYSA-N 1 1 240.331 3.908 20 0 BHADMO C[C@@H](c1ccco1)[N@@H+](C)Cc1cccs1 ZINC000131136498 176032153 /nfs/dbraw/zinc/03/21/53/176032153.db2.gz OLXIPEVGQOWCDL-JTQLQIEISA-N 1 1 221.325 3.534 20 0 BHADMO CC[C@@H]1CCC[N@@H+](CCCCC(F)(F)F)C1 ZINC000131136523 325120921 /nfs/dbraw/zinc/12/09/21/325120921.db2.gz HWXXPGLHORNYFT-LLVKDONJSA-N 1 1 237.309 3.841 20 0 BHADMO C[C@H](c1ccco1)[N@@H+](C)Cc1cccs1 ZINC000131136695 177048150 /nfs/dbraw/zinc/04/81/50/177048150.db2.gz OLXIPEVGQOWCDL-SNVBAGLBSA-N 1 1 221.325 3.534 20 0 BHADMO CC[C@H]1CCC[N@@H+](CCCCC(F)(F)F)C1 ZINC000131136696 325120662 /nfs/dbraw/zinc/12/06/62/325120662.db2.gz HWXXPGLHORNYFT-NSHDSACASA-N 1 1 237.309 3.841 20 0 BHADMO C[C@@H](c1ccco1)[N@@H+](C)Cc1ccsc1 ZINC000131137421 176032210 /nfs/dbraw/zinc/03/22/10/176032210.db2.gz PGXZLHZCZGWHLD-JTQLQIEISA-N 1 1 221.325 3.534 20 0 BHADMO C[C@H](c1ccco1)[N@@H+](C)Cc1ccsc1 ZINC000131137632 177048006 /nfs/dbraw/zinc/04/80/06/177048006.db2.gz PGXZLHZCZGWHLD-SNVBAGLBSA-N 1 1 221.325 3.534 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@@H](C)c2ccco2)cc1F ZINC000131137871 325121050 /nfs/dbraw/zinc/12/10/50/325121050.db2.gz DGFIAXKCXOFNBN-LBPRGKRZSA-N 1 1 247.313 3.920 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@H](C)c2ccco2)cc1F ZINC000131138106 325120829 /nfs/dbraw/zinc/12/08/29/325120829.db2.gz DGFIAXKCXOFNBN-GFCCVEGCSA-N 1 1 247.313 3.920 20 0 BHADMO COCc1ccc([C@@H]2CCC[N@H+]2C2CCCC2)o1 ZINC000131167377 385313945 /nfs/dbraw/zinc/31/39/45/385313945.db2.gz PGXBJPDZTOADFL-AWEZNQCLSA-N 1 1 249.354 3.506 20 0 BHADMO COCc1ccc([C@H]2CCC[N@H+]2C2CCCC2)o1 ZINC000131167581 385314935 /nfs/dbraw/zinc/31/49/35/385314935.db2.gz PGXBJPDZTOADFL-CQSZACIVSA-N 1 1 249.354 3.506 20 0 BHADMO CCc1ccc(CNc2cccc(C)[nH+]2)s1 ZINC000131169772 386197788 /nfs/dbraw/zinc/19/77/88/386197788.db2.gz STUPOMLDKWVCRB-UHFFFAOYSA-N 1 1 232.352 3.626 20 0 BHADMO Cc1ccc(NCc2cnc(C(C)C)s2)[nH+]c1 ZINC000131232668 591574111 /nfs/dbraw/zinc/57/41/11/591574111.db2.gz RTFJKCAEFBXTSV-UHFFFAOYSA-N 1 1 247.367 3.582 20 0 BHADMO Cc1ccc(C[N@@H+](C)CCCCC(F)(F)F)o1 ZINC000131238113 385322013 /nfs/dbraw/zinc/32/20/13/385322013.db2.gz KOZVWEINCLEYII-UHFFFAOYSA-N 1 1 249.276 3.752 20 0 BHADMO C[N@@H+](CCCCC(F)(F)F)Cc1ccccc1 ZINC000131244557 385321175 /nfs/dbraw/zinc/32/11/75/385321175.db2.gz LXESJDMAVXRVCB-UHFFFAOYSA-N 1 1 245.288 3.851 20 0 BHADMO CC[C@@H]1CCCC[N@H+]1CCCCC(F)(F)F ZINC000131245893 325128815 /nfs/dbraw/zinc/12/88/15/325128815.db2.gz OSVWAYMPYOFDDP-LLVKDONJSA-N 1 1 237.309 3.984 20 0 BHADMO CC[C@H]1CCCC[N@H+]1CCCCC(F)(F)F ZINC000131246129 325128696 /nfs/dbraw/zinc/12/86/96/325128696.db2.gz OSVWAYMPYOFDDP-NSHDSACASA-N 1 1 237.309 3.984 20 0 BHADMO COc1ccc(CCC[N@@H+](C)C2CCCC2)cc1 ZINC000131248024 325128824 /nfs/dbraw/zinc/12/88/24/325128824.db2.gz UFDFPTQSLDFWGY-UHFFFAOYSA-N 1 1 247.382 3.502 20 0 BHADMO C[N@@H+](CCCCC(F)(F)F)C1CCCCC1 ZINC000131253966 325130527 /nfs/dbraw/zinc/13/05/27/325130527.db2.gz WXQJANHMLJDKIE-UHFFFAOYSA-N 1 1 237.309 3.984 20 0 BHADMO C[C@@H]1C[C@H](C)C[N@H+](CCCCC(F)(F)F)C1 ZINC000131271194 325133504 /nfs/dbraw/zinc/13/35/04/325133504.db2.gz IJZJOBUIGQYOAU-PHIMTYICSA-N 1 1 237.309 3.697 20 0 BHADMO C[C@@H]1CCCC[N@H+]1CCCCC(F)(F)F ZINC000131307222 325135689 /nfs/dbraw/zinc/13/56/89/325135689.db2.gz NOHFFNZQAUUGAQ-SNVBAGLBSA-N 1 1 223.282 3.593 20 0 BHADMO C[C@H]1CCCC[N@H+]1CCCCC(F)(F)F ZINC000131307445 325135808 /nfs/dbraw/zinc/13/58/08/325135808.db2.gz NOHFFNZQAUUGAQ-JTQLQIEISA-N 1 1 223.282 3.593 20 0 BHADMO C[N@@H+](Cc1ccc(O)cc1)C1CCCCCC1 ZINC000131422258 490636551 /nfs/dbraw/zinc/63/65/51/490636551.db2.gz PNINPPIWINROJL-UHFFFAOYSA-N 1 1 233.355 3.547 20 0 BHADMO Oc1ccc(C[N@H+]2CCC[C@@H]2C2CCCC2)cc1 ZINC000131427503 490534673 /nfs/dbraw/zinc/53/46/73/490534673.db2.gz YPTMNJIMOWKXEX-MRXNPFEDSA-N 1 1 245.366 3.547 20 0 BHADMO Oc1ccc(C[N@H+]2CCC[C@H]2C2CCCC2)cc1 ZINC000131427739 490638336 /nfs/dbraw/zinc/63/83/36/490638336.db2.gz YPTMNJIMOWKXEX-INIZCTEOSA-N 1 1 245.366 3.547 20 0 BHADMO CCCCC[N@@H+](Cc1ccc(O)cc1)C(C)C ZINC000131432872 490637884 /nfs/dbraw/zinc/63/78/84/490637884.db2.gz NDZRTQCVYRPZHI-UHFFFAOYSA-N 1 1 235.371 3.793 20 0 BHADMO CCC1CCC([N@@H+](C)Cc2ccc(O)cc2)CC1 ZINC000131436460 490638106 /nfs/dbraw/zinc/63/81/06/490638106.db2.gz MCQFSWXNZIOUQC-UHFFFAOYSA-N 1 1 247.382 3.793 20 0 BHADMO CC(C)C[N@@H+](Cc1ccc(O)cc1)C1CCCC1 ZINC000131457224 490641145 /nfs/dbraw/zinc/64/11/45/490641145.db2.gz QCGMWFOZZKJKRO-UHFFFAOYSA-N 1 1 247.382 3.793 20 0 BHADMO C[N@@H+](Cc1ccc(O)cc1)C1CCC(C)(C)CC1 ZINC000131458098 490640263 /nfs/dbraw/zinc/64/02/63/490640263.db2.gz XODFKDFHJOFPLF-UHFFFAOYSA-N 1 1 247.382 3.793 20 0 BHADMO CC(C)[C@@H](c1ccccc1)[N@@H+](C)CCCF ZINC000131483180 325155599 /nfs/dbraw/zinc/15/55/99/325155599.db2.gz BJKQOGWJJRZXHS-AWEZNQCLSA-N 1 1 223.335 3.675 20 0 BHADMO CC(C)[C@H](c1ccccc1)[N@@H+](C)CCCF ZINC000131483392 325155459 /nfs/dbraw/zinc/15/54/59/325155459.db2.gz BJKQOGWJJRZXHS-CQSZACIVSA-N 1 1 223.335 3.675 20 0 BHADMO CCS[C@@H]1CCCC[N@H+](C2CCCC2)C1 ZINC000131567026 325164858 /nfs/dbraw/zinc/16/48/58/325164858.db2.gz FZVYALGETNYCHC-CYBMUJFWSA-N 1 1 227.417 3.537 20 0 BHADMO CCS[C@H]1CCCC[N@H+](C2CCCC2)C1 ZINC000131567226 325164782 /nfs/dbraw/zinc/16/47/82/325164782.db2.gz FZVYALGETNYCHC-ZDUSSCGKSA-N 1 1 227.417 3.537 20 0 BHADMO CC(C)C[NH2+]CC(F)(F)c1ccc(Cl)cc1 ZINC000131765120 345307750 /nfs/dbraw/zinc/30/77/50/345307750.db2.gz HMNLDWIDONZVPA-UHFFFAOYSA-N 1 1 247.716 3.677 20 0 BHADMO C[N@@H+](CCc1ccccc1F)Cc1ccsc1 ZINC000131800870 490657704 /nfs/dbraw/zinc/65/77/04/490657704.db2.gz JKSWDRUYSDCLSI-UHFFFAOYSA-N 1 1 249.354 3.562 20 0 BHADMO Cc1ccc([C@@H]2CCC[N@H+]2CCCF)s1 ZINC000131877193 358698835 /nfs/dbraw/zinc/69/88/35/358698835.db2.gz UWXZKYCKFJDAOQ-NSHDSACASA-N 1 1 227.348 3.553 20 0 BHADMO Cc1ccc([C@H]2CCC[N@H+]2CCCF)s1 ZINC000131877373 358698918 /nfs/dbraw/zinc/69/89/18/358698918.db2.gz UWXZKYCKFJDAOQ-LLVKDONJSA-N 1 1 227.348 3.553 20 0 BHADMO CC(C)CC[C@H](C)[NH2+][C@@H]1C[C@H](N)c2ccccc21 ZINC000131926489 358701415 /nfs/dbraw/zinc/70/14/15/358701415.db2.gz KSCDJGWRTKJQPK-VBNZEHGJSA-N 1 1 246.398 3.546 20 0 BHADMO CC(C)CC[C@H](C)[NH2+][C@H]1C[C@H](N)c2ccccc21 ZINC000131926904 358701307 /nfs/dbraw/zinc/70/13/07/358701307.db2.gz KSCDJGWRTKJQPK-RCBQFDQVSA-N 1 1 246.398 3.546 20 0 BHADMO CCCCC[C@H](C)[NH2+][C@@H]1C[C@H](N)c2ccccc21 ZINC000131979686 591682676 /nfs/dbraw/zinc/68/26/76/591682676.db2.gz KYFAMNFHXROHIB-VBNZEHGJSA-N 1 1 246.398 3.690 20 0 BHADMO CCCCC[C@H](C)[NH2+][C@H]1C[C@H](N)c2ccccc21 ZINC000131980115 591681986 /nfs/dbraw/zinc/68/19/86/591681986.db2.gz KYFAMNFHXROHIB-RCBQFDQVSA-N 1 1 246.398 3.690 20 0 BHADMO CC(C)C[N@@H+](CCCCC(F)(F)F)C1CC1 ZINC000132067664 325196764 /nfs/dbraw/zinc/19/67/64/325196764.db2.gz LGCXVILYJPKQPG-UHFFFAOYSA-N 1 1 237.309 3.839 20 0 BHADMO CC[N@@H+](CCCCC(F)(F)F)CC(C)C ZINC000132092641 325198218 /nfs/dbraw/zinc/19/82/18/325198218.db2.gz CWWOJWGAIWJZMX-UHFFFAOYSA-N 1 1 225.298 3.697 20 0 BHADMO CC[N@@H+](Cc1ccccc1)[C@@H](C)c1ccccn1 ZINC000132099112 325199269 /nfs/dbraw/zinc/19/92/69/325199269.db2.gz NOCXPBXICIYQCF-AWEZNQCLSA-N 1 1 240.350 3.665 20 0 BHADMO CC[N@@H+](Cc1ccccc1)[C@H](C)c1ccccn1 ZINC000132099306 324113817 /nfs/dbraw/zinc/11/38/17/324113817.db2.gz NOCXPBXICIYQCF-CQSZACIVSA-N 1 1 240.350 3.665 20 0 BHADMO CC[C@H](C)C[C@H](C)[NH2+][C@@H]1C[C@H](N)c2ccccc21 ZINC000132153927 358708779 /nfs/dbraw/zinc/70/87/79/358708779.db2.gz AKTJXKXHGSVWQO-GVAFMPQTSA-N 1 1 246.398 3.546 20 0 BHADMO CC(C)[N@@H+](CCCCC(F)(F)F)C1CC1 ZINC000132328305 325211822 /nfs/dbraw/zinc/21/18/22/325211822.db2.gz AMGQYMFFMCBZMI-UHFFFAOYSA-N 1 1 223.282 3.592 20 0 BHADMO C[C@@H]1CC[C@H]([NH2+]CC(F)(F)c2ccccc2)C1 ZINC000132355631 191030751 /nfs/dbraw/zinc/03/07/51/191030751.db2.gz YAKCXUVHULXTRU-YPMHNXCESA-N 1 1 239.309 3.557 20 0 BHADMO C[C@H]1CC[C@H]([NH2+]CC(F)(F)c2ccccc2)C1 ZINC000132355851 191030819 /nfs/dbraw/zinc/03/08/19/191030819.db2.gz YAKCXUVHULXTRU-AAEUAGOBSA-N 1 1 239.309 3.557 20 0 BHADMO C[C@@H]1CC[C@@H]([NH2+]CC(F)(F)c2ccccc2)C1 ZINC000132356056 191030865 /nfs/dbraw/zinc/03/08/65/191030865.db2.gz YAKCXUVHULXTRU-DGCLKSJQSA-N 1 1 239.309 3.557 20 0 BHADMO C[C@H]1CC[C@@H]([NH2+]CC(F)(F)c2ccccc2)C1 ZINC000132356277 191030869 /nfs/dbraw/zinc/03/08/69/191030869.db2.gz YAKCXUVHULXTRU-WCQYABFASA-N 1 1 239.309 3.557 20 0 BHADMO C[N@@H+](Cc1cccc(O)c1)C1CCCCCC1 ZINC000132358234 191030969 /nfs/dbraw/zinc/03/09/69/191030969.db2.gz KZFYYQQFYKUKJP-UHFFFAOYSA-N 1 1 233.355 3.547 20 0 BHADMO CC[N@@H+](CCCCC(F)(F)F)C1CCCC1 ZINC000132362352 344424447 /nfs/dbraw/zinc/42/44/47/344424447.db2.gz MPVUXXDKODUXQS-UHFFFAOYSA-N 1 1 237.309 3.984 20 0 BHADMO CC[N@@H+](Cc1cccs1)[C@@H](C)c1ccccn1 ZINC000132370767 345328788 /nfs/dbraw/zinc/32/87/88/345328788.db2.gz FESKFEOEGOSJHP-LBPRGKRZSA-N 1 1 246.379 3.726 20 0 BHADMO CC[N@@H+](Cc1cccs1)[C@H](C)c1ccccn1 ZINC000132370996 345328644 /nfs/dbraw/zinc/32/86/44/345328644.db2.gz FESKFEOEGOSJHP-GFCCVEGCSA-N 1 1 246.379 3.726 20 0 BHADMO Oc1cccc(C[N@H+]2CCC[C@H]3CCCC[C@@H]32)c1 ZINC000132393728 358721012 /nfs/dbraw/zinc/72/10/12/358721012.db2.gz HNLOUPFYNSKSQU-ZBFHGGJFSA-N 1 1 245.366 3.547 20 0 BHADMO Oc1cccc(C[N@H+]2CCC[C@@H]3CCCC[C@@H]32)c1 ZINC000132393954 358721130 /nfs/dbraw/zinc/72/11/30/358721130.db2.gz HNLOUPFYNSKSQU-HOCLYGCPSA-N 1 1 245.366 3.547 20 0 BHADMO Cl/C=C/C[N@H+]1CCCCC[C@H]1c1ccco1 ZINC000132533765 591716722 /nfs/dbraw/zinc/71/67/22/591716722.db2.gz WARNYTLNTZHIIP-ZCRIDZFUSA-N 1 1 239.746 3.949 20 0 BHADMO Cl/C=C/C[N@H+]1CCCCC[C@@H]1c1ccco1 ZINC000132533945 591717408 /nfs/dbraw/zinc/71/74/08/591717408.db2.gz WARNYTLNTZHIIP-FZKGZDJFSA-N 1 1 239.746 3.949 20 0 BHADMO C[C@@H](Cc1ccc(Cl)cc1)[N@@H+](C)CCCF ZINC000132602986 325228769 /nfs/dbraw/zinc/22/87/69/325228769.db2.gz GRWOOCHLBRUCRL-NSHDSACASA-N 1 1 243.753 3.562 20 0 BHADMO C[C@H](Cc1ccc(Cl)cc1)[N@@H+](C)CCCF ZINC000132603185 325228833 /nfs/dbraw/zinc/22/88/33/325228833.db2.gz GRWOOCHLBRUCRL-LLVKDONJSA-N 1 1 243.753 3.562 20 0 BHADMO FCCC[N@H+]1CCCCC[C@H]1c1ccco1 ZINC000132619234 384241490 /nfs/dbraw/zinc/24/14/90/384241490.db2.gz JTMBQFREEUPCTK-LBPRGKRZSA-N 1 1 225.307 3.556 20 0 BHADMO FCCC[N@H+]1CCCCC[C@@H]1c1ccco1 ZINC000132619457 384240956 /nfs/dbraw/zinc/24/09/56/384240956.db2.gz JTMBQFREEUPCTK-GFCCVEGCSA-N 1 1 225.307 3.556 20 0 BHADMO Cc1ccccc1[C@@H]1C[C@H](C)[N@H+](CCCF)C1 ZINC000132642377 358731640 /nfs/dbraw/zinc/73/16/40/358731640.db2.gz DBOWFJSNDMFHOH-UONOGXRCSA-N 1 1 235.346 3.532 20 0 BHADMO Cc1ccccc1[C@H]1C[C@H](C)[N@H+](CCCF)C1 ZINC000132642595 358731760 /nfs/dbraw/zinc/73/17/60/358731760.db2.gz DBOWFJSNDMFHOH-KBPBESRZSA-N 1 1 235.346 3.532 20 0 BHADMO Cc1ccccc1[C@@H]1C[C@@H](C)[N@H+](CCCF)C1 ZINC000132642799 358731753 /nfs/dbraw/zinc/73/17/53/358731753.db2.gz DBOWFJSNDMFHOH-ZIAGYGMSSA-N 1 1 235.346 3.532 20 0 BHADMO Cc1ccccc1[C@H]1C[C@@H](C)[N@H+](CCCF)C1 ZINC000132642991 358731969 /nfs/dbraw/zinc/73/19/69/358731969.db2.gz DBOWFJSNDMFHOH-KGLIPLIRSA-N 1 1 235.346 3.532 20 0 BHADMO CC(C)CC[N@@H+](C)CCCCC(F)(F)F ZINC000132741762 491138117 /nfs/dbraw/zinc/13/81/17/491138117.db2.gz HOLCGLFEZQIHFI-UHFFFAOYSA-N 1 1 225.298 3.697 20 0 BHADMO C[C@@H](c1ccccc1)[N@H+]1CCc2ccsc2C1 ZINC000132755334 325243734 /nfs/dbraw/zinc/24/37/34/325243734.db2.gz SQOKEJXDERMGCL-LBPRGKRZSA-N 1 1 243.375 3.867 20 0 BHADMO C[C@H](c1ccccc1)[N@H+]1CCc2ccsc2C1 ZINC000132755525 325243596 /nfs/dbraw/zinc/24/35/96/325243596.db2.gz SQOKEJXDERMGCL-GFCCVEGCSA-N 1 1 243.375 3.867 20 0 BHADMO Oc1cccc(C[N@H+]2CCC[C@@H]2C2CCCC2)c1 ZINC000132827981 134667501 /nfs/dbraw/zinc/66/75/01/134667501.db2.gz LQSWUOVXFDSPKC-MRXNPFEDSA-N 1 1 245.366 3.547 20 0 BHADMO Oc1cccc(C[N@H+]2CCC[C@H]2C2CCCC2)c1 ZINC000132828203 358736751 /nfs/dbraw/zinc/73/67/51/358736751.db2.gz LQSWUOVXFDSPKC-INIZCTEOSA-N 1 1 245.366 3.547 20 0 BHADMO CCC(CC)C[N@@H+](CC)Cc1cccc(O)c1 ZINC000132931217 191036551 /nfs/dbraw/zinc/03/65/51/191036551.db2.gz VFRWMAQWNNNRBO-UHFFFAOYSA-N 1 1 235.371 3.650 20 0 BHADMO CC(C)Nc1ccc([NH+]2CCC(C)CC2)cc1 ZINC000133028426 591757056 /nfs/dbraw/zinc/75/70/56/591757056.db2.gz NJKKKIWDDTVGBQ-UHFFFAOYSA-N 1 1 232.371 3.743 20 0 BHADMO Cc1ccc([C@@H]2CCCCC[N@H+]2CCCF)o1 ZINC000133181151 358747467 /nfs/dbraw/zinc/74/74/67/358747467.db2.gz LXZNBLKRLWKHOJ-ZDUSSCGKSA-N 1 1 239.334 3.865 20 0 BHADMO Cc1ccc([C@H]2CCCCC[N@H+]2CCCF)o1 ZINC000133181390 358747042 /nfs/dbraw/zinc/74/70/42/358747042.db2.gz LXZNBLKRLWKHOJ-CYBMUJFWSA-N 1 1 239.334 3.865 20 0 BHADMO CCCCC[N@@H+](Cc1cccc(O)c1)C(C)C ZINC000133255577 191038696 /nfs/dbraw/zinc/03/86/96/191038696.db2.gz IOYRTJRCEZIXMD-UHFFFAOYSA-N 1 1 235.371 3.793 20 0 BHADMO CC[N@@H+](C/C(C)=C/c1ccccc1)C1CC1 ZINC000133319992 323018637 /nfs/dbraw/zinc/01/86/37/323018637.db2.gz AZWJWXJBTQPLDE-ACCUITESSA-N 1 1 215.340 3.574 20 0 BHADMO Cc1ccc(C[N@@H+](CCCF)C2CC2)cc1C ZINC000133368511 325291068 /nfs/dbraw/zinc/29/10/68/325291068.db2.gz ZIXGVSPNYICYLI-UHFFFAOYSA-N 1 1 235.346 3.627 20 0 BHADMO Cc1cccc([C@@H]2CCC[N@H+]2CCCF)c1C ZINC000133487330 325296792 /nfs/dbraw/zinc/29/67/92/325296792.db2.gz UNOHNRGMZPBKGZ-HNNXBMFYSA-N 1 1 235.346 3.800 20 0 BHADMO Cc1cccc([C@H]2CCC[N@H+]2CCCF)c1C ZINC000133487533 325296623 /nfs/dbraw/zinc/29/66/23/325296623.db2.gz UNOHNRGMZPBKGZ-OAHLLOKOSA-N 1 1 235.346 3.800 20 0 BHADMO FCCC[N@@H+](Cc1ccoc1)C1CCCCC1 ZINC000133529306 566434408 /nfs/dbraw/zinc/43/44/08/566434408.db2.gz XJVYTECIAMWHHI-UHFFFAOYSA-N 1 1 239.334 3.774 20 0 BHADMO CCC1CCC([N@@H+](C)Cc2cccc(O)c2)CC1 ZINC000133534604 384296621 /nfs/dbraw/zinc/29/66/21/384296621.db2.gz YVDLTXCRHJOHOX-UHFFFAOYSA-N 1 1 247.382 3.793 20 0 BHADMO Cc1cc(C[N@@H+]2CCC[C@H](C)[C@@H]2C)cc(C)c1O ZINC000133724751 191043136 /nfs/dbraw/zinc/04/31/36/191043136.db2.gz HRJOCBXQZLELND-FZMZJTMJSA-N 1 1 247.382 3.629 20 0 BHADMO Cc1cc(C[N@@H+]2CCC[C@@H](C)[C@@H]2C)cc(C)c1O ZINC000133724956 191042954 /nfs/dbraw/zinc/04/29/54/191042954.db2.gz HRJOCBXQZLELND-RISCZKNCSA-N 1 1 247.382 3.629 20 0 BHADMO C[C@@H]1C[C@H](c2cccc(F)c2)[N@@H+](CCCF)C1 ZINC000133818255 325321560 /nfs/dbraw/zinc/32/15/60/325321560.db2.gz LQHRSOVKWUWAIM-BXUZGUMPSA-N 1 1 239.309 3.568 20 0 BHADMO C[C@H]1C[C@H](c2cccc(F)c2)[N@@H+](CCCF)C1 ZINC000133818467 325321378 /nfs/dbraw/zinc/32/13/78/325321378.db2.gz LQHRSOVKWUWAIM-SMDDNHRTSA-N 1 1 239.309 3.568 20 0 BHADMO C[C@@H]1C[C@@H](c2cccc(F)c2)[N@@H+](CCCF)C1 ZINC000133818706 325321617 /nfs/dbraw/zinc/32/16/17/325321617.db2.gz LQHRSOVKWUWAIM-RISCZKNCSA-N 1 1 239.309 3.568 20 0 BHADMO C[C@H]1C[C@@H](c2cccc(F)c2)[N@@H+](CCCF)C1 ZINC000133818895 325321459 /nfs/dbraw/zinc/32/14/59/325321459.db2.gz LQHRSOVKWUWAIM-FZMZJTMJSA-N 1 1 239.309 3.568 20 0 BHADMO Cc1ccc(C(C)(C)C[N@@H+](C)CCCF)cc1 ZINC000133846303 325323406 /nfs/dbraw/zinc/32/34/06/325323406.db2.gz NRKZKCGENUBTKA-UHFFFAOYSA-N 1 1 237.362 3.564 20 0 BHADMO CC[C@@H](Cc1ccc(C)cc1)[N@@H+](C)CCCF ZINC000133885295 325326823 /nfs/dbraw/zinc/32/68/23/325326823.db2.gz DPFNUWYMURUXSZ-HNNXBMFYSA-N 1 1 237.362 3.608 20 0 BHADMO CC[C@H](Cc1ccc(C)cc1)[N@@H+](C)CCCF ZINC000133885529 325326750 /nfs/dbraw/zinc/32/67/50/325326750.db2.gz DPFNUWYMURUXSZ-OAHLLOKOSA-N 1 1 237.362 3.608 20 0 BHADMO C[C@@H]1C[C@H](c2ccccc2F)[N@@H+](CCCF)C1 ZINC000133925460 358772328 /nfs/dbraw/zinc/77/23/28/358772328.db2.gz HCMOUDFJPUSJFW-BXUZGUMPSA-N 1 1 239.309 3.568 20 0 BHADMO C[C@H]1C[C@H](c2ccccc2F)[N@@H+](CCCF)C1 ZINC000133925688 358772544 /nfs/dbraw/zinc/77/25/44/358772544.db2.gz HCMOUDFJPUSJFW-SMDDNHRTSA-N 1 1 239.309 3.568 20 0 BHADMO C[C@@H]1C[C@@H](c2ccccc2F)[N@@H+](CCCF)C1 ZINC000133925860 358772283 /nfs/dbraw/zinc/77/22/83/358772283.db2.gz HCMOUDFJPUSJFW-RISCZKNCSA-N 1 1 239.309 3.568 20 0 BHADMO C[C@H]1C[C@@H](c2ccccc2F)[N@@H+](CCCF)C1 ZINC000133926084 358772009 /nfs/dbraw/zinc/77/20/09/358772009.db2.gz HCMOUDFJPUSJFW-FZMZJTMJSA-N 1 1 239.309 3.568 20 0 BHADMO Cc1cc[nH+]c(N[C@@H](C)CSC(C)(C)C)c1 ZINC000134071094 591880899 /nfs/dbraw/zinc/88/08/99/591880899.db2.gz HQUMFIFTTDUZKW-NSHDSACASA-N 1 1 238.400 3.722 20 0 BHADMO Cc1cc[nH+]c(N[C@H](C)CSC(C)(C)C)c1 ZINC000134071307 591880933 /nfs/dbraw/zinc/88/09/33/591880933.db2.gz HQUMFIFTTDUZKW-LLVKDONJSA-N 1 1 238.400 3.722 20 0 BHADMO CC(C)=CCC[C@H](C)Nc1cc(C)cc[nH+]1 ZINC000134073608 325341309 /nfs/dbraw/zinc/34/13/09/325341309.db2.gz RRRKYYTZKFADFQ-ZDUSSCGKSA-N 1 1 218.344 3.937 20 0 BHADMO CC(C)=CCC[C@@H](C)Nc1cc(C)cc[nH+]1 ZINC000134073811 325341576 /nfs/dbraw/zinc/34/15/76/325341576.db2.gz RRRKYYTZKFADFQ-CYBMUJFWSA-N 1 1 218.344 3.937 20 0 BHADMO Cc1ccsc1[C@H](C)Nc1cc(C)cc[nH+]1 ZINC000134074425 384331274 /nfs/dbraw/zinc/33/12/74/384331274.db2.gz CZDPSVJAEAJYBA-NSHDSACASA-N 1 1 232.352 3.933 20 0 BHADMO Cc1ccsc1[C@@H](C)Nc1cc(C)cc[nH+]1 ZINC000134074654 384331608 /nfs/dbraw/zinc/33/16/08/384331608.db2.gz CZDPSVJAEAJYBA-LLVKDONJSA-N 1 1 232.352 3.933 20 0 BHADMO CC(C)=CCC[C@H](C)Nc1cccc(C)[nH+]1 ZINC000134164951 325346537 /nfs/dbraw/zinc/34/65/37/325346537.db2.gz XRIGBRAIOMMPCI-LBPRGKRZSA-N 1 1 218.344 3.937 20 0 BHADMO CC(C)=CCC[C@@H](C)Nc1cccc(C)[nH+]1 ZINC000134165134 325346172 /nfs/dbraw/zinc/34/61/72/325346172.db2.gz XRIGBRAIOMMPCI-GFCCVEGCSA-N 1 1 218.344 3.937 20 0 BHADMO CC(C)=CCC[C@H](C)Nc1ccc(C)c[nH+]1 ZINC000134178496 325347335 /nfs/dbraw/zinc/34/73/35/325347335.db2.gz XSQFDGQVFNUVTH-ZDUSSCGKSA-N 1 1 218.344 3.937 20 0 BHADMO CC(C)=CCC[C@@H](C)Nc1ccc(C)c[nH+]1 ZINC000134178680 325347234 /nfs/dbraw/zinc/34/72/34/325347234.db2.gz XSQFDGQVFNUVTH-CYBMUJFWSA-N 1 1 218.344 3.937 20 0 BHADMO Cc1cccc([C@@H](C)[NH2+][C@@H](C)c2nccs2)c1 ZINC000134218467 358783818 /nfs/dbraw/zinc/78/38/18/358783818.db2.gz OFWSFPFNZMXYLW-NEPJUHHUSA-N 1 1 246.379 3.863 20 0 BHADMO Cc1cccc([C@H](C)[NH2+][C@@H](C)c2nccs2)c1 ZINC000134218489 134704534 /nfs/dbraw/zinc/70/45/34/134704534.db2.gz OFWSFPFNZMXYLW-RYUDHWBXSA-N 1 1 246.379 3.863 20 0 BHADMO CCOc1ccccc1[C@@H](C)[NH2+]Cc1ccoc1 ZINC000134288327 535541210 /nfs/dbraw/zinc/54/12/10/535541210.db2.gz MOOXLJGJBMLITN-GFCCVEGCSA-N 1 1 245.322 3.529 20 0 BHADMO CCOc1ccccc1[C@H](C)[NH2+]Cc1ccoc1 ZINC000134288344 358786019 /nfs/dbraw/zinc/78/60/19/358786019.db2.gz MOOXLJGJBMLITN-LBPRGKRZSA-N 1 1 245.322 3.529 20 0 BHADMO CC(C)C[N@@H+](CCc1ccncc1)CC(C)(C)C ZINC000134446451 325358919 /nfs/dbraw/zinc/35/89/19/325358919.db2.gz QRYVFPLQMWKDPG-UHFFFAOYSA-N 1 1 248.414 3.628 20 0 BHADMO CC(C)C[N@@H+](CCc1ccccn1)CC(C)(C)C ZINC000134449865 325359286 /nfs/dbraw/zinc/35/92/86/325359286.db2.gz SJKWWOZUAAWOTN-UHFFFAOYSA-N 1 1 248.414 3.628 20 0 BHADMO CC(C)C[N@@H+](Cc1ccccn1)CC(C)(C)C ZINC000134461785 358790345 /nfs/dbraw/zinc/79/03/45/358790345.db2.gz PXSHQGRUEBIBEV-UHFFFAOYSA-N 1 1 234.387 3.586 20 0 BHADMO CC(C)C[N@@H+](CCCCCCO)CC(C)(C)C ZINC000134462734 591929019 /nfs/dbraw/zinc/92/90/19/591929019.db2.gz DLGTVLPNERPZEV-UHFFFAOYSA-N 1 1 243.435 3.543 20 0 BHADMO Cc1cc([NH2+][C@@H](C)C(C)C)ccc1N(C)C ZINC000134493233 591931757 /nfs/dbraw/zinc/93/17/57/591931757.db2.gz XOWGGLXAHKXMDW-LBPRGKRZSA-N 1 1 220.360 3.517 20 0 BHADMO Cc1cc([NH2+][C@H](C)C(C)C)ccc1N(C)C ZINC000134493254 591931229 /nfs/dbraw/zinc/93/12/29/591931229.db2.gz XOWGGLXAHKXMDW-GFCCVEGCSA-N 1 1 220.360 3.517 20 0 BHADMO Cc1cnc([C@@H](C)[NH2+][C@@H](C)c2ccccc2)s1 ZINC000134898226 384396956 /nfs/dbraw/zinc/39/69/56/384396956.db2.gz YSEUGEAOZGTWEH-NWDGAFQWSA-N 1 1 246.379 3.863 20 0 BHADMO Cc1cnc([C@H](C)[NH2+][C@@H](C)c2ccccc2)s1 ZINC000134898245 384398909 /nfs/dbraw/zinc/39/89/09/384398909.db2.gz YSEUGEAOZGTWEH-RYUDHWBXSA-N 1 1 246.379 3.863 20 0 BHADMO Cc1cnc([C@@H](C)[NH2+][C@H](C)c2ccccc2)s1 ZINC000134898263 384398597 /nfs/dbraw/zinc/39/85/97/384398597.db2.gz YSEUGEAOZGTWEH-VXGBXAGGSA-N 1 1 246.379 3.863 20 0 BHADMO Cc1cnc([C@H](C)[NH2+][C@H](C)c2ccccc2)s1 ZINC000134898280 179655644 /nfs/dbraw/zinc/65/56/44/179655644.db2.gz YSEUGEAOZGTWEH-NEPJUHHUSA-N 1 1 246.379 3.863 20 0 BHADMO Cc1cnc([C@H](C)[NH2+]Cc2ccc(C)cc2)s1 ZINC000134905483 384397436 /nfs/dbraw/zinc/39/74/36/384397436.db2.gz DLTRRKWKJYRNQP-LBPRGKRZSA-N 1 1 246.379 3.611 20 0 BHADMO Cc1cnc([C@@H](C)[NH2+]Cc2ccc(C)cc2)s1 ZINC000134905502 384398680 /nfs/dbraw/zinc/39/86/80/384398680.db2.gz DLTRRKWKJYRNQP-GFCCVEGCSA-N 1 1 246.379 3.611 20 0 BHADMO Cc1cnc([C@H](C)[NH2+]Cc2cccc(C)c2)s1 ZINC000134905995 179098613 /nfs/dbraw/zinc/09/86/13/179098613.db2.gz NFOUDIKHYBZLCZ-LBPRGKRZSA-N 1 1 246.379 3.611 20 0 BHADMO Cc1cnc([C@@H](C)[NH2+]Cc2cccc(C)c2)s1 ZINC000134906013 179100718 /nfs/dbraw/zinc/10/07/18/179100718.db2.gz NFOUDIKHYBZLCZ-GFCCVEGCSA-N 1 1 246.379 3.611 20 0 BHADMO Cc1cnc([C@H](C)[NH2+]Cc2ccccc2C)s1 ZINC000134912452 358811109 /nfs/dbraw/zinc/81/11/09/358811109.db2.gz NLJPCZUORAKUGR-LBPRGKRZSA-N 1 1 246.379 3.611 20 0 BHADMO Cc1cnc([C@@H](C)[NH2+]Cc2ccccc2C)s1 ZINC000134912472 358810724 /nfs/dbraw/zinc/81/07/24/358810724.db2.gz NLJPCZUORAKUGR-GFCCVEGCSA-N 1 1 246.379 3.611 20 0 BHADMO C[C@@H](CNc1cc[nH+]cc1Cl)c1ccccc1 ZINC000134922928 325382857 /nfs/dbraw/zinc/38/28/57/325382857.db2.gz UKCGQECQTFUZKZ-NSHDSACASA-N 1 1 246.741 3.951 20 0 BHADMO C[C@H](CNc1cc[nH+]cc1Cl)c1ccccc1 ZINC000134922944 325382723 /nfs/dbraw/zinc/38/27/23/325382723.db2.gz UKCGQECQTFUZKZ-LLVKDONJSA-N 1 1 246.741 3.951 20 0 BHADMO CCC[N@@H+](Cc1nccs1)Cc1ccccc1 ZINC000134952467 169177895 /nfs/dbraw/zinc/17/78/95/169177895.db2.gz RMLTWHHNZOPQNW-UHFFFAOYSA-N 1 1 246.379 3.555 20 0 BHADMO CCC[N@H+](Cc1nccs1)Cc1ccccc1 ZINC000134952467 169177893 /nfs/dbraw/zinc/17/78/93/169177893.db2.gz RMLTWHHNZOPQNW-UHFFFAOYSA-N 1 1 246.379 3.555 20 0 BHADMO CC(C)C[N@@H+](Cc1cccnc1)CC(C)(C)C ZINC000134956659 358812943 /nfs/dbraw/zinc/81/29/43/358812943.db2.gz KORGPFQIERUFHP-UHFFFAOYSA-N 1 1 234.387 3.586 20 0 BHADMO CC(C)C[N@@H+](Cc1ccncc1)CC(C)(C)C ZINC000134957385 358812465 /nfs/dbraw/zinc/81/24/65/358812465.db2.gz OZRNVKOLJALCGO-UHFFFAOYSA-N 1 1 234.387 3.586 20 0 BHADMO CCCCC[N@@H+](Cc1nccs1)C(C)C ZINC000134980109 384404736 /nfs/dbraw/zinc/40/47/36/384404736.db2.gz BZBOLPGWICNINK-UHFFFAOYSA-N 1 1 226.389 3.544 20 0 BHADMO Cc1ccc([C@@H](C)[N@@H+](C)Cc2nccs2)cc1 ZINC000134990295 384404498 /nfs/dbraw/zinc/40/44/98/384404498.db2.gz GZPGIFFOOHBOSB-GFCCVEGCSA-N 1 1 246.379 3.645 20 0 BHADMO Cc1ccc([C@@H](C)[N@H+](C)Cc2nccs2)cc1 ZINC000134990295 384404495 /nfs/dbraw/zinc/40/44/95/384404495.db2.gz GZPGIFFOOHBOSB-GFCCVEGCSA-N 1 1 246.379 3.645 20 0 BHADMO Cc1ccc([C@H](C)[N@@H+](C)Cc2nccs2)cc1 ZINC000134990314 384403259 /nfs/dbraw/zinc/40/32/59/384403259.db2.gz GZPGIFFOOHBOSB-LBPRGKRZSA-N 1 1 246.379 3.645 20 0 BHADMO Cc1ccc([C@H](C)[N@H+](C)Cc2nccs2)cc1 ZINC000134990314 384403252 /nfs/dbraw/zinc/40/32/52/384403252.db2.gz GZPGIFFOOHBOSB-LBPRGKRZSA-N 1 1 246.379 3.645 20 0 BHADMO C[N@@H+](Cc1nccs1)C1CCCCCCC1 ZINC000135014882 591973153 /nfs/dbraw/zinc/97/31/53/591973153.db2.gz VWKXAYBXDPRQOS-UHFFFAOYSA-N 1 1 238.400 3.688 20 0 BHADMO CC[C@@H](C)[C@@H](C)[N@@H+](Cc1nccs1)C1CC1 ZINC000135046263 358818036 /nfs/dbraw/zinc/81/80/36/358818036.db2.gz FXMXJMGDTLHUOG-GHMZBOCLSA-N 1 1 238.400 3.542 20 0 BHADMO CC[C@H](C)[C@@H](C)[N@@H+](Cc1nccs1)C1CC1 ZINC000135046282 358817892 /nfs/dbraw/zinc/81/78/92/358817892.db2.gz FXMXJMGDTLHUOG-WDEREUQCSA-N 1 1 238.400 3.542 20 0 BHADMO CC[C@@H](C)[C@H](C)[N@@H+](Cc1nccs1)C1CC1 ZINC000135046306 358818100 /nfs/dbraw/zinc/81/81/00/358818100.db2.gz FXMXJMGDTLHUOG-MNOVXSKESA-N 1 1 238.400 3.542 20 0 BHADMO CC[C@H](C)[C@H](C)[N@@H+](Cc1nccs1)C1CC1 ZINC000135046323 358818172 /nfs/dbraw/zinc/81/81/72/358818172.db2.gz FXMXJMGDTLHUOG-QWRGUYRKSA-N 1 1 238.400 3.542 20 0 BHADMO Cc1ccoc1C[NH2+][C@@H](C)c1ccccc1F ZINC000135125561 384414837 /nfs/dbraw/zinc/41/48/37/384414837.db2.gz HYOBNGUJEKYTPV-NSHDSACASA-N 1 1 233.286 3.578 20 0 BHADMO Cc1ccoc1C[NH2+][C@H](C)c1ccccc1F ZINC000135125580 384416005 /nfs/dbraw/zinc/41/60/05/384416005.db2.gz HYOBNGUJEKYTPV-LLVKDONJSA-N 1 1 233.286 3.578 20 0 BHADMO Cc1nc(C[NH2+][C@@H](C)c2ccccc2)c(C)s1 ZINC000135127403 358821397 /nfs/dbraw/zinc/82/13/97/358821397.db2.gz ZVKSOHWCIWFBTC-JTQLQIEISA-N 1 1 246.379 3.611 20 0 BHADMO Cc1nc(C[NH2+][C@H](C)c2ccccc2)c(C)s1 ZINC000135127423 358821343 /nfs/dbraw/zinc/82/13/43/358821343.db2.gz ZVKSOHWCIWFBTC-SNVBAGLBSA-N 1 1 246.379 3.611 20 0 BHADMO CC(C)C[N@@H+](Cc1nccs1)CC(C)(C)C ZINC000135154144 358822103 /nfs/dbraw/zinc/82/21/03/358822103.db2.gz MZJXBWIBHMMMQG-UHFFFAOYSA-N 1 1 240.416 3.647 20 0 BHADMO CC(C)CC[C@@H]1CCC[N@H+]1Cc1nccs1 ZINC000135162666 534925102 /nfs/dbraw/zinc/92/51/02/534925102.db2.gz HQEARYPNEFBPDP-LBPRGKRZSA-N 1 1 238.400 3.544 20 0 BHADMO CC(C)CC[C@H]1CCC[N@H+]1Cc1nccs1 ZINC000135162687 358823533 /nfs/dbraw/zinc/82/35/33/358823533.db2.gz HQEARYPNEFBPDP-GFCCVEGCSA-N 1 1 238.400 3.544 20 0 BHADMO CCC[C@@H](C)[C@@H]1CCC[N@H+]1Cc1nccs1 ZINC000135162773 358823554 /nfs/dbraw/zinc/82/35/54/358823554.db2.gz MQLMEKZMXJTQGW-NEPJUHHUSA-N 1 1 238.400 3.544 20 0 BHADMO CCC[C@H](C)[C@@H]1CCC[N@H+]1Cc1nccs1 ZINC000135162797 358823038 /nfs/dbraw/zinc/82/30/38/358823038.db2.gz MQLMEKZMXJTQGW-RYUDHWBXSA-N 1 1 238.400 3.544 20 0 BHADMO CCC[C@@H](C)[C@H]1CCC[N@H+]1Cc1nccs1 ZINC000135162816 358823516 /nfs/dbraw/zinc/82/35/16/358823516.db2.gz MQLMEKZMXJTQGW-VXGBXAGGSA-N 1 1 238.400 3.544 20 0 BHADMO CCC[C@H](C)[C@H]1CCC[N@H+]1Cc1nccs1 ZINC000135162837 358823280 /nfs/dbraw/zinc/82/32/80/358823280.db2.gz MQLMEKZMXJTQGW-NWDGAFQWSA-N 1 1 238.400 3.544 20 0 BHADMO Cc1cc([C@H](C)[NH2+]Cc2occc2C)c(C)o1 ZINC000135166176 178252004 /nfs/dbraw/zinc/25/20/04/178252004.db2.gz YZYUWJLVLQKADX-NSHDSACASA-N 1 1 233.311 3.649 20 0 BHADMO Cc1cc([C@@H](C)[NH2+]Cc2occc2C)c(C)o1 ZINC000135166195 178229406 /nfs/dbraw/zinc/22/94/06/178229406.db2.gz YZYUWJLVLQKADX-LLVKDONJSA-N 1 1 233.311 3.649 20 0 BHADMO CC(C)[N@@H+](Cc1nccs1)C1CCCCC1 ZINC000135178555 325398813 /nfs/dbraw/zinc/39/88/13/325398813.db2.gz YVIVAMYCQXELRR-UHFFFAOYSA-N 1 1 238.400 3.686 20 0 BHADMO CCC[C@@H]1[C@H](C)CCC[N@H+]1Cc1nccs1 ZINC000135202852 358826543 /nfs/dbraw/zinc/82/65/43/358826543.db2.gz ZVHROPTVIVXFKE-VXGBXAGGSA-N 1 1 238.400 3.544 20 0 BHADMO CCC[C@H]1[C@H](C)CCC[N@H+]1Cc1nccs1 ZINC000135202873 358826510 /nfs/dbraw/zinc/82/65/10/358826510.db2.gz ZVHROPTVIVXFKE-NEPJUHHUSA-N 1 1 238.400 3.544 20 0 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/nfs/dbraw/zinc/94/97/28/635949728.db2.gz CABLVNHZYQFMHJ-OAHLLOKOSA-N 1 1 247.382 3.829 20 0 BHADMO C[N@@H+](CCCCC(F)(F)F)CC1CCCC1 ZINC000151568353 323019056 /nfs/dbraw/zinc/01/90/56/323019056.db2.gz XFXPXAQYEIOVMW-UHFFFAOYSA-N 1 1 237.309 3.841 20 0 BHADMO C[N@@H+](CCCCC(F)(F)F)C(C1CC1)C1CC1 ZINC000151612355 323020705 /nfs/dbraw/zinc/02/07/05/323020705.db2.gz IUJAFEOYSOEKHX-UHFFFAOYSA-N 1 1 249.320 3.839 20 0 BHADMO FC(F)(F)CCCC[N@H+]1CC[C@@H]2CCCC[C@@H]21 ZINC000151674574 343407189 /nfs/dbraw/zinc/40/71/89/343407189.db2.gz ZASJNPPCXSTQSD-RYUDHWBXSA-N 1 1 249.320 3.984 20 0 BHADMO CC(C)[N@@H+](Cc1cccs1)C1CCCC1 ZINC000151727583 323025255 /nfs/dbraw/zinc/02/52/55/323025255.db2.gz DKGMFFRFSBXPAP-UHFFFAOYSA-N 1 1 223.385 3.901 20 0 BHADMO CC[C@@H](Cc1ccccc1)[N@@H+](CC)CCCF ZINC000151857238 323030706 /nfs/dbraw/zinc/03/07/06/323030706.db2.gz WJGUOWSLEZWUME-HNNXBMFYSA-N 1 1 237.362 3.689 20 0 BHADMO CC[C@H](Cc1ccccc1)[N@@H+](CC)CCCF ZINC000151857313 323030803 /nfs/dbraw/zinc/03/08/03/323030803.db2.gz WJGUOWSLEZWUME-OAHLLOKOSA-N 1 1 237.362 3.689 20 0 BHADMO CC(C)(C)[N@@H+](CCCF)Cc1ccccc1 ZINC000151937220 398324906 /nfs/dbraw/zinc/32/49/06/398324906.db2.gz WVBQZZYCVPSIIY-UHFFFAOYSA-N 1 1 223.335 3.647 20 0 BHADMO CC(C)(C)[N@@H+](CCCF)Cc1ccc(F)cc1 ZINC000151949047 323044191 /nfs/dbraw/zinc/04/41/91/323044191.db2.gz ZMEPYPOSOCMISV-UHFFFAOYSA-N 1 1 241.325 3.786 20 0 BHADMO CC1(C)Cc2occc2[C@H]([NH2+]Cc2ccco2)C1 ZINC000152032483 188157349 /nfs/dbraw/zinc/15/73/49/188157349.db2.gz VSXHWRYVNYXDLU-CYBMUJFWSA-N 1 1 245.322 3.676 20 0 BHADMO CC1(C)Cc2occc2[C@@H]([NH2+]Cc2ccco2)C1 ZINC000152032550 385147671 /nfs/dbraw/zinc/14/76/71/385147671.db2.gz VSXHWRYVNYXDLU-ZDUSSCGKSA-N 1 1 245.322 3.676 20 0 BHADMO c1c[nH]c([C@@H]2CCCC[N@@H+]2CC2CCCCC2)n1 ZINC000152043077 384922770 /nfs/dbraw/zinc/92/27/70/384922770.db2.gz BSPWGACXRIHKQN-AWEZNQCLSA-N 1 1 247.386 3.517 20 0 BHADMO c1c[nH]c([C@H]2CCCC[N@@H+]2CC2CCCCC2)n1 ZINC000152043157 183327665 /nfs/dbraw/zinc/32/76/65/183327665.db2.gz BSPWGACXRIHKQN-CQSZACIVSA-N 1 1 247.386 3.517 20 0 BHADMO CCC[N@@H+](CCCCC(F)(F)F)CC(F)F ZINC000152121210 323045151 /nfs/dbraw/zinc/04/51/51/323045151.db2.gz HOLNJOBPZXHMKH-UHFFFAOYSA-N 1 1 247.251 3.696 20 0 BHADMO CCC[N@H+](CCCCC(F)(F)F)CC(F)F ZINC000152121210 323045150 /nfs/dbraw/zinc/04/51/50/323045150.db2.gz HOLNJOBPZXHMKH-UHFFFAOYSA-N 1 1 247.251 3.696 20 0 BHADMO CC[N@@H+](CCCCC(F)(F)F)Cc1ccoc1 ZINC000152182388 538092015 /nfs/dbraw/zinc/09/20/15/538092015.db2.gz COWAOJRBLFQUAW-UHFFFAOYSA-N 1 1 249.276 3.834 20 0 BHADMO CCC[N@@H+](C)[C@@H](C)c1ncc(-c2ccccc2)o1 ZINC000152201853 169087207 /nfs/dbraw/zinc/08/72/07/169087207.db2.gz JTGDCNOAQQMPJF-LBPRGKRZSA-N 1 1 244.338 3.744 20 0 BHADMO CCC[N@@H+](C)[C@H](C)c1ncc(-c2ccccc2)o1 ZINC000152201922 169087461 /nfs/dbraw/zinc/08/74/61/169087461.db2.gz JTGDCNOAQQMPJF-GFCCVEGCSA-N 1 1 244.338 3.744 20 0 BHADMO COCCCC[N@@H+](Cc1ccccc1)C(C)(C)C ZINC000152299777 385085736 /nfs/dbraw/zinc/08/57/36/385085736.db2.gz RWTLTKRYJFBPRV-UHFFFAOYSA-N 1 1 249.398 3.714 20 0 BHADMO FC(F)(F)CCCC[N@H+]1CCC[C@H]1C1CCC1 ZINC000152347002 323177424 /nfs/dbraw/zinc/17/74/24/323177424.db2.gz SBXLLTNSUQBBMI-LBPRGKRZSA-N 1 1 249.320 3.984 20 0 BHADMO FC(F)(F)CCCC[N@H+]1CCC[C@@H]1C1CCC1 ZINC000152347096 323177462 /nfs/dbraw/zinc/17/74/62/323177462.db2.gz SBXLLTNSUQBBMI-GFCCVEGCSA-N 1 1 249.320 3.984 20 0 BHADMO CC1(C)CCC[N@H+]1CCCCC(F)(F)F ZINC000152361103 323178298 /nfs/dbraw/zinc/17/82/98/323178298.db2.gz YEUOMXYUYIHGBV-UHFFFAOYSA-N 1 1 223.282 3.593 20 0 BHADMO CCc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccccn2)o1 ZINC000152427132 385179976 /nfs/dbraw/zinc/17/99/76/385179976.db2.gz SLBCQYGFENOJSL-NWDGAFQWSA-N 1 1 244.338 3.649 20 0 BHADMO CCc1ccc([C@H](C)[NH2+][C@@H](C)c2ccccn2)o1 ZINC000152427211 385182127 /nfs/dbraw/zinc/18/21/27/385182127.db2.gz SLBCQYGFENOJSL-RYUDHWBXSA-N 1 1 244.338 3.649 20 0 BHADMO CCc1ccc([C@@H](C)[NH2+][C@H](C)c2ccccn2)o1 ZINC000152427299 385179528 /nfs/dbraw/zinc/17/95/28/385179528.db2.gz SLBCQYGFENOJSL-VXGBXAGGSA-N 1 1 244.338 3.649 20 0 BHADMO CCc1ccc([C@H](C)[NH2+][C@H](C)c2ccccn2)o1 ZINC000152427382 385180542 /nfs/dbraw/zinc/18/05/42/385180542.db2.gz SLBCQYGFENOJSL-NEPJUHHUSA-N 1 1 244.338 3.649 20 0 BHADMO CCC[N@@H+](CCCCC(F)(F)F)C1CC1 ZINC000152447130 323324036 /nfs/dbraw/zinc/32/40/36/323324036.db2.gz SUAWZHQYDBPPPL-UHFFFAOYSA-N 1 1 223.282 3.593 20 0 BHADMO C[C@@H](c1ccccc1F)[N@H+]1C[C@@H]2CCC[C@@H]2C1 ZINC000152852851 388888832 /nfs/dbraw/zinc/88/88/32/388888832.db2.gz QHWHUNTTYSZKED-RWMBFGLXSA-N 1 1 233.330 3.619 20 0 BHADMO C[C@H](c1ccccc1F)[N@H+]1C[C@@H]2CCC[C@@H]2C1 ZINC000152852960 388888301 /nfs/dbraw/zinc/88/83/01/388888301.db2.gz QHWHUNTTYSZKED-UPJWGTAASA-N 1 1 233.330 3.619 20 0 BHADMO Cc1ccc(C[NH2+]C2(c3cccc(F)c3)CC2)o1 ZINC000152862964 385219795 /nfs/dbraw/zinc/21/97/95/385219795.db2.gz FOELHTGYJJHIIC-UHFFFAOYSA-N 1 1 245.297 3.506 20 0 BHADMO C[C@@H](c1ccc(F)cc1)[N@H+]1C[C@@H]2CCC[C@@H]2C1 ZINC000152915507 388894566 /nfs/dbraw/zinc/89/45/66/388894566.db2.gz XAGXDBKOMDLBEI-FPMFFAJLSA-N 1 1 233.330 3.619 20 0 BHADMO C[C@H](c1ccc(F)cc1)[N@H+]1C[C@@H]2CCC[C@@H]2C1 ZINC000152915600 388893951 /nfs/dbraw/zinc/89/39/51/388893951.db2.gz XAGXDBKOMDLBEI-BNOWGMLFSA-N 1 1 233.330 3.619 20 0 BHADMO FC(F)(F)CCCC[NH+]1Cc2ccccc2C1 ZINC000153046231 385233268 /nfs/dbraw/zinc/23/32/68/385233268.db2.gz BNWYYWTZHBDMIV-UHFFFAOYSA-N 1 1 243.272 3.735 20 0 BHADMO CC[C@@H]1CCCC[N@H+]1Cc1cccs1 ZINC000153117556 323049869 /nfs/dbraw/zinc/04/98/69/323049869.db2.gz HWEHJFFRMYPTOU-LLVKDONJSA-N 1 1 209.358 3.513 20 0 BHADMO CC[C@H]1CCCC[N@H+]1Cc1cccs1 ZINC000153117637 388941639 /nfs/dbraw/zinc/94/16/39/388941639.db2.gz HWEHJFFRMYPTOU-NSHDSACASA-N 1 1 209.358 3.513 20 0 BHADMO C[N@@H+](Cc1cccs1)C1CCCCC1 ZINC000153118601 201221807 /nfs/dbraw/zinc/22/18/07/201221807.db2.gz DOPWCGPMKDPJQF-UHFFFAOYSA-N 1 1 209.358 3.513 20 0 BHADMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCCCC(F)(F)F ZINC000153261560 388957527 /nfs/dbraw/zinc/95/75/27/388957527.db2.gz WQNSWUOQPWHWRR-PHIMTYICSA-N 1 1 237.309 3.982 20 0 BHADMO CC[C@@H](C)C[N@@H+](C)CCCCC(F)(F)F ZINC000153408690 323051075 /nfs/dbraw/zinc/05/10/75/323051075.db2.gz NDZWFYGXHGQEEZ-SNVBAGLBSA-N 1 1 225.298 3.697 20 0 BHADMO CC[C@H](C)C[N@@H+](C)CCCCC(F)(F)F ZINC000153408797 323051085 /nfs/dbraw/zinc/05/10/85/323051085.db2.gz NDZWFYGXHGQEEZ-JTQLQIEISA-N 1 1 225.298 3.697 20 0 BHADMO Cc1ccc(C[N@H+]2CCC3(C2)CCCCC3)nc1 ZINC000153483732 344888146 /nfs/dbraw/zinc/88/81/46/344888146.db2.gz ZMSLPOLBXPRUAD-UHFFFAOYSA-N 1 1 244.382 3.546 20 0 BHADMO Cc1ccccc1[C@@H]1CCC[N@H+]1Cc1ccco1 ZINC000153490642 388979394 /nfs/dbraw/zinc/97/93/94/388979394.db2.gz KVSCVQFEOOHZJQ-INIZCTEOSA-N 1 1 241.334 3.925 20 0 BHADMO Cc1ccccc1[C@H]1CCC[N@H+]1Cc1ccco1 ZINC000153490731 388979442 /nfs/dbraw/zinc/97/94/42/388979442.db2.gz KVSCVQFEOOHZJQ-MRXNPFEDSA-N 1 1 241.334 3.925 20 0 BHADMO Fc1cccc([C@@H]2CCC[N@H+]2Cc2ccco2)c1 ZINC000153508461 388979414 /nfs/dbraw/zinc/97/94/14/388979414.db2.gz DQPOBJUDAPWWJY-HNNXBMFYSA-N 1 1 245.297 3.756 20 0 BHADMO Fc1cccc([C@H]2CCC[N@H+]2Cc2ccco2)c1 ZINC000153508579 388979556 /nfs/dbraw/zinc/97/95/56/388979556.db2.gz DQPOBJUDAPWWJY-OAHLLOKOSA-N 1 1 245.297 3.756 20 0 BHADMO Cc1ccc(C[N@H+]2CCC[C@@H]2c2ccsc2)o1 ZINC000153537321 326100942 /nfs/dbraw/zinc/10/09/42/326100942.db2.gz IAMSGFJKWCKECX-CQSZACIVSA-N 1 1 247.363 3.987 20 0 BHADMO Cc1ccc(C[N@H+]2CCC[C@H]2c2ccsc2)o1 ZINC000153537405 326101465 /nfs/dbraw/zinc/10/14/65/326101465.db2.gz IAMSGFJKWCKECX-AWEZNQCLSA-N 1 1 247.363 3.987 20 0 BHADMO Cc1ccc(C[N@H+]2[C@H](C)C[C@H]3CCCC[C@@H]32)nc1 ZINC000153553094 326101694 /nfs/dbraw/zinc/10/16/94/326101694.db2.gz MHUFYXQHGWUEAG-FMKPAKJESA-N 1 1 244.382 3.543 20 0 BHADMO c1coc(C[N@H+]2CCC[C@@H]2c2ccsc2)c1 ZINC000153553449 385265537 /nfs/dbraw/zinc/26/55/37/385265537.db2.gz HBAQKJDCYMJTFJ-CYBMUJFWSA-N 1 1 233.336 3.678 20 0 BHADMO c1coc(C[N@H+]2CCC[C@H]2c2ccsc2)c1 ZINC000153553570 385265060 /nfs/dbraw/zinc/26/50/60/385265060.db2.gz HBAQKJDCYMJTFJ-ZDUSSCGKSA-N 1 1 233.336 3.678 20 0 BHADMO Cc1ccoc1C[N@H+]1CCC[C@@H]1c1ccsc1 ZINC000153555255 326101919 /nfs/dbraw/zinc/10/19/19/326101919.db2.gz NMRNECKXBODKIG-CYBMUJFWSA-N 1 1 247.363 3.987 20 0 BHADMO Cc1ccoc1C[N@H+]1CCC[C@H]1c1ccsc1 ZINC000153555363 326101812 /nfs/dbraw/zinc/10/18/12/326101812.db2.gz NMRNECKXBODKIG-ZDUSSCGKSA-N 1 1 247.363 3.987 20 0 BHADMO CC1(C)CCC[N@@H+](CCCCC(F)(F)F)C1 ZINC000153597087 326103250 /nfs/dbraw/zinc/10/32/50/326103250.db2.gz BIPUUJVSYJWRFI-UHFFFAOYSA-N 1 1 237.309 3.841 20 0 BHADMO CC[N@@H+](Cc1ccc(COC)cc1)C1CCCC1 ZINC000153670413 326106190 /nfs/dbraw/zinc/10/61/90/326106190.db2.gz KCFWUDBKBIHLJL-UHFFFAOYSA-N 1 1 247.382 3.598 20 0 BHADMO CC[N@@H+](Cc1ccsc1)C1CCCC1 ZINC000153681891 326107413 /nfs/dbraw/zinc/10/74/13/326107413.db2.gz IFUFKEVSIKVIDK-UHFFFAOYSA-N 1 1 209.358 3.513 20 0 BHADMO CC[N@@H+](Cc1cccc2[nH]ccc21)C1CCCC1 ZINC000153682913 326107828 /nfs/dbraw/zinc/10/78/28/326107828.db2.gz BVQVXCKDAZLQKX-UHFFFAOYSA-N 1 1 242.366 3.932 20 0 BHADMO CC[N@H+](Cc1cnc(C(C)C)s1)CC(C)C ZINC000153687908 323052778 /nfs/dbraw/zinc/05/27/78/323052778.db2.gz VWFUIHVZMHXVRC-UHFFFAOYSA-N 1 1 240.416 3.744 20 0 BHADMO CC[N@H+](Cc1ccc2ncccc2c1)CC(C)C ZINC000153690879 326107812 /nfs/dbraw/zinc/10/78/12/326107812.db2.gz AFDIPFARZHEFMC-UHFFFAOYSA-N 1 1 242.366 3.713 20 0 BHADMO C[N@@H+](Cc1ccccc1OC1CCCC1)C1CC1 ZINC000153755611 326111764 /nfs/dbraw/zinc/11/17/64/326111764.db2.gz KWTRGMIAOSDNQW-UHFFFAOYSA-N 1 1 245.366 3.602 20 0 BHADMO C[N@@H+](Cc1cccc(OC2CCCC2)c1)C1CC1 ZINC000153760543 326112086 /nfs/dbraw/zinc/11/20/86/326112086.db2.gz GYMFWKRQSTUSPO-UHFFFAOYSA-N 1 1 245.366 3.602 20 0 BHADMO C[N@@H+](Cc1cc(Cl)cc(Cl)c1)C1CC1 ZINC000153767477 326112072 /nfs/dbraw/zinc/11/20/72/326112072.db2.gz LUJSUPCPKSAEFL-UHFFFAOYSA-N 1 1 230.138 3.588 20 0 BHADMO Cc1ccc(C[N@H+]2CCC[C@@H]2C2CCCC2)cn1 ZINC000153788518 344977363 /nfs/dbraw/zinc/97/73/63/344977363.db2.gz YDYODMTYPQISPZ-MRXNPFEDSA-N 1 1 244.382 3.545 20 0 BHADMO Cc1ccc(C[N@H+]2CCC[C@H]2C2CCCC2)cn1 ZINC000153788618 344977482 /nfs/dbraw/zinc/97/74/82/344977482.db2.gz YDYODMTYPQISPZ-INIZCTEOSA-N 1 1 244.382 3.545 20 0 BHADMO Cc1ccc(C[N@H+]2CCC[C@@H]2CC(C)(C)C)cn1 ZINC000153803538 344981112 /nfs/dbraw/zinc/98/11/12/344981112.db2.gz NAEJBSILJSXJKO-OAHLLOKOSA-N 1 1 246.398 3.791 20 0 BHADMO Cc1ccc(C[N@H+]2CCC[C@H]2CC(C)(C)C)cn1 ZINC000153803657 344981261 /nfs/dbraw/zinc/98/12/61/344981261.db2.gz NAEJBSILJSXJKO-HNNXBMFYSA-N 1 1 246.398 3.791 20 0 BHADMO CCC(CC)C[N@@H+](C)[C@@H](C)c1ccco1 ZINC000153876985 201250883 /nfs/dbraw/zinc/25/08/83/201250883.db2.gz IBCOAEVBTWUWTO-NSHDSACASA-N 1 1 209.333 3.709 20 0 BHADMO CCC(CC)C[N@@H+](C)[C@H](C)c1ccco1 ZINC000153877148 201250021 /nfs/dbraw/zinc/25/00/21/201250021.db2.gz IBCOAEVBTWUWTO-LLVKDONJSA-N 1 1 209.333 3.709 20 0 BHADMO CCCO[C@@H]1CCC[N@@H+](CC(CC)CC)CC1 ZINC000153883229 201252817 /nfs/dbraw/zinc/25/28/17/201252817.db2.gz FZOPPSYTKBTKIK-OAHLLOKOSA-N 1 1 241.419 3.704 20 0 BHADMO CCCO[C@H]1CCC[N@@H+](CC(CC)CC)CC1 ZINC000153883338 201251836 /nfs/dbraw/zinc/25/18/36/201251836.db2.gz FZOPPSYTKBTKIK-HNNXBMFYSA-N 1 1 241.419 3.704 20 0 BHADMO CCC(CC)C[N@@H+](C)[C@@H](C)c1ccccn1 ZINC000153900754 168347542 /nfs/dbraw/zinc/34/75/42/168347542.db2.gz IMDBSMOBAPLJIB-LBPRGKRZSA-N 1 1 220.360 3.511 20 0 BHADMO CCC(CC)C[N@@H+](C)[C@H](C)c1ccccn1 ZINC000153900831 168348325 /nfs/dbraw/zinc/34/83/25/168348325.db2.gz IMDBSMOBAPLJIB-GFCCVEGCSA-N 1 1 220.360 3.511 20 0 BHADMO CCC(CC)C[N@@H+](C)[C@@H](C)c1ccncc1 ZINC000153900958 168346252 /nfs/dbraw/zinc/34/62/52/168346252.db2.gz KPCHLTIPEMEFNU-LBPRGKRZSA-N 1 1 220.360 3.511 20 0 BHADMO CCC(CC)C[N@@H+](C)[C@H](C)c1ccncc1 ZINC000153901061 168348812 /nfs/dbraw/zinc/34/88/12/168348812.db2.gz KPCHLTIPEMEFNU-GFCCVEGCSA-N 1 1 220.360 3.511 20 0 BHADMO CCC(CC)C[N@@H+](CC)[C@@H](C)c1ccccn1 ZINC000153901202 326118413 /nfs/dbraw/zinc/11/84/13/326118413.db2.gz SJXBGTKYEXIMOQ-ZDUSSCGKSA-N 1 1 234.387 3.901 20 0 BHADMO 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C[C@H](c1cc2ccccc2o1)[N@@H+](C)CC1CC1 ZINC000155376721 326194513 /nfs/dbraw/zinc/19/45/13/326194513.db2.gz JAANTMQAKVUFKF-LLVKDONJSA-N 1 1 229.323 3.836 20 0 BHADMO c1coc(C[N@@H+](Cc2ccccc2)CC2CC2)c1 ZINC000155492930 326197489 /nfs/dbraw/zinc/19/74/89/326197489.db2.gz QQFCJDSXPBRFPI-UHFFFAOYSA-N 1 1 241.334 3.692 20 0 BHADMO C[C@@H]1CC[C@H](C)[N@@H+]1CCCCC(F)(F)F ZINC000155516982 326198773 /nfs/dbraw/zinc/19/87/73/326198773.db2.gz HGEDVZFLKQZFPN-AOOOYVTPSA-N 1 1 223.282 3.592 20 0 BHADMO FC(F)(F)CCCC[N@H+]1CCC2(CCC2)C1 ZINC000155519553 345088399 /nfs/dbraw/zinc/08/83/99/345088399.db2.gz SZBLWTOCSMTEOO-UHFFFAOYSA-N 1 1 235.293 3.595 20 0 BHADMO CC[N@@H+](CC1CC1)[C@@H](C)c1ccc(F)cc1 ZINC000155681843 326207896 /nfs/dbraw/zinc/20/78/96/326207896.db2.gz KRXWCDVOLYWYEP-NSHDSACASA-N 1 1 221.319 3.619 20 0 BHADMO CC[N@@H+](CC1CC1)[C@H](C)c1ccc(F)cc1 ZINC000155681956 326207642 /nfs/dbraw/zinc/20/76/42/326207642.db2.gz KRXWCDVOLYWYEP-LLVKDONJSA-N 1 1 221.319 3.619 20 0 BHADMO Cc1ccc(C[N@H+](CC2CC2)C(C)C)s1 ZINC000155698687 345096635 /nfs/dbraw/zinc/09/66/35/345096635.db2.gz DHAUNQSLHFOEMJ-UHFFFAOYSA-N 1 1 223.385 3.677 20 0 BHADMO CC[N@@H+](CC1CC1)[C@@H](C)c1ccccc1F ZINC000155833435 389011207 /nfs/dbraw/zinc/01/12/07/389011207.db2.gz YVKPWYASILTOKO-NSHDSACASA-N 1 1 221.319 3.619 20 0 BHADMO CC[N@@H+](CC1CC1)[C@H](C)c1ccccc1F ZINC000155833547 389010981 /nfs/dbraw/zinc/01/09/81/389010981.db2.gz YVKPWYASILTOKO-LLVKDONJSA-N 1 1 221.319 3.619 20 0 BHADMO CC[N@@H+](CC1CC1)[C@@H](C)c1cccc(F)c1 ZINC000155841962 326213120 /nfs/dbraw/zinc/21/31/20/326213120.db2.gz LWXXFEKSZGRHBC-NSHDSACASA-N 1 1 221.319 3.619 20 0 BHADMO CC[N@@H+](CC1CC1)[C@H](C)c1cccc(F)c1 ZINC000155842047 326212855 /nfs/dbraw/zinc/21/28/55/326212855.db2.gz LWXXFEKSZGRHBC-LLVKDONJSA-N 1 1 221.319 3.619 20 0 BHADMO CC(C)[N@@H+](CCCCC(F)(F)F)CC(F)F ZINC000155865583 326213608 /nfs/dbraw/zinc/21/36/08/326213608.db2.gz VHJGQANGQWVUHE-UHFFFAOYSA-N 1 1 247.251 3.695 20 0 BHADMO CC(C)[N@H+](CCCCC(F)(F)F)CC(F)F ZINC000155865583 326213606 /nfs/dbraw/zinc/21/36/06/326213606.db2.gz VHJGQANGQWVUHE-UHFFFAOYSA-N 1 1 247.251 3.695 20 0 BHADMO CCCCC[N@@H+](Cc1ccc(C)cn1)C(C)C ZINC000156075123 326218106 /nfs/dbraw/zinc/21/81/06/326218106.db2.gz IDNRCMZWAMENBT-UHFFFAOYSA-N 1 1 234.387 3.791 20 0 BHADMO CC[N@@H+](Cc1ccc(C)cn1)C1CCCCC1 ZINC000156128271 326220096 /nfs/dbraw/zinc/22/00/96/326220096.db2.gz UVEGMYVSUGELTO-UHFFFAOYSA-N 1 1 232.371 3.545 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@@H](C)c2cccs2)nc1 ZINC000156196763 326221970 /nfs/dbraw/zinc/22/19/70/326221970.db2.gz UPLAGXNSMCUGIE-LBPRGKRZSA-N 1 1 246.379 3.645 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@H](C)c2cccs2)nc1 ZINC000156196895 326221790 /nfs/dbraw/zinc/22/17/90/326221790.db2.gz UPLAGXNSMCUGIE-GFCCVEGCSA-N 1 1 246.379 3.645 20 0 BHADMO CC(=O)CC[N@H+]1CCCC[C@H]1c1ccc(C)cc1 ZINC000156248976 397756497 /nfs/dbraw/zinc/75/64/97/397756497.db2.gz UWWVFRYNESXDIY-INIZCTEOSA-N 1 1 245.366 3.501 20 0 BHADMO CC(=O)CC[N@H+]1CCCC[C@@H]1c1ccc(C)cc1 ZINC000156249103 397756751 /nfs/dbraw/zinc/75/67/51/397756751.db2.gz UWWVFRYNESXDIY-MRXNPFEDSA-N 1 1 245.366 3.501 20 0 BHADMO Cc1ccc(C[N@H+]2CCC[C@@H]2C2CCCC2)nc1 ZINC000156287472 345141889 /nfs/dbraw/zinc/14/18/89/345141889.db2.gz YVXWKCRRNKVEQE-MRXNPFEDSA-N 1 1 244.382 3.545 20 0 BHADMO Cc1ccc(C[N@H+]2CCC[C@H]2C2CCCC2)nc1 ZINC000156287612 134712192 /nfs/dbraw/zinc/71/21/92/134712192.db2.gz YVXWKCRRNKVEQE-INIZCTEOSA-N 1 1 244.382 3.545 20 0 BHADMO Clc1ccc([C@@H]2CC[N@@H+](CC3CC3)C2)cc1 ZINC000156346306 326228548 /nfs/dbraw/zinc/22/85/48/326228548.db2.gz LJQUDZRYIKBASS-CYBMUJFWSA-N 1 1 235.758 3.539 20 0 BHADMO Clc1ccc([C@H]2CC[N@@H+](CC3CC3)C2)cc1 ZINC000156346442 326228395 /nfs/dbraw/zinc/22/83/95/326228395.db2.gz LJQUDZRYIKBASS-ZDUSSCGKSA-N 1 1 235.758 3.539 20 0 BHADMO Cc1cc(C[N@H+](C)Cc2ccccc2)c(C)o1 ZINC000156375565 640442092 /nfs/dbraw/zinc/44/20/92/640442092.db2.gz LCIZETSRXNSVPW-UHFFFAOYSA-N 1 1 229.323 3.528 20 0 BHADMO Cc1ccc([C@@H]2CCC[N@H+]2CC2CC2)s1 ZINC000156404932 345158155 /nfs/dbraw/zinc/15/81/55/345158155.db2.gz SMBJFBMKLSBDKD-LBPRGKRZSA-N 1 1 221.369 3.603 20 0 BHADMO Cc1ccc([C@H]2CCC[N@H+]2CC2CC2)s1 ZINC000156405069 345158445 /nfs/dbraw/zinc/15/84/45/345158445.db2.gz SMBJFBMKLSBDKD-GFCCVEGCSA-N 1 1 221.369 3.603 20 0 BHADMO c1coc([C@@H]2CCCCC[N@@H+]2CC2CC2)c1 ZINC000156463653 345161924 /nfs/dbraw/zinc/16/19/24/345161924.db2.gz VKUUCVRVCFMQMC-ZDUSSCGKSA-N 1 1 219.328 3.607 20 0 BHADMO c1coc([C@H]2CCCCC[N@@H+]2CC2CC2)c1 ZINC000156463764 345161742 /nfs/dbraw/zinc/16/17/42/345161742.db2.gz VKUUCVRVCFMQMC-CYBMUJFWSA-N 1 1 219.328 3.607 20 0 BHADMO c1ccc(SC[C@@H]2CC[N@@H+](CC3CC3)C2)cc1 ZINC000156564246 326235662 /nfs/dbraw/zinc/23/56/62/326235662.db2.gz MAVGHBCLLIAEKL-CQSZACIVSA-N 1 1 247.407 3.511 20 0 BHADMO c1ccc(SC[C@H]2CC[N@@H+](CC3CC3)C2)cc1 ZINC000156564361 326235461 /nfs/dbraw/zinc/23/54/61/326235461.db2.gz MAVGHBCLLIAEKL-AWEZNQCLSA-N 1 1 247.407 3.511 20 0 BHADMO Cc1ccc(CNc2cccc3cc[nH+]cc32)nc1 ZINC000156590592 326236255 /nfs/dbraw/zinc/23/62/55/326236255.db2.gz CDBYYXQGVZMARA-UHFFFAOYSA-N 1 1 249.317 3.550 20 0 BHADMO c1c[nH]c([C@@H]2CCC[N@@H+]2C[C@H]2CC=CCC2)c1 ZINC000156603113 385460266 /nfs/dbraw/zinc/46/02/66/385460266.db2.gz WNHIMAVPXOJRSF-ZFWWWQNUSA-N 1 1 230.355 3.508 20 0 BHADMO c1c[nH]c([C@H]2CCC[N@@H+]2C[C@H]2CC=CCC2)c1 ZINC000156603231 187300704 /nfs/dbraw/zinc/30/07/04/187300704.db2.gz WNHIMAVPXOJRSF-DZGCQCFKSA-N 1 1 230.355 3.508 20 0 BHADMO Cc1cc(C[N@H+]2CCC[C@@H]2c2ccc[nH]2)c(C)o1 ZINC000156609792 640466668 /nfs/dbraw/zinc/46/66/68/640466668.db2.gz LNIQSRZDIJFPHK-OAHLLOKOSA-N 1 1 244.338 3.562 20 0 BHADMO Cc1cc(C[N@H+]2CCC[C@H]2c2ccc[nH]2)c(C)o1 ZINC000156609922 640466535 /nfs/dbraw/zinc/46/65/35/640466535.db2.gz LNIQSRZDIJFPHK-HNNXBMFYSA-N 1 1 244.338 3.562 20 0 BHADMO Cc1[nH+]ccn1CCCCSc1ccccc1 ZINC000156673758 323034699 /nfs/dbraw/zinc/03/46/99/323034699.db2.gz PUOCVNTZPQZFAS-UHFFFAOYSA-N 1 1 246.379 3.764 20 0 BHADMO Cc1[nH+]ccn1CCCCSC1CCCC1 ZINC000156704291 326240265 /nfs/dbraw/zinc/24/02/65/326240265.db2.gz BDXXVIUKRDYYLH-UHFFFAOYSA-N 1 1 238.400 3.648 20 0 BHADMO CCC(C)(C)[C@@H]1CCC[N@H+]1CCc1ccccn1 ZINC000156768614 326241849 /nfs/dbraw/zinc/24/18/49/326241849.db2.gz RAIOQISKSJBPPA-HNNXBMFYSA-N 1 1 246.398 3.525 20 0 BHADMO CCC(C)(C)[C@H]1CCC[N@H+]1CCc1ccccn1 ZINC000156768743 326241688 /nfs/dbraw/zinc/24/16/88/326241688.db2.gz RAIOQISKSJBPPA-OAHLLOKOSA-N 1 1 246.398 3.525 20 0 BHADMO CCC(C)(C)[C@@H]1CCC[N@H+]1Cc1ccc(C)cn1 ZINC000156781597 384955669 /nfs/dbraw/zinc/95/56/69/384955669.db2.gz UYUDRQOQCPCABQ-HNNXBMFYSA-N 1 1 246.398 3.791 20 0 BHADMO CCC(C)(C)[C@H]1CCC[N@H+]1Cc1ccc(C)cn1 ZINC000156781731 384956128 /nfs/dbraw/zinc/95/61/28/384956128.db2.gz UYUDRQOQCPCABQ-OAHLLOKOSA-N 1 1 246.398 3.791 20 0 BHADMO CCC(C)(C)[C@@H]1CCC[N@H+]1CCCCCOC ZINC000156805034 326242853 /nfs/dbraw/zinc/24/28/53/326242853.db2.gz AICRTLAMSLHSLC-AWEZNQCLSA-N 1 1 241.419 3.704 20 0 BHADMO CCC(C)(C)[C@H]1CCC[N@H+]1CCCCCOC ZINC000156805175 326242571 /nfs/dbraw/zinc/24/25/71/326242571.db2.gz AICRTLAMSLHSLC-CQSZACIVSA-N 1 1 241.419 3.704 20 0 BHADMO CSC(C)(C)CNc1[nH+]ccc2ccccc21 ZINC000156852438 632404981 /nfs/dbraw/zinc/40/49/81/632404981.db2.gz MGGWBYLBXWSXGN-UHFFFAOYSA-N 1 1 246.379 3.788 20 0 BHADMO CCC(C)(C)[C@@H]1CCC[N@H+]1CCc1ccncc1 ZINC000156947052 385031549 /nfs/dbraw/zinc/03/15/49/385031549.db2.gz QWVOOJSSHMVRBT-HNNXBMFYSA-N 1 1 246.398 3.525 20 0 BHADMO CCC(C)(C)[C@H]1CCC[N@H+]1CCc1ccncc1 ZINC000156947204 385029269 /nfs/dbraw/zinc/02/92/69/385029269.db2.gz QWVOOJSSHMVRBT-OAHLLOKOSA-N 1 1 246.398 3.525 20 0 BHADMO CC[N@@H+](Cc1cccnc1C)C1CCCCC1 ZINC000156954783 326250575 /nfs/dbraw/zinc/25/05/75/326250575.db2.gz XFRGVZPAOGDZRV-UHFFFAOYSA-N 1 1 232.371 3.545 20 0 BHADMO CC[N@@H+](Cc1scnc1C)C1CCCCC1 ZINC000156954948 326250237 /nfs/dbraw/zinc/25/02/37/326250237.db2.gz VBSNTYDEASODOU-UHFFFAOYSA-N 1 1 238.400 3.606 20 0 BHADMO CCC(C)(C)[C@@H]1CCC[N@H+]1Cc1nccs1 ZINC000156955322 385025596 /nfs/dbraw/zinc/02/55/96/385025596.db2.gz JOGSVQDFVMFUOR-NSHDSACASA-N 1 1 238.400 3.544 20 0 BHADMO CCC(C)(C)[C@H]1CCC[N@H+]1Cc1nccs1 ZINC000156955479 385026636 /nfs/dbraw/zinc/02/66/36/385026636.db2.gz JOGSVQDFVMFUOR-LLVKDONJSA-N 1 1 238.400 3.544 20 0 BHADMO CC(C)[N@@H+](C)Cc1ncc(-c2ccccc2)s1 ZINC000156973928 326251109 /nfs/dbraw/zinc/25/11/09/326251109.db2.gz VRAVBVOMLDEGFC-UHFFFAOYSA-N 1 1 246.379 3.650 20 0 BHADMO Cc1ccoc1C[N@H+]([C@@H](C)C(C)C)C1CC1 ZINC000156984090 326251648 /nfs/dbraw/zinc/25/16/48/326251648.db2.gz IXYHSPRCCRBHBD-LBPRGKRZSA-N 1 1 221.344 3.597 20 0 BHADMO Cc1ccoc1C[N@H+]([C@H](C)C(C)C)C1CC1 ZINC000156984238 326251353 /nfs/dbraw/zinc/25/13/53/326251353.db2.gz IXYHSPRCCRBHBD-GFCCVEGCSA-N 1 1 221.344 3.597 20 0 BHADMO CCC[N@@H+](C)Cc1ncc(-c2ccccc2)s1 ZINC000157136029 326258283 /nfs/dbraw/zinc/25/82/83/326258283.db2.gz YYLISPHHFNEUFU-UHFFFAOYSA-N 1 1 246.379 3.652 20 0 BHADMO Cc1ccc(C[N@H+]2CCC[C@@H]2CC(C)(C)C)nc1 ZINC000157161909 385090260 /nfs/dbraw/zinc/09/02/60/385090260.db2.gz WAXLTFLUNOFRAA-OAHLLOKOSA-N 1 1 246.398 3.791 20 0 BHADMO Cc1ccc(C[N@H+]2CCC[C@H]2CC(C)(C)C)nc1 ZINC000157162062 385090715 /nfs/dbraw/zinc/09/07/15/385090715.db2.gz WAXLTFLUNOFRAA-HNNXBMFYSA-N 1 1 246.398 3.791 20 0 BHADMO Cc1cccc(N2CCC[C@@H]2C2CCCC2)[nH+]1 ZINC000157208941 385108029 /nfs/dbraw/zinc/10/80/29/385108029.db2.gz JYNTWHRIPCZPNP-CQSZACIVSA-N 1 1 230.355 3.549 20 0 BHADMO Cc1cccc(N2CCC[C@H]2C2CCCC2)[nH+]1 ZINC000157209086 385107346 /nfs/dbraw/zinc/10/73/46/385107346.db2.gz JYNTWHRIPCZPNP-AWEZNQCLSA-N 1 1 230.355 3.549 20 0 BHADMO CSCCC[N@@H+](C)Cc1cccc(Cl)c1 ZINC000157383162 385156891 /nfs/dbraw/zinc/15/68/91/385156891.db2.gz OKDOUVPSVOCJLK-UHFFFAOYSA-N 1 1 243.803 3.525 20 0 BHADMO CSCCC[N@H+]1CCC[C@@H]1c1cccs1 ZINC000157403515 385499553 /nfs/dbraw/zinc/49/95/53/385499553.db2.gz YKUBFJYYRRQGEN-LLVKDONJSA-N 1 1 241.425 3.638 20 0 BHADMO CSCCC[N@H+]1CCC[C@H]1c1cccs1 ZINC000157403686 385499845 /nfs/dbraw/zinc/49/98/45/385499845.db2.gz YKUBFJYYRRQGEN-NSHDSACASA-N 1 1 241.425 3.638 20 0 BHADMO CSCCC[N@@H+](C)Cc1ccc(Cl)s1 ZINC000157410549 387793009 /nfs/dbraw/zinc/79/30/09/387793009.db2.gz VUEOSDHYHZVGMY-UHFFFAOYSA-N 1 1 249.832 3.586 20 0 BHADMO CC[C@@H]1CCCC[N@H+]1Cc1ccsc1 ZINC000157467962 326276762 /nfs/dbraw/zinc/27/67/62/326276762.db2.gz VXWVHJSDHIYLCL-GFCCVEGCSA-N 1 1 209.358 3.513 20 0 BHADMO CC[C@H]1CCCC[N@H+]1Cc1ccsc1 ZINC000157468105 326276570 /nfs/dbraw/zinc/27/65/70/326276570.db2.gz VXWVHJSDHIYLCL-LBPRGKRZSA-N 1 1 209.358 3.513 20 0 BHADMO CSCCC[N@@H+](C)[C@@H](C)c1ccc(F)cc1 ZINC000157494125 387806089 /nfs/dbraw/zinc/80/60/89/387806089.db2.gz KDJGYJZQDLNJHB-NSHDSACASA-N 1 1 241.375 3.572 20 0 BHADMO CSCCC[N@@H+](C)[C@H](C)c1ccc(F)cc1 ZINC000157494274 191116464 /nfs/dbraw/zinc/11/64/64/191116464.db2.gz KDJGYJZQDLNJHB-LLVKDONJSA-N 1 1 241.375 3.572 20 0 BHADMO COCc1ccc(C[N@@H+](C)C2CCCCC2)cc1 ZINC000157499243 326278929 /nfs/dbraw/zinc/27/89/29/326278929.db2.gz MSKYGODAXPHEMK-UHFFFAOYSA-N 1 1 247.382 3.598 20 0 BHADMO C[N@@H+](Cc1cccc2[nH]ccc21)C1CCCCC1 ZINC000157512628 326279725 /nfs/dbraw/zinc/27/97/25/326279725.db2.gz PRLNHXHVUFAQDF-UHFFFAOYSA-N 1 1 242.366 3.932 20 0 BHADMO CCc1nc([C@@H](C)Nc2cccc(C)[nH+]2)cs1 ZINC000157525975 172002847 /nfs/dbraw/zinc/00/28/47/172002847.db2.gz QFCJKIMISSSVSC-SNVBAGLBSA-N 1 1 247.367 3.582 20 0 BHADMO CCc1nc([C@H](C)Nc2cccc(C)[nH+]2)cs1 ZINC000157526141 172006985 /nfs/dbraw/zinc/00/69/85/172006985.db2.gz QFCJKIMISSSVSC-JTQLQIEISA-N 1 1 247.367 3.582 20 0 BHADMO CSCCC[N@H+]1CCC[C@@H]1c1ccccc1 ZINC000157535182 191116398 /nfs/dbraw/zinc/11/63/98/191116398.db2.gz MYZSRBLZHQCEOM-CQSZACIVSA-N 1 1 235.396 3.577 20 0 BHADMO CSCCC[N@H+]1CCC[C@H]1c1ccccc1 ZINC000157535335 387826307 /nfs/dbraw/zinc/82/63/07/387826307.db2.gz MYZSRBLZHQCEOM-AWEZNQCLSA-N 1 1 235.396 3.577 20 0 BHADMO Cc1ccoc1CNc1cccc2cc[nH+]cc21 ZINC000157541010 326281597 /nfs/dbraw/zinc/28/15/97/326281597.db2.gz KZMMUKYPFDKHNJ-UHFFFAOYSA-N 1 1 238.290 3.748 20 0 BHADMO Cc1ccc(C[N@H+](C(C)C)C2CCCC2)nc1 ZINC000157569979 538830701 /nfs/dbraw/zinc/83/07/01/538830701.db2.gz SLCPRRXPKHCDBL-UHFFFAOYSA-N 1 1 232.371 3.543 20 0 BHADMO CC(C)[N@@H+](CCCCC(F)(F)F)C1CCC1 ZINC000157621662 326287409 /nfs/dbraw/zinc/28/74/09/326287409.db2.gz FRWICXKCFSVTIZ-UHFFFAOYSA-N 1 1 237.309 3.982 20 0 BHADMO Cc1cccc(N2CCC3(CCCC3)CC2)[nH+]1 ZINC000157656227 385241599 /nfs/dbraw/zinc/24/15/99/385241599.db2.gz GAPJWSOHJPPFMS-UHFFFAOYSA-N 1 1 230.355 3.551 20 0 BHADMO CCC(CC)SCCCCn1cc[nH+]c1C ZINC000157677209 326290162 /nfs/dbraw/zinc/29/01/62/326290162.db2.gz MSQPMJDNVDANNF-UHFFFAOYSA-N 1 1 240.416 3.894 20 0 BHADMO CSCCC[N@@H+](C)[C@@H](C)c1ccccc1F ZINC000157715642 193019522 /nfs/dbraw/zinc/01/95/22/193019522.db2.gz IIKXQKRIYOIMPU-NSHDSACASA-N 1 1 241.375 3.572 20 0 BHADMO CSCCC[N@@H+](C)[C@H](C)c1ccccc1F ZINC000157715770 193019418 /nfs/dbraw/zinc/01/94/18/193019418.db2.gz IIKXQKRIYOIMPU-LLVKDONJSA-N 1 1 241.375 3.572 20 0 BHADMO Cc1cccc(N2CCC3(C2)CCCCC3)[nH+]1 ZINC000157726739 385261897 /nfs/dbraw/zinc/26/18/97/385261897.db2.gz KOLMWPFLHHCREH-UHFFFAOYSA-N 1 1 230.355 3.551 20 0 BHADMO CSCCC[N@H+]1CCC[C@H]1c1ccccc1C ZINC000157736783 326293558 /nfs/dbraw/zinc/29/35/58/326293558.db2.gz OYVCIFBYSAAMMG-HNNXBMFYSA-N 1 1 249.423 3.885 20 0 BHADMO CSCCC[N@H+]1CCC[C@@H]1c1ccccc1C ZINC000157736930 326293627 /nfs/dbraw/zinc/29/36/27/326293627.db2.gz OYVCIFBYSAAMMG-OAHLLOKOSA-N 1 1 249.423 3.885 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@@H](C)c2cccs2)o1 ZINC000157812951 385524611 /nfs/dbraw/zinc/52/46/11/385524611.db2.gz XSBGNMSNAWOEFS-NSHDSACASA-N 1 1 235.352 3.843 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@H](C)c2cccs2)o1 ZINC000157813100 385523746 /nfs/dbraw/zinc/52/37/46/385523746.db2.gz XSBGNMSNAWOEFS-LLVKDONJSA-N 1 1 235.352 3.843 20 0 BHADMO Cc1ccoc1C[N@H+](C)[C@@H](C)c1cccs1 ZINC000157842471 385528327 /nfs/dbraw/zinc/52/83/27/385528327.db2.gz ZDFJONLRYMVFHG-NSHDSACASA-N 1 1 235.352 3.843 20 0 BHADMO Cc1ccoc1C[N@H+](C)[C@H](C)c1cccs1 ZINC000157842626 385528279 /nfs/dbraw/zinc/52/82/79/385528279.db2.gz ZDFJONLRYMVFHG-LLVKDONJSA-N 1 1 235.352 3.843 20 0 BHADMO Cc1ncccc1C[N@H+](C)[C@@H](C)c1cccs1 ZINC000157857086 326298479 /nfs/dbraw/zinc/29/84/79/326298479.db2.gz WUGQPCUTVRARBG-LBPRGKRZSA-N 1 1 246.379 3.645 20 0 BHADMO Cc1ncccc1C[N@H+](C)[C@H](C)c1cccs1 ZINC000157857266 326298568 /nfs/dbraw/zinc/29/85/68/326298568.db2.gz WUGQPCUTVRARBG-GFCCVEGCSA-N 1 1 246.379 3.645 20 0 BHADMO COc1ccccc1[C@H]1CC[N@@H+](CCC(C)C)C1 ZINC000157984992 383856601 /nfs/dbraw/zinc/85/66/01/383856601.db2.gz HIYSTFMXEJMPIV-AWEZNQCLSA-N 1 1 247.382 3.531 20 0 BHADMO COc1ccccc1[C@@H]1CC[N@@H+](CCC(C)C)C1 ZINC000157985138 346389560 /nfs/dbraw/zinc/38/95/60/346389560.db2.gz HIYSTFMXEJMPIV-CQSZACIVSA-N 1 1 247.382 3.531 20 0 BHADMO C[C@@H](C1CC1)[N@@H+](C)Cc1cc2cc(F)ccc2o1 ZINC000158025628 326304923 /nfs/dbraw/zinc/30/49/23/326304923.db2.gz RECSDBOWKMWIBF-JTQLQIEISA-N 1 1 247.313 3.802 20 0 BHADMO C[C@H](C1CC1)[N@@H+](C)Cc1cc2cc(F)ccc2o1 ZINC000158025763 326304845 /nfs/dbraw/zinc/30/48/45/326304845.db2.gz RECSDBOWKMWIBF-SNVBAGLBSA-N 1 1 247.313 3.802 20 0 BHADMO C[C@@H](C1CC1)[N@@H+](C)Cc1coc2ccccc12 ZINC000158038594 326305840 /nfs/dbraw/zinc/30/58/40/326305840.db2.gz JDXDFEQGBVTWLQ-NSHDSACASA-N 1 1 229.323 3.663 20 0 BHADMO C[C@H](C1CC1)[N@@H+](C)Cc1coc2ccccc12 ZINC000158038714 326305754 /nfs/dbraw/zinc/30/57/54/326305754.db2.gz JDXDFEQGBVTWLQ-LLVKDONJSA-N 1 1 229.323 3.663 20 0 BHADMO C[C@@H](C1CC1)[N@@H+](C)Cc1ccc([C@H]2C[C@H]2C)o1 ZINC000158072581 326307289 /nfs/dbraw/zinc/30/72/89/326307289.db2.gz GNQRDEPGPXIACL-SUNKGSAMSA-N 1 1 233.355 3.633 20 0 BHADMO C[C@@H](C1CC1)[N@@H+](C)Cc1ccc([C@@H]2C[C@H]2C)o1 ZINC000158072874 326307619 /nfs/dbraw/zinc/30/76/19/326307619.db2.gz GNQRDEPGPXIACL-UHIISALHSA-N 1 1 233.355 3.633 20 0 BHADMO C[C@@H](C1CC1)[N@@H+](C)C/C=C/c1ccc(F)cc1 ZINC000158080576 326307651 /nfs/dbraw/zinc/30/76/51/326307651.db2.gz GRPXQSYYWDMSKZ-PCAWENJQSA-N 1 1 233.330 3.569 20 0 BHADMO C[C@H](C1CC1)[N@@H+](C)C/C=C/c1ccc(F)cc1 ZINC000158080722 326307528 /nfs/dbraw/zinc/30/75/28/326307528.db2.gz GRPXQSYYWDMSKZ-AAOUONPWSA-N 1 1 233.330 3.569 20 0 BHADMO CCCc1[nH+]ccn1Cc1c(C)cccc1C ZINC000158098718 385124073 /nfs/dbraw/zinc/12/40/73/385124073.db2.gz BXBZPJVRQBTHLV-UHFFFAOYSA-N 1 1 228.339 3.501 20 0 BHADMO CCCC[N@@H+](C)Cc1cnc(C(C)(C)C)s1 ZINC000158165373 326310731 /nfs/dbraw/zinc/31/07/31/326310731.db2.gz IOGWPFPASXFTAE-UHFFFAOYSA-N 1 1 240.416 3.673 20 0 BHADMO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2cncc(F)c2)o1 ZINC000158166760 178847658 /nfs/dbraw/zinc/84/76/58/178847658.db2.gz FARJJTWVUTVVTF-WDEREUQCSA-N 1 1 248.301 3.534 20 0 BHADMO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2cncc(F)c2)o1 ZINC000158166920 385551114 /nfs/dbraw/zinc/55/11/14/385551114.db2.gz FARJJTWVUTVVTF-QWRGUYRKSA-N 1 1 248.301 3.534 20 0 BHADMO CCCC[N@@H+](C)Cc1cnc(C2CCC2)s1 ZINC000158170270 326311040 /nfs/dbraw/zinc/31/10/40/326311040.db2.gz VUCDNLUNTUMIPS-UHFFFAOYSA-N 1 1 238.400 3.643 20 0 BHADMO CCCc1[nH+]ccn1C[C@@H](C)c1ccccc1 ZINC000158170908 326311018 /nfs/dbraw/zinc/31/10/18/326311018.db2.gz PKYNSQDTAPVNNV-CYBMUJFWSA-N 1 1 228.339 3.639 20 0 BHADMO CCCc1[nH+]ccn1C[C@H](C)c1ccccc1 ZINC000158171054 326310646 /nfs/dbraw/zinc/31/06/46/326310646.db2.gz PKYNSQDTAPVNNV-ZDUSSCGKSA-N 1 1 228.339 3.639 20 0 BHADMO CCCC[N@@H+](C)Cc1cnc(CC(C)C)s1 ZINC000158174372 326311037 /nfs/dbraw/zinc/31/10/37/326311037.db2.gz WKTFMWCQFOMBQZ-UHFFFAOYSA-N 1 1 240.416 3.574 20 0 BHADMO CC[C@@H](C)CSCCCCn1cc[nH+]c1C ZINC000158177166 326310834 /nfs/dbraw/zinc/31/08/34/326310834.db2.gz UPAOATBSBXDBKM-GFCCVEGCSA-N 1 1 240.416 3.751 20 0 BHADMO CC[C@H](C)CSCCCCn1cc[nH+]c1C ZINC000158177305 323072407 /nfs/dbraw/zinc/07/24/07/323072407.db2.gz UPAOATBSBXDBKM-LBPRGKRZSA-N 1 1 240.416 3.751 20 0 BHADMO CC[C@H](Nc1cccc(C)[nH+]1)c1c(C)noc1C ZINC000158239091 345312586 /nfs/dbraw/zinc/31/25/86/345312586.db2.gz LHRUYRPKFUDMEU-LBPRGKRZSA-N 1 1 245.326 3.558 20 0 BHADMO CC[C@@H](Nc1cccc(C)[nH+]1)c1c(C)noc1C ZINC000158239240 345312234 /nfs/dbraw/zinc/31/22/34/345312234.db2.gz LHRUYRPKFUDMEU-GFCCVEGCSA-N 1 1 245.326 3.558 20 0 BHADMO CCc1[nH+]ccn1CCCc1ccc(Cl)cc1 ZINC000158370017 326315926 /nfs/dbraw/zinc/31/59/26/326315926.db2.gz OKOMVTPYTWEXSS-UHFFFAOYSA-N 1 1 248.757 3.732 20 0 BHADMO CCc1[nH+]ccn1Cc1ccc2ccccc2c1 ZINC000158398867 326318062 /nfs/dbraw/zinc/31/80/62/326318062.db2.gz SFFHQMHHJYWGNJ-UHFFFAOYSA-N 1 1 236.318 3.647 20 0 BHADMO CC[N@H+]1CCCCC[C@@H]1c1ccc(C)o1 ZINC000158636596 344704229 /nfs/dbraw/zinc/70/42/29/344704229.db2.gz AVHXHTQRAFCNKU-GFCCVEGCSA-N 1 1 207.317 3.525 20 0 BHADMO CC[N@H+]1CCCCC[C@H]1c1ccc(C)o1 ZINC000158636750 344703908 /nfs/dbraw/zinc/70/39/08/344703908.db2.gz AVHXHTQRAFCNKU-LBPRGKRZSA-N 1 1 207.317 3.525 20 0 BHADMO CCSCC[C@@H](C)Nc1cc[nH+]cc1Cl ZINC000158679865 361207684 /nfs/dbraw/zinc/20/76/84/361207684.db2.gz DKNQYNYMEJVLOB-SECBINFHSA-N 1 1 244.791 3.679 20 0 BHADMO CCSCC[C@H](C)Nc1cc[nH+]cc1Cl ZINC000158679993 346661634 /nfs/dbraw/zinc/66/16/34/346661634.db2.gz DKNQYNYMEJVLOB-VIFPVBQESA-N 1 1 244.791 3.679 20 0 BHADMO CC[N@@H+](Cc1ccc(C)o1)Cc1ccccc1 ZINC000158686421 326337085 /nfs/dbraw/zinc/33/70/85/326337085.db2.gz JRDLTLCDRFKJHN-UHFFFAOYSA-N 1 1 229.323 3.610 20 0 BHADMO CC[N@@H+](Cc1ccsc1)Cc1ccccc1 ZINC000158696580 326338040 /nfs/dbraw/zinc/33/80/40/326338040.db2.gz RKVRWCFIAMZSPG-UHFFFAOYSA-N 1 1 231.364 3.770 20 0 BHADMO COc1ccc2ccccc2c1C[N@@H+](C)C(C)C ZINC000158704377 326338904 /nfs/dbraw/zinc/33/89/04/326338904.db2.gz HJOYZJNVOXKTNL-UHFFFAOYSA-N 1 1 243.350 3.689 20 0 BHADMO CC(C)[N@@H+](C)Cc1cnc(C2CCCC2)s1 ZINC000158710234 326339239 /nfs/dbraw/zinc/33/92/39/326339239.db2.gz NEPSPJRDBSTSFA-UHFFFAOYSA-N 1 1 238.400 3.641 20 0 BHADMO CC(C)[N@@H+](C)Cc1cccc(-c2cccnc2)c1 ZINC000158716945 384260175 /nfs/dbraw/zinc/26/01/75/384260175.db2.gz GPDLSIUKAZCBPA-UHFFFAOYSA-N 1 1 240.350 3.589 20 0 BHADMO CC(C)[N@@H+](C)Cc1ccc(F)c(C(F)(F)F)c1 ZINC000158718801 326340434 /nfs/dbraw/zinc/34/04/34/326340434.db2.gz ZRFJYHHOHVDKLF-UHFFFAOYSA-N 1 1 249.251 3.685 20 0 BHADMO Cc1oc2ccccc2c1C[N@H+](C)C(C)C ZINC000158721905 326340829 /nfs/dbraw/zinc/34/08/29/326340829.db2.gz SFWYWGGQQFDHRI-UHFFFAOYSA-N 1 1 217.312 3.581 20 0 BHADMO CC(C)[N@@H+](C)Cc1cccc(-c2ccncc2)c1 ZINC000158724575 326340904 /nfs/dbraw/zinc/34/09/04/326340904.db2.gz QTBPEXSSKKMIAG-UHFFFAOYSA-N 1 1 240.350 3.589 20 0 BHADMO CC(C)[N@@H+](C)Cc1cccc(-c2ccccn2)c1 ZINC000158727726 384262133 /nfs/dbraw/zinc/26/21/33/384262133.db2.gz FEGAKQJXOJOBBT-UHFFFAOYSA-N 1 1 240.350 3.589 20 0 BHADMO CC(C)[N@@H+](C)Cc1ccc(CSC(F)F)o1 ZINC000158733580 384263608 /nfs/dbraw/zinc/26/36/08/384263608.db2.gz ACEDSOWFDSBFIN-UHFFFAOYSA-N 1 1 249.326 3.576 20 0 BHADMO COc1ccc(C[N@@H+](C)C(C)C)c2ccccc12 ZINC000158740050 326341256 /nfs/dbraw/zinc/34/12/56/326341256.db2.gz MBOOFIXGQJTEJS-UHFFFAOYSA-N 1 1 243.350 3.689 20 0 BHADMO CC(C)[N@@H+](C)Cc1ccc(F)cc1C(F)(F)F ZINC000158744104 384764372 /nfs/dbraw/zinc/76/43/72/384764372.db2.gz KTPLIZCRYJCQAE-UHFFFAOYSA-N 1 1 249.251 3.685 20 0 BHADMO CC(C)c1ncc(C[N@H+]2CCCC[C@H]2C)s1 ZINC000158923290 326346307 /nfs/dbraw/zinc/34/63/07/326346307.db2.gz LGXKBIIQKFBWLC-LLVKDONJSA-N 1 1 238.400 3.641 20 0 BHADMO CC(C)c1ncc(C[N@H+]2CCCC[C@@H]2C)s1 ZINC000158923401 326346272 /nfs/dbraw/zinc/34/62/72/326346272.db2.gz LGXKBIIQKFBWLC-NSHDSACASA-N 1 1 238.400 3.641 20 0 BHADMO C[C@@H]1CCCC[N@H+]1Cc1ccc2ncccc2c1 ZINC000158932567 326346360 /nfs/dbraw/zinc/34/63/60/326346360.db2.gz IZIIGTDQMDEZFT-CYBMUJFWSA-N 1 1 240.350 3.609 20 0 BHADMO C[C@H]1CCCC[N@H+]1Cc1ccc2ncccc2c1 ZINC000158932720 326346337 /nfs/dbraw/zinc/34/63/37/326346337.db2.gz IZIIGTDQMDEZFT-ZDUSSCGKSA-N 1 1 240.350 3.609 20 0 BHADMO C[C@@H]1CCCC[N@H+]1Cc1cccc2[nH]ccc21 ZINC000158952332 326346751 /nfs/dbraw/zinc/34/67/51/326346751.db2.gz DLEIQLUPXSHFNQ-GFCCVEGCSA-N 1 1 228.339 3.542 20 0 BHADMO C[C@H]1CCCC[N@H+]1Cc1cccc2[nH]ccc21 ZINC000158952461 409953504 /nfs/dbraw/zinc/95/35/04/409953504.db2.gz DLEIQLUPXSHFNQ-LBPRGKRZSA-N 1 1 228.339 3.542 20 0 BHADMO CCCC[N@@H+](CC)Cc1cnc(C(C)C)s1 ZINC000158970966 326347011 /nfs/dbraw/zinc/34/70/11/326347011.db2.gz OINQOUNRRWGUKL-UHFFFAOYSA-N 1 1 240.416 3.889 20 0 BHADMO CCCC[N@@H+](CC)Cc1ccc2ncccc2c1 ZINC000158975614 343657063 /nfs/dbraw/zinc/65/70/63/343657063.db2.gz KVIRVXQPVHHGCO-UHFFFAOYSA-N 1 1 242.366 3.857 20 0 BHADMO CCCC[N@@H+](CC)CC1=Cc2ccccc2OC1 ZINC000158977375 326347118 /nfs/dbraw/zinc/34/71/18/326347118.db2.gz HQVPOXXSWHIVGU-UHFFFAOYSA-N 1 1 245.366 3.584 20 0 BHADMO CCCC[N@@H+](CC)Cc1cnc(C2CC2)s1 ZINC000158983662 323074374 /nfs/dbraw/zinc/07/43/74/323074374.db2.gz XZAVIOJPONPYDK-UHFFFAOYSA-N 1 1 238.400 3.643 20 0 BHADMO C[N@@H+](Cc1cc(Cl)ccc1Cl)C1CC1 ZINC000159085598 326349142 /nfs/dbraw/zinc/34/91/42/326349142.db2.gz CZLPPKWLOLCFNO-UHFFFAOYSA-N 1 1 230.138 3.588 20 0 BHADMO C[N@H+](Cc1cc(Cl)ccc1Cl)C1CC1 ZINC000159085598 326349141 /nfs/dbraw/zinc/34/91/41/326349141.db2.gz CZLPPKWLOLCFNO-UHFFFAOYSA-N 1 1 230.138 3.588 20 0 BHADMO Cc1ncccc1C[N@H+](C(C)C)C1CCCC1 ZINC000159143973 538874825 /nfs/dbraw/zinc/87/48/25/538874825.db2.gz FCYOKAKQEZAZKG-UHFFFAOYSA-N 1 1 232.371 3.543 20 0 BHADMO Cc1ncsc1C[N@H+](C(C)C)C1CCCC1 ZINC000159144179 323074967 /nfs/dbraw/zinc/07/49/67/323074967.db2.gz NIICYJSHKGGHHG-UHFFFAOYSA-N 1 1 238.400 3.605 20 0 BHADMO CC(C)[N@@H+](Cc1ccsc1)C1CCCC1 ZINC000159145620 641668470 /nfs/dbraw/zinc/66/84/70/641668470.db2.gz QVAXFUOLINZZEC-UHFFFAOYSA-N 1 1 223.385 3.901 20 0 BHADMO CCO[C@@H]1CCC[N@H+]([C@@H](C)c2ccccc2C)C1 ZINC000159236393 541492675 /nfs/dbraw/zinc/49/26/75/541492675.db2.gz HFSFYXREJIIHHN-LSDHHAIUSA-N 1 1 247.382 3.557 20 0 BHADMO CCO[C@H]1CCC[N@H+]([C@@H](C)c2ccccc2C)C1 ZINC000159236544 541492694 /nfs/dbraw/zinc/49/26/94/541492694.db2.gz HFSFYXREJIIHHN-GJZGRUSLSA-N 1 1 247.382 3.557 20 0 BHADMO c1c[nH]c([C@@H]2CCC[N@@H+]2CCC2CCCC2)c1 ZINC000159332786 383999101 /nfs/dbraw/zinc/99/91/01/383999101.db2.gz LJPSQXCOWZTLCH-HNNXBMFYSA-N 1 1 232.371 3.732 20 0 BHADMO c1c[nH]c([C@H]2CCC[N@@H+]2CCC2CCCC2)c1 ZINC000159332943 383998563 /nfs/dbraw/zinc/99/85/63/383998563.db2.gz LJPSQXCOWZTLCH-OAHLLOKOSA-N 1 1 232.371 3.732 20 0 BHADMO CCCCCC[N@@H+](CC)CCc1nccs1 ZINC000159335508 635218961 /nfs/dbraw/zinc/21/89/61/635218961.db2.gz LAENOHFFFVDXHC-UHFFFAOYSA-N 1 1 240.416 3.588 20 0 BHADMO Cc1cccc(C)c1C[NH2+][C@@H](C)c1nccs1 ZINC000160385041 397769297 /nfs/dbraw/zinc/76/92/97/397769297.db2.gz PQZUBWMBNYVBIW-LBPRGKRZSA-N 1 1 246.379 3.611 20 0 BHADMO Cc1cccc(C)c1C[NH2+][C@H](C)c1nccs1 ZINC000160385179 711808033 /nfs/dbraw/zinc/80/80/33/711808033.db2.gz PQZUBWMBNYVBIW-GFCCVEGCSA-N 1 1 246.379 3.611 20 0 BHADMO Cc1cccc(C)c1Cn1cc[nH+]c1C(C)C ZINC000160393562 388062276 /nfs/dbraw/zinc/06/22/76/388062276.db2.gz SKYXULBUJATOSG-UHFFFAOYSA-N 1 1 228.339 3.672 20 0 BHADMO C[C@H]([NH2+][C@@H](C)c1ccccc1)c1cscn1 ZINC000161135844 384466134 /nfs/dbraw/zinc/46/61/34/384466134.db2.gz NURKFVRWNFYELI-QWRGUYRKSA-N 1 1 232.352 3.555 20 0 BHADMO C[C@@H]([NH2+][C@@H](C)c1cscn1)c1ccccc1 ZINC000161135946 384466313 /nfs/dbraw/zinc/46/63/13/384466313.db2.gz NURKFVRWNFYELI-MNOVXSKESA-N 1 1 232.352 3.555 20 0 BHADMO C[C@@H]([NH2+][C@@H](C)c1ccccc1)c1cscn1 ZINC000161136052 384467759 /nfs/dbraw/zinc/46/77/59/384467759.db2.gz NURKFVRWNFYELI-WDEREUQCSA-N 1 1 232.352 3.555 20 0 BHADMO C[C@@H]([NH2+][C@H](C)c1ccccc1)c1cscn1 ZINC000161136154 384467322 /nfs/dbraw/zinc/46/73/22/384467322.db2.gz NURKFVRWNFYELI-GHMZBOCLSA-N 1 1 232.352 3.555 20 0 BHADMO CCC(CC)[NH2+]CC(F)(F)c1ccccc1 ZINC000161165321 384470084 /nfs/dbraw/zinc/47/00/84/384470084.db2.gz KEGAUBVYDWZRMA-UHFFFAOYSA-N 1 1 227.298 3.557 20 0 BHADMO CCC[C@@H](C)[NH2+]CC(F)(F)c1ccccc1 ZINC000161165874 384470898 /nfs/dbraw/zinc/47/08/98/384470898.db2.gz UDQIZGTWMCMTOM-LLVKDONJSA-N 1 1 227.298 3.557 20 0 BHADMO CCC[C@H](C)[NH2+]CC(F)(F)c1ccccc1 ZINC000161165999 384864689 /nfs/dbraw/zinc/86/46/89/384864689.db2.gz UDQIZGTWMCMTOM-NSHDSACASA-N 1 1 227.298 3.557 20 0 BHADMO CC(C)c1[nH+]ccn1CCC1CCCC1 ZINC000161531864 385299881 /nfs/dbraw/zinc/29/98/81/385299881.db2.gz GIPOGKKLCZPKGB-UHFFFAOYSA-N 1 1 206.333 3.587 20 0 BHADMO Cc1cc[nH+]c(NC2CC(c3ccccc3)C2)c1 ZINC000161591835 387247947 /nfs/dbraw/zinc/24/79/47/387247947.db2.gz MPIYVOMSHIVQJT-UHFFFAOYSA-N 1 1 238.334 3.748 20 0 BHADMO Cc1cc[nH+]c(NCc2coc3ccccc23)c1 ZINC000161668166 387255250 /nfs/dbraw/zinc/25/52/50/387255250.db2.gz XKBBNNQSKHQZEH-UHFFFAOYSA-N 1 1 238.290 3.748 20 0 BHADMO c1[nH+]c2c(n1C1CCCCCC1)CCCC2 ZINC000162073604 362886950 /nfs/dbraw/zinc/88/69/50/362886950.db2.gz FCXIAZLURXVRLO-UHFFFAOYSA-N 1 1 218.344 3.657 20 0 BHADMO C[N@@H+](Cc1ccco1)Cc1coc2ccccc12 ZINC000162145909 387320602 /nfs/dbraw/zinc/32/06/02/387320602.db2.gz JFVKLTGZHRSNQT-UHFFFAOYSA-N 1 1 241.290 3.658 20 0 BHADMO Cc1cccc(C[N@@H+](C)Cc2ccco2)c1C ZINC000162154694 387325761 /nfs/dbraw/zinc/32/57/61/387325761.db2.gz GNXLBYPNBTXHRI-UHFFFAOYSA-N 1 1 229.323 3.528 20 0 BHADMO C/C(=C\c1ccccc1)C[N@H+](C)Cc1ccco1 ZINC000162162879 398133398 /nfs/dbraw/zinc/13/33/98/398133398.db2.gz XZISYMCXOPMFEC-SDNWHVSQSA-N 1 1 241.334 3.815 20 0 BHADMO C[N@@H+](C/C=C/c1ccc(F)cc1)Cc1ccco1 ZINC000162166877 398133378 /nfs/dbraw/zinc/13/33/78/398133378.db2.gz JOWALOMSNXKJMV-DUXPYHPUSA-N 1 1 245.297 3.564 20 0 BHADMO Cc1ccc(C[N@@H+](C)Cc2ccco2)cc1C ZINC000162168187 398133666 /nfs/dbraw/zinc/13/36/66/398133666.db2.gz RYZROZCVTUJKDQ-UHFFFAOYSA-N 1 1 229.323 3.528 20 0 BHADMO Cc1ccccc1[C@@H](C)[NH2+][C@@H](C)c1cscn1 ZINC000162305839 179322164 /nfs/dbraw/zinc/32/21/64/179322164.db2.gz COVKGTWZXZIINY-NEPJUHHUSA-N 1 1 246.379 3.863 20 0 BHADMO Cc1ccccc1[C@H](C)[NH2+][C@@H](C)c1cscn1 ZINC000162305955 179338778 /nfs/dbraw/zinc/33/87/78/179338778.db2.gz COVKGTWZXZIINY-RYUDHWBXSA-N 1 1 246.379 3.863 20 0 BHADMO Cc1ccccc1[C@@H](C)[NH2+][C@H](C)c1cscn1 ZINC000162306096 179322773 /nfs/dbraw/zinc/32/27/73/179322773.db2.gz COVKGTWZXZIINY-VXGBXAGGSA-N 1 1 246.379 3.863 20 0 BHADMO Cc1ccccc1[C@H](C)[NH2+][C@H](C)c1cscn1 ZINC000162306220 179339609 /nfs/dbraw/zinc/33/96/09/179339609.db2.gz COVKGTWZXZIINY-NWDGAFQWSA-N 1 1 246.379 3.863 20 0 BHADMO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2cscn2)cc1 ZINC000162371582 323610695 /nfs/dbraw/zinc/61/06/95/323610695.db2.gz ZJNJIBZEDSZYRY-NEPJUHHUSA-N 1 1 246.379 3.863 20 0 BHADMO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2cscn2)cc1 ZINC000162371713 411224608 /nfs/dbraw/zinc/22/46/08/411224608.db2.gz ZJNJIBZEDSZYRY-RYUDHWBXSA-N 1 1 246.379 3.863 20 0 BHADMO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2cscn2)cc1 ZINC000162371845 411224595 /nfs/dbraw/zinc/22/45/95/411224595.db2.gz ZJNJIBZEDSZYRY-VXGBXAGGSA-N 1 1 246.379 3.863 20 0 BHADMO Cc1ccc([C@H](C)[NH2+][C@H](C)c2cscn2)cc1 ZINC000162371979 323608903 /nfs/dbraw/zinc/60/89/03/323608903.db2.gz ZJNJIBZEDSZYRY-NWDGAFQWSA-N 1 1 246.379 3.863 20 0 BHADMO CC[C@H]([NH2+][C@@H](C)c1cscn1)c1ccccc1 ZINC000162399047 384615722 /nfs/dbraw/zinc/61/57/22/384615722.db2.gz MMXTVWMIGHOLPE-AAEUAGOBSA-N 1 1 246.379 3.945 20 0 BHADMO CC[C@@H]([NH2+][C@@H](C)c1cscn1)c1ccccc1 ZINC000162399177 346520944 /nfs/dbraw/zinc/52/09/44/346520944.db2.gz MMXTVWMIGHOLPE-WCQYABFASA-N 1 1 246.379 3.945 20 0 BHADMO CC[C@H]([NH2+][C@H](C)c1cscn1)c1ccccc1 ZINC000162399321 384613967 /nfs/dbraw/zinc/61/39/67/384613967.db2.gz MMXTVWMIGHOLPE-YPMHNXCESA-N 1 1 246.379 3.945 20 0 BHADMO CC[C@@H]([NH2+][C@H](C)c1cscn1)c1ccccc1 ZINC000162399450 346521316 /nfs/dbraw/zinc/52/13/16/346521316.db2.gz MMXTVWMIGHOLPE-DGCLKSJQSA-N 1 1 246.379 3.945 20 0 BHADMO CCc1ccccc1C[NH2+][C@@H](C)c1cscn1 ZINC000162425429 384619291 /nfs/dbraw/zinc/61/92/91/384619291.db2.gz YAACWZFFZLLDOF-NSHDSACASA-N 1 1 246.379 3.556 20 0 BHADMO CCc1ccccc1C[NH2+][C@H](C)c1cscn1 ZINC000162425509 384620431 /nfs/dbraw/zinc/62/04/31/384620431.db2.gz YAACWZFFZLLDOF-LLVKDONJSA-N 1 1 246.379 3.556 20 0 BHADMO Cc1cc([NH2+]C[C@@H](C)C(C)(C)C)ccc1N ZINC000162634089 634245546 /nfs/dbraw/zinc/24/55/46/634245546.db2.gz NSERCLAMZUVSKR-LLVKDONJSA-N 1 1 220.360 3.671 20 0 BHADMO Cc1cc([NH2+]C[C@H](C)C(C)(C)C)ccc1N ZINC000162634191 634244128 /nfs/dbraw/zinc/24/41/28/634244128.db2.gz NSERCLAMZUVSKR-NSHDSACASA-N 1 1 220.360 3.671 20 0 BHADMO Cc1ccc(C[N@H+]2CCC[C@@H]2c2cccs2)o1 ZINC000162690235 387506989 /nfs/dbraw/zinc/50/69/89/387506989.db2.gz FFQLURVTIRWYJZ-CYBMUJFWSA-N 1 1 247.363 3.987 20 0 BHADMO Cc1ccc(C[N@H+]2CCC[C@H]2c2cccs2)o1 ZINC000162690368 387506551 /nfs/dbraw/zinc/50/65/51/387506551.db2.gz FFQLURVTIRWYJZ-ZDUSSCGKSA-N 1 1 247.363 3.987 20 0 BHADMO c1coc(C[N@H+]2CCC[C@@H]2c2cccs2)c1 ZINC000162704258 384671223 /nfs/dbraw/zinc/67/12/23/384671223.db2.gz POYZULAKOWSDJL-GFCCVEGCSA-N 1 1 233.336 3.678 20 0 BHADMO c1coc(C[N@H+]2CCC[C@H]2c2cccs2)c1 ZINC000162704391 384671984 /nfs/dbraw/zinc/67/19/84/384671984.db2.gz POYZULAKOWSDJL-LBPRGKRZSA-N 1 1 233.336 3.678 20 0 BHADMO Cc1ccoc1C[N@H+]1CCC[C@@H]1c1cccs1 ZINC000162705362 387498650 /nfs/dbraw/zinc/49/86/50/387498650.db2.gz OBXHOFNRMYNVMT-GFCCVEGCSA-N 1 1 247.363 3.987 20 0 BHADMO Cc1ccoc1C[N@H+]1CCC[C@H]1c1cccs1 ZINC000162705504 387498187 /nfs/dbraw/zinc/49/81/87/387498187.db2.gz OBXHOFNRMYNVMT-LBPRGKRZSA-N 1 1 247.363 3.987 20 0 BHADMO Cc1ccc(N[C@@H](C)CC2CCC2)c(C)[nH+]1 ZINC000162947346 538925831 /nfs/dbraw/zinc/92/58/31/538925831.db2.gz LRIDALGFRJZIKB-NSHDSACASA-N 1 1 218.344 3.689 20 0 BHADMO Cc1ccc(N[C@H](C)CC2CCC2)c(C)[nH+]1 ZINC000162947464 538925887 /nfs/dbraw/zinc/92/58/87/538925887.db2.gz LRIDALGFRJZIKB-LLVKDONJSA-N 1 1 218.344 3.689 20 0 BHADMO CCCC[C@@H](CC)Cn1c[nH+]c(C)c1C ZINC000163203234 202265692 /nfs/dbraw/zinc/26/56/92/202265692.db2.gz QPRKKUYAYQRBHV-CYBMUJFWSA-N 1 1 208.349 3.716 20 0 BHADMO CCCC[C@H](CC)Cn1c[nH+]c(C)c1C ZINC000163203355 202266912 /nfs/dbraw/zinc/26/69/12/202266912.db2.gz QPRKKUYAYQRBHV-ZDUSSCGKSA-N 1 1 208.349 3.716 20 0 BHADMO Cc1ccc([C@@H](C)[NH2+]Cc2cc(C)oc2C)o1 ZINC000163249565 636310448 /nfs/dbraw/zinc/31/04/48/636310448.db2.gz WNYCLWKPKOMTMQ-LLVKDONJSA-N 1 1 233.311 3.649 20 0 BHADMO Cc1ccc([C@H](C)[NH2+]Cc2cc(C)oc2C)o1 ZINC000163249625 636309711 /nfs/dbraw/zinc/30/97/11/636309711.db2.gz WNYCLWKPKOMTMQ-NSHDSACASA-N 1 1 233.311 3.649 20 0 BHADMO CCCCC[N@@H+](Cc1ccc(CO)cc1)C(C)C ZINC000163413299 388284316 /nfs/dbraw/zinc/28/43/16/388284316.db2.gz ZUVUMIUNZHOVAB-UHFFFAOYSA-N 1 1 249.398 3.580 20 0 BHADMO CC[C@H]([NH2+]Cc1ccco1)c1ccccc1F ZINC000163454433 384807366 /nfs/dbraw/zinc/80/73/66/384807366.db2.gz OSBBYAVZUAYAMZ-AWEZNQCLSA-N 1 1 233.286 3.660 20 0 BHADMO CC[C@@H]([NH2+]Cc1ccco1)c1ccccc1F ZINC000163454549 346560859 /nfs/dbraw/zinc/56/08/59/346560859.db2.gz OSBBYAVZUAYAMZ-CQSZACIVSA-N 1 1 233.286 3.660 20 0 BHADMO CC(C)C[C@@H]1CCC[N@H+]1Cc1ccccc1 ZINC000165177654 345738804 /nfs/dbraw/zinc/73/88/04/345738804.db2.gz NDRJADMZBGCVIB-HNNXBMFYSA-N 1 1 217.356 3.697 20 0 BHADMO CC(C)C[C@H]1CCC[N@H+]1Cc1ccccc1 ZINC000165177762 345738647 /nfs/dbraw/zinc/73/86/47/345738647.db2.gz NDRJADMZBGCVIB-OAHLLOKOSA-N 1 1 217.356 3.697 20 0 BHADMO CC(C)CC[N@@H+](Cc1ccccc1)C(C)C ZINC000165215092 538935196 /nfs/dbraw/zinc/93/51/96/538935196.db2.gz RNXBLJFQPQQSST-UHFFFAOYSA-N 1 1 219.372 3.943 20 0 BHADMO CC[C@@H]1CCCC[N@H+]1CCc1ccc(C)cc1 ZINC000165270656 342893541 /nfs/dbraw/zinc/89/35/41/342893541.db2.gz BTEQGVNGPWUDHG-MRXNPFEDSA-N 1 1 231.383 3.802 20 0 BHADMO CC[C@H]1CCCC[N@H+]1CCc1ccc(C)cc1 ZINC000165270774 343551618 /nfs/dbraw/zinc/55/16/18/343551618.db2.gz BTEQGVNGPWUDHG-INIZCTEOSA-N 1 1 231.383 3.802 20 0 BHADMO CC(C)[N@@H+](C)Cc1ccc(Cl)cc1Cl ZINC000165317132 345720629 /nfs/dbraw/zinc/72/06/29/345720629.db2.gz GRHIAAYBNLPDTP-UHFFFAOYSA-N 1 1 232.154 3.834 20 0 BHADMO CC(C)C[N@H+]1CCC[C@@H]1C1CCCCC1 ZINC000165486814 343449510 /nfs/dbraw/zinc/44/95/10/343449510.db2.gz WHTKOKLUWIAEJL-CQSZACIVSA-N 1 1 209.377 3.687 20 0 BHADMO CC(C)C[N@H+]1CCC[C@H]1C1CCCCC1 ZINC000165486941 343449763 /nfs/dbraw/zinc/44/97/63/343449763.db2.gz WHTKOKLUWIAEJL-AWEZNQCLSA-N 1 1 209.377 3.687 20 0 BHADMO C[C@@H](CC1CC1)Nc1cccc2cc[nH+]cc21 ZINC000165733943 326426067 /nfs/dbraw/zinc/42/60/67/326426067.db2.gz WWMNFOAEKXVUKO-NSHDSACASA-N 1 1 226.323 3.835 20 0 BHADMO C[C@H](CC1CC1)Nc1cccc2cc[nH+]cc21 ZINC000165734078 326426162 /nfs/dbraw/zinc/42/61/62/326426162.db2.gz WWMNFOAEKXVUKO-LLVKDONJSA-N 1 1 226.323 3.835 20 0 BHADMO C(=C\c1ccccc1)\CNc1[nH]c2ccccc2[nH+]1 ZINC000165821658 345721056 /nfs/dbraw/zinc/72/10/56/345721056.db2.gz BXLZNWLYCMATLD-TWGQIWQCSA-N 1 1 249.317 3.688 20 0 BHADMO CCC[N@H+]1CCCC[C@@H]1c1ccccc1 ZINC000166217834 343565735 /nfs/dbraw/zinc/56/57/35/343565735.db2.gz HRXHSSPLRNIJPS-CQSZACIVSA-N 1 1 203.329 3.624 20 0 BHADMO CCC[N@H+]1CCCC[C@H]1c1ccccc1 ZINC000166217963 343348254 /nfs/dbraw/zinc/34/82/54/343348254.db2.gz HRXHSSPLRNIJPS-AWEZNQCLSA-N 1 1 203.329 3.624 20 0 BHADMO Cc1cccc([C@H](C)[NH2+][C@@H](C)c2cscn2)c1 ZINC000166950757 388435378 /nfs/dbraw/zinc/43/53/78/388435378.db2.gz PXAISMYNQFGQHL-RYUDHWBXSA-N 1 1 246.379 3.863 20 0 BHADMO Cc1cccc([C@H](C)[NH2+][C@H](C)c2cscn2)c1 ZINC000166950865 388434962 /nfs/dbraw/zinc/43/49/62/388434962.db2.gz PXAISMYNQFGQHL-NWDGAFQWSA-N 1 1 246.379 3.863 20 0 BHADMO CCC(CC)C[N@@H+](CC)Cc1ccc(O)cc1 ZINC000167849186 538944721 /nfs/dbraw/zinc/94/47/21/538944721.db2.gz SYYSIXWYKLYTLE-UHFFFAOYSA-N 1 1 235.371 3.650 20 0 BHADMO Cc1cc(F)ccc1Cn1cc[nH+]c1C(C)C ZINC000167986254 364827701 /nfs/dbraw/zinc/82/77/01/364827701.db2.gz SGEZIGIDUHRUBL-UHFFFAOYSA-N 1 1 232.302 3.502 20 0 BHADMO c1cc([NH2+]C2CCCCCC2)cc2c1NCC2 ZINC000168074583 134155472 /nfs/dbraw/zinc/15/54/72/134155472.db2.gz ZMJXWJMJDBXHDB-UHFFFAOYSA-N 1 1 230.355 3.789 20 0 BHADMO c1ccc([C@H]2CCC[N@H+](CC3CC3)CC2)cc1 ZINC000168274052 345723154 /nfs/dbraw/zinc/72/31/54/345723154.db2.gz OTPACPMXLWZIEU-INIZCTEOSA-N 1 1 229.367 3.666 20 0 BHADMO c1ccc([C@@H]2CCC[N@H+](CC3CC3)CC2)cc1 ZINC000168274146 345722957 /nfs/dbraw/zinc/72/29/57/345722957.db2.gz OTPACPMXLWZIEU-MRXNPFEDSA-N 1 1 229.367 3.666 20 0 BHADMO FC(F)(F)CCNc1[nH+]ccc2ccccc21 ZINC000168683909 364988735 /nfs/dbraw/zinc/98/87/35/364988735.db2.gz KSEQQBHZHPORGP-UHFFFAOYSA-N 1 1 240.228 3.599 20 0 BHADMO c1ccc2c(c1)cc[nH+]c2N[C@H]1CC=CCC1 ZINC000168699653 364990077 /nfs/dbraw/zinc/99/00/77/364990077.db2.gz ZYJJHJNQWCHWAT-ZDUSSCGKSA-N 1 1 224.307 3.755 20 0 BHADMO c1ccc2c(c1)cc[nH+]c2N[C@@H]1CC=CCC1 ZINC000168699744 364989579 /nfs/dbraw/zinc/98/95/79/364989579.db2.gz ZYJJHJNQWCHWAT-CYBMUJFWSA-N 1 1 224.307 3.755 20 0 BHADMO c1ccc2c(c1)cc[nH+]c2NC[C@@H]1CCCS1 ZINC000168706796 357193176 /nfs/dbraw/zinc/19/31/76/357193176.db2.gz YOXNQLDBHRUMBL-LBPRGKRZSA-N 1 1 244.363 3.542 20 0 BHADMO c1ccc2c(c1)cc[nH+]c2NC[C@H]1CCCS1 ZINC000168706900 357193050 /nfs/dbraw/zinc/19/30/50/357193050.db2.gz YOXNQLDBHRUMBL-GFCCVEGCSA-N 1 1 244.363 3.542 20 0 BHADMO C[C@@H](c1cc2ccccc2o1)[N@@H+](C)CCCF ZINC000169178889 134249393 /nfs/dbraw/zinc/24/93/93/134249393.db2.gz JEPWVQUXWKRIBA-NSHDSACASA-N 1 1 235.302 3.785 20 0 BHADMO C[C@H](c1cc2ccccc2o1)[N@@H+](C)CCCF ZINC000169178970 134249661 /nfs/dbraw/zinc/24/96/61/134249661.db2.gz JEPWVQUXWKRIBA-LLVKDONJSA-N 1 1 235.302 3.785 20 0 BHADMO FCC[NH+](Cc1ccccc1)Cc1ccccc1 ZINC000169414093 633161659 /nfs/dbraw/zinc/16/16/59/633161659.db2.gz JFMKSFQPWBQSFY-UHFFFAOYSA-N 1 1 243.325 3.658 20 0 BHADMO C[N@@H+](CCC1CCCCC1)Cc1cscn1 ZINC000170652247 346429577 /nfs/dbraw/zinc/42/95/77/346429577.db2.gz MNVMIKLXUNXOMP-UHFFFAOYSA-N 1 1 238.400 3.545 20 0 BHADMO C[N@H+](CCC1CCCCC1)Cc1cscn1 ZINC000170652247 346429573 /nfs/dbraw/zinc/42/95/73/346429573.db2.gz MNVMIKLXUNXOMP-UHFFFAOYSA-N 1 1 238.400 3.545 20 0 BHADMO CC[C@@H](C)[N@@H+](C)Cc1csc(C(C)(C)C)n1 ZINC000170790895 346450660 /nfs/dbraw/zinc/45/06/60/346450660.db2.gz UQMBNIUHVXBHDN-SNVBAGLBSA-N 1 1 240.416 3.671 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1csc(C(C)(C)C)n1 ZINC000170790898 346450443 /nfs/dbraw/zinc/45/04/43/346450443.db2.gz UQMBNIUHVXBHDN-JTQLQIEISA-N 1 1 240.416 3.671 20 0 BHADMO CCCC[N@@H+](CCCCO)[C@@H](C)c1ccccc1 ZINC000170871734 385453383 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/nfs/dbraw/zinc/23/75/72/384237572.db2.gz RFLGGPFGDXFBDU-NSHDSACASA-N 1 1 221.319 3.619 20 0 BHADMO C[C@H](c1ccccc1F)[N@@H+](C)CCC1CC1 ZINC000173543552 384238014 /nfs/dbraw/zinc/23/80/14/384238014.db2.gz RFLGGPFGDXFBDU-LLVKDONJSA-N 1 1 221.319 3.619 20 0 BHADMO CC(C)[N@H+](Cc1cccs1)CC1CCC1 ZINC000173567462 384233511 /nfs/dbraw/zinc/23/35/11/384233511.db2.gz ATNDKUAIHYGTPH-UHFFFAOYSA-N 1 1 223.385 3.759 20 0 BHADMO CC(C)C[N@@H+](Cc1ccncc1Cl)C(C)C ZINC000173573499 387899542 /nfs/dbraw/zinc/89/95/42/387899542.db2.gz CENKUDSHZUQHSI-UHFFFAOYSA-N 1 1 240.778 3.601 20 0 BHADMO C[C@@H](c1cccc(F)c1)[N@@H+](C)CCC1CC1 ZINC000173583726 534088815 /nfs/dbraw/zinc/08/88/15/534088815.db2.gz FGKIFHWVRDKRGA-NSHDSACASA-N 1 1 221.319 3.619 20 0 BHADMO C[C@H](c1cccc(F)c1)[N@@H+](C)CCC1CC1 ZINC000173583741 534127264 /nfs/dbraw/zinc/12/72/64/534127264.db2.gz FGKIFHWVRDKRGA-LLVKDONJSA-N 1 1 221.319 3.619 20 0 BHADMO C[N@@H+](CCc1c(F)cccc1Cl)C1CCC1 ZINC000173616721 529932542 /nfs/dbraw/zinc/93/25/42/529932542.db2.gz WBUIFFJSCOFMOL-UHFFFAOYSA-N 1 1 241.737 3.506 20 0 BHADMO Cc1cnc(C[N@@H+](CC2CC2)C2CCCCC2)o1 ZINC000173636693 384241009 /nfs/dbraw/zinc/24/10/09/384241009.db2.gz MJOUBHWEZSKLME-UHFFFAOYSA-N 1 1 248.370 3.528 20 0 BHADMO CCC[C@@H]1[C@H](C)CCC[N@H+]1CCc1ccccn1 ZINC000173702707 527877468 /nfs/dbraw/zinc/87/74/68/527877468.db2.gz HCVSYCVGGODVBR-GDBMZVCRSA-N 1 1 246.398 3.525 20 0 BHADMO CCC[C@H]1[C@H](C)CCC[N@H+]1CCc1ccccn1 ZINC000173702723 528445107 /nfs/dbraw/zinc/44/51/07/528445107.db2.gz HCVSYCVGGODVBR-ZBFHGGJFSA-N 1 1 246.398 3.525 20 0 BHADMO CCC[C@@H]1[C@@H](C)CCC[N@H+]1CCc1ccccn1 ZINC000173702736 527876657 /nfs/dbraw/zinc/87/66/57/527876657.db2.gz HCVSYCVGGODVBR-GOEBONIOSA-N 1 1 246.398 3.525 20 0 BHADMO CCC[C@H]1[C@@H](C)CCC[N@H+]1CCc1ccccn1 ZINC000173702750 528442804 /nfs/dbraw/zinc/44/28/04/528442804.db2.gz HCVSYCVGGODVBR-HOCLYGCPSA-N 1 1 246.398 3.525 20 0 BHADMO CCC[C@@H]1[C@H](C)CCC[N@H+]1CCc1ccncc1 ZINC000173705030 535510145 /nfs/dbraw/zinc/51/01/45/535510145.db2.gz NDDSJWLIONNNEX-GDBMZVCRSA-N 1 1 246.398 3.525 20 0 BHADMO CCC[C@H]1[C@H](C)CCC[N@H+]1CCc1ccncc1 ZINC000173705041 134276747 /nfs/dbraw/zinc/27/67/47/134276747.db2.gz NDDSJWLIONNNEX-ZBFHGGJFSA-N 1 1 246.398 3.525 20 0 BHADMO CCC[C@@H]1[C@@H](C)CCC[N@H+]1CCc1ccncc1 ZINC000173705049 535506910 /nfs/dbraw/zinc/50/69/10/535506910.db2.gz NDDSJWLIONNNEX-GOEBONIOSA-N 1 1 246.398 3.525 20 0 BHADMO CCC[C@H]1[C@@H](C)CCC[N@H+]1CCc1ccncc1 ZINC000173705057 134276709 /nfs/dbraw/zinc/27/67/09/134276709.db2.gz NDDSJWLIONNNEX-HOCLYGCPSA-N 1 1 246.398 3.525 20 0 BHADMO CCC[C@@H]1[C@H](C)CCC[N@H+]1CCc1cccnc1 ZINC000173706308 535509900 /nfs/dbraw/zinc/50/99/00/535509900.db2.gz GVOIUEHGCLLMEW-GDBMZVCRSA-N 1 1 246.398 3.525 20 0 BHADMO CCC[C@H]1[C@H](C)CCC[N@H+]1CCc1cccnc1 ZINC000173706321 134276816 /nfs/dbraw/zinc/27/68/16/134276816.db2.gz GVOIUEHGCLLMEW-ZBFHGGJFSA-N 1 1 246.398 3.525 20 0 BHADMO CCC[C@@H]1[C@@H](C)CCC[N@H+]1CCc1cccnc1 ZINC000173706332 535507082 /nfs/dbraw/zinc/50/70/82/535507082.db2.gz GVOIUEHGCLLMEW-GOEBONIOSA-N 1 1 246.398 3.525 20 0 BHADMO CCC[C@H]1[C@@H](C)CCC[N@H+]1CCc1cccnc1 ZINC000173706343 134276522 /nfs/dbraw/zinc/27/65/22/134276522.db2.gz GVOIUEHGCLLMEW-HOCLYGCPSA-N 1 1 246.398 3.525 20 0 BHADMO Cc1nc(C)c([C@@H](C)[N@@H+](C)CC2CCC2)s1 ZINC000173712422 229358145 /nfs/dbraw/zinc/35/81/45/229358145.db2.gz GRAFOLYKLVZNSC-SNVBAGLBSA-N 1 1 238.400 3.553 20 0 BHADMO Cc1nc(C)c([C@H](C)[N@@H+](C)CC2CCC2)s1 ZINC000173712431 229358514 /nfs/dbraw/zinc/35/85/14/229358514.db2.gz GRAFOLYKLVZNSC-JTQLQIEISA-N 1 1 238.400 3.553 20 0 BHADMO c1ccc([C@@H]2CSCC[N@@H+]2CC2CCC2)cc1 ZINC000173757092 384265907 /nfs/dbraw/zinc/26/59/07/384265907.db2.gz JFGRKZKGSQIUMJ-HNNXBMFYSA-N 1 1 247.407 3.577 20 0 BHADMO c1ccc([C@H]2CSCC[N@@H+]2CC2CCC2)cc1 ZINC000173757102 384264481 /nfs/dbraw/zinc/26/44/81/384264481.db2.gz JFGRKZKGSQIUMJ-OAHLLOKOSA-N 1 1 247.407 3.577 20 0 BHADMO Cc1cc(C[N@H+](C)C2CCC2)c2ccccc2n1 ZINC000173917961 384734733 /nfs/dbraw/zinc/73/47/33/384734733.db2.gz PJLZHMTYNANGKW-UHFFFAOYSA-N 1 1 240.350 3.528 20 0 BHADMO CCC[C@]1(C)CCC[N@@H+](CCc2cccnc2)C1 ZINC000174002348 134279836 /nfs/dbraw/zinc/27/98/36/134279836.db2.gz URRBUGGEIDNBLC-MRXNPFEDSA-N 1 1 246.398 3.526 20 0 BHADMO CCC[C@@]1(C)CCC[N@@H+](CCc2cccnc2)C1 ZINC000174002363 535552792 /nfs/dbraw/zinc/55/27/92/535552792.db2.gz URRBUGGEIDNBLC-INIZCTEOSA-N 1 1 246.398 3.526 20 0 BHADMO CCSCC[C@@H](C)[N@@H+](C)[C@H]1C=CCCC1 ZINC000174033015 134278321 /nfs/dbraw/zinc/27/83/21/134278321.db2.gz SFNLVKBYNVALBT-OLZOCXBDSA-N 1 1 227.417 3.559 20 0 BHADMO CCSCC[C@H](C)[N@@H+](C)[C@H]1C=CCCC1 ZINC000174033026 134278718 /nfs/dbraw/zinc/27/87/18/134278718.db2.gz SFNLVKBYNVALBT-STQMWFEESA-N 1 1 227.417 3.559 20 0 BHADMO CCC[N@H+]1CC[C@H](CSc2ccccc2)C1 ZINC000174143600 363057437 /nfs/dbraw/zinc/05/74/37/363057437.db2.gz TXTDFKRBJRDCNF-ZDUSSCGKSA-N 1 1 235.396 3.511 20 0 BHADMO CCC[N@H+]1CC[C@@H](CSc2ccccc2)C1 ZINC000174143614 363056778 /nfs/dbraw/zinc/05/67/78/363056778.db2.gz TXTDFKRBJRDCNF-CYBMUJFWSA-N 1 1 235.396 3.511 20 0 BHADMO c1cc(C[N@H+]2CCCC3(C2)CCCCCC3)no1 ZINC000174172693 134279380 /nfs/dbraw/zinc/27/93/80/134279380.db2.gz HYCHHNOYSAXUJA-UHFFFAOYSA-N 1 1 248.370 3.611 20 0 BHADMO c1csc(CC[N@H+]2CCC3(CCCC3)C2)c1 ZINC000174269196 641261164 /nfs/dbraw/zinc/26/11/64/641261164.db2.gz VXDWFNGHGBAWDA-UHFFFAOYSA-N 1 1 235.396 3.557 20 0 BHADMO CC[C@@H]1C[N@H+]([C@@H](C)c2ccccc2)CCS1 ZINC000174361309 365483406 /nfs/dbraw/zinc/48/34/06/365483406.db2.gz KTHZYQRKRSAEMG-GXTWGEPZSA-N 1 1 235.396 3.575 20 0 BHADMO CC[C@H]1C[N@H+]([C@@H](C)c2ccccc2)CCS1 ZINC000174361324 365483158 /nfs/dbraw/zinc/48/31/58/365483158.db2.gz KTHZYQRKRSAEMG-JSGCOSHPSA-N 1 1 235.396 3.575 20 0 BHADMO Cc1cccc([C@@H](C)[N@H+]2CCC[C@@H]2C)c1 ZINC000174407943 134281206 /nfs/dbraw/zinc/28/12/06/134281206.db2.gz LAFBQIMDSPGFLO-QWHCGFSZSA-N 1 1 203.329 3.540 20 0 BHADMO Cc1cccc([C@H](C)[N@H+]2CCC[C@@H]2C)c1 ZINC000174407956 134281472 /nfs/dbraw/zinc/28/14/72/134281472.db2.gz LAFBQIMDSPGFLO-STQMWFEESA-N 1 1 203.329 3.540 20 0 BHADMO Cc1cc(C[N@@H+]2CCC[C@@H]2C)c2ccccc2n1 ZINC000174414913 134282178 /nfs/dbraw/zinc/28/21/78/134282178.db2.gz BCKWWALUNHSTNO-ZDUSSCGKSA-N 1 1 240.350 3.528 20 0 BHADMO Cc1cc(C[N@@H+]2CCC[C@H]2C)c2ccccc2n1 ZINC000174414926 134281854 /nfs/dbraw/zinc/28/18/54/134281854.db2.gz BCKWWALUNHSTNO-CYBMUJFWSA-N 1 1 240.350 3.528 20 0 BHADMO CCC[C@]1(C)CCC[N@@H+](Cc2cscn2)C1 ZINC000174452704 384793614 /nfs/dbraw/zinc/79/36/14/384793614.db2.gz XSBFKQWEKDSOTC-CYBMUJFWSA-N 1 1 238.400 3.545 20 0 BHADMO CCC[C@]1(C)CCC[N@H+](Cc2cscn2)C1 ZINC000174452704 384793605 /nfs/dbraw/zinc/79/36/05/384793605.db2.gz XSBFKQWEKDSOTC-CYBMUJFWSA-N 1 1 238.400 3.545 20 0 BHADMO CCC[C@@]1(C)CCC[N@@H+](Cc2cscn2)C1 ZINC000174452716 384794758 /nfs/dbraw/zinc/79/47/58/384794758.db2.gz XSBFKQWEKDSOTC-ZDUSSCGKSA-N 1 1 238.400 3.545 20 0 BHADMO CCC[C@@]1(C)CCC[N@H+](Cc2cscn2)C1 ZINC000174452716 384794752 /nfs/dbraw/zinc/79/47/52/384794752.db2.gz XSBFKQWEKDSOTC-ZDUSSCGKSA-N 1 1 238.400 3.545 20 0 BHADMO CCC[C@]1(C)CCC[N@@H+](CCc2ccncc2)C1 ZINC000174454308 134281692 /nfs/dbraw/zinc/28/16/92/134281692.db2.gz ZVVUEZLBHXPOHL-MRXNPFEDSA-N 1 1 246.398 3.526 20 0 BHADMO CCC[C@@]1(C)CCC[N@@H+](CCc2ccncc2)C1 ZINC000174454321 535553718 /nfs/dbraw/zinc/55/37/18/535553718.db2.gz ZVVUEZLBHXPOHL-INIZCTEOSA-N 1 1 246.398 3.526 20 0 BHADMO c1cc(CNc2cc[nH+]c3ccsc32)co1 ZINC000174698820 384356113 /nfs/dbraw/zinc/35/61/13/384356113.db2.gz ZBTLAWCOTUINEI-UHFFFAOYSA-N 1 1 230.292 3.501 20 0 BHADMO CC[N@@H+](Cc1ccncc1Cl)[C@@H](C)C(C)C ZINC000174863734 528861446 /nfs/dbraw/zinc/86/14/46/528861446.db2.gz CRADDNIKMDDMFO-NSHDSACASA-N 1 1 240.778 3.601 20 0 BHADMO CC[N@@H+](Cc1ccncc1Cl)[C@H](C)C(C)C ZINC000174863746 528862018 /nfs/dbraw/zinc/86/20/18/528862018.db2.gz CRADDNIKMDDMFO-LLVKDONJSA-N 1 1 240.778 3.601 20 0 BHADMO C[N@@H+](CCC1CCCCC1)Cc1nccs1 ZINC000175064988 536322872 /nfs/dbraw/zinc/32/28/72/536322872.db2.gz ARSIXOPGRRKJIN-UHFFFAOYSA-N 1 1 238.400 3.545 20 0 BHADMO C[N@H+](CCC1CCCCC1)Cc1nccs1 ZINC000175064988 536322869 /nfs/dbraw/zinc/32/28/69/536322869.db2.gz ARSIXOPGRRKJIN-UHFFFAOYSA-N 1 1 238.400 3.545 20 0 BHADMO CC[C@@H](c1ccccc1)[N@@H+](C)Cc1nccs1 ZINC000175075875 346891725 /nfs/dbraw/zinc/89/17/25/346891725.db2.gz SUDRQKUTQYUMNG-ZDUSSCGKSA-N 1 1 246.379 3.726 20 0 BHADMO CC[C@@H](c1ccccc1)[N@H+](C)Cc1nccs1 ZINC000175075875 346891717 /nfs/dbraw/zinc/89/17/17/346891717.db2.gz SUDRQKUTQYUMNG-ZDUSSCGKSA-N 1 1 246.379 3.726 20 0 BHADMO CC[C@H](c1ccccc1)[N@@H+](C)Cc1nccs1 ZINC000175075890 384866880 /nfs/dbraw/zinc/86/68/80/384866880.db2.gz SUDRQKUTQYUMNG-CYBMUJFWSA-N 1 1 246.379 3.726 20 0 BHADMO CC[C@H](c1ccccc1)[N@H+](C)Cc1nccs1 ZINC000175075890 384866873 /nfs/dbraw/zinc/86/68/73/384866873.db2.gz SUDRQKUTQYUMNG-CYBMUJFWSA-N 1 1 246.379 3.726 20 0 BHADMO CC(C)CC[N@H+]1CCCC[C@@H]1c1cccn1C ZINC000175115801 527724834 /nfs/dbraw/zinc/72/48/34/527724834.db2.gz ABCDVQVAXOSXLB-OAHLLOKOSA-N 1 1 234.387 3.598 20 0 BHADMO CC(C)CC[N@H+]1CCCC[C@H]1c1cccn1C ZINC000175115819 527726625 /nfs/dbraw/zinc/72/66/25/527726625.db2.gz ABCDVQVAXOSXLB-HNNXBMFYSA-N 1 1 234.387 3.598 20 0 BHADMO Cn1cccc1[C@@H]1CCCC[N@H+]1[C@H]1C=CCCC1 ZINC000175118872 229215947 /nfs/dbraw/zinc/21/59/47/229215947.db2.gz WRBGKXKZIYVDSW-HOCLYGCPSA-N 1 1 244.382 3.661 20 0 BHADMO Cn1cccc1[C@H]1CCCC[N@H+]1[C@H]1C=CCCC1 ZINC000175118890 229215906 /nfs/dbraw/zinc/21/59/06/229215906.db2.gz WRBGKXKZIYVDSW-GOEBONIOSA-N 1 1 244.382 3.661 20 0 BHADMO CC(C)=CC[N@@H+]1CCCC[C@@H]1c1cccn1C ZINC000175133096 365532663 /nfs/dbraw/zinc/53/26/63/365532663.db2.gz JYLYRXOSAKILKQ-OAHLLOKOSA-N 1 1 232.371 3.518 20 0 BHADMO CC(C)=CC[N@@H+]1CCCC[C@H]1c1cccn1C ZINC000175133118 365531946 /nfs/dbraw/zinc/53/19/46/365531946.db2.gz JYLYRXOSAKILKQ-HNNXBMFYSA-N 1 1 232.371 3.518 20 0 BHADMO CSCCC[N@@H+](C)Cc1cc2ccccc2o1 ZINC000175178085 134286000 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C[C@@H](c1ccccn1)[N@H+]1CCC2(C1)CCCCC2 ZINC000177297503 176027853 /nfs/dbraw/zinc/02/78/53/176027853.db2.gz KLWQHPQKVNMCAB-AWEZNQCLSA-N 1 1 244.382 3.799 20 0 BHADMO C[C@H](c1ccccn1)[N@H+]1CCC2(C1)CCCCC2 ZINC000177297521 177043420 /nfs/dbraw/zinc/04/34/20/177043420.db2.gz KLWQHPQKVNMCAB-CQSZACIVSA-N 1 1 244.382 3.799 20 0 BHADMO CC(C)C[C@@H]1CC[N@H+]([C@@H](C)c2ccccn2)C1 ZINC000177361003 134297510 /nfs/dbraw/zinc/29/75/10/134297510.db2.gz AQIMCNWSWFICDV-KBPBESRZSA-N 1 1 232.371 3.511 20 0 BHADMO CC(C)C[C@H]1CC[N@H+]([C@@H](C)c2ccccn2)C1 ZINC000177361023 134297685 /nfs/dbraw/zinc/29/76/85/134297685.db2.gz AQIMCNWSWFICDV-UONOGXRCSA-N 1 1 232.371 3.511 20 0 BHADMO C[C@@H](c1ccccc1)[N@H+]1CCSC(C)(C)C1 ZINC000177510308 134298445 /nfs/dbraw/zinc/29/84/45/134298445.db2.gz RHAJURHAQFZTAT-LBPRGKRZSA-N 1 1 235.396 3.575 20 0 BHADMO C[C@H](c1ccccc1)[N@H+]1CCSC(C)(C)C1 ZINC000177510325 134298669 /nfs/dbraw/zinc/29/86/69/134298669.db2.gz RHAJURHAQFZTAT-GFCCVEGCSA-N 1 1 235.396 3.575 20 0 BHADMO CCCCCC[N@@H+](C)Cc1ccc(Cl)nc1 ZINC000177623785 643454180 /nfs/dbraw/zinc/45/41/80/643454180.db2.gz CDOPADLGTDCTRF-UHFFFAOYSA-N 1 1 240.778 3.747 20 0 BHADMO C[N@@H+](CCC(C)(C)C)Cc1ccc(Cl)nc1 ZINC000177624923 632851401 /nfs/dbraw/zinc/85/14/01/632851401.db2.gz CXNCNUDKNCCUMG-UHFFFAOYSA-N 1 1 240.778 3.603 20 0 BHADMO CCCC[N@@H+](C)[C@@H](C)c1ncc(C(C)(C)C)o1 ZINC000177632560 388487803 /nfs/dbraw/zinc/48/78/03/388487803.db2.gz PRGZGENHOLUIRP-NSHDSACASA-N 1 1 238.375 3.765 20 0 BHADMO CCCC[N@@H+](C)[C@H](C)c1ncc(C(C)(C)C)o1 ZINC000177632574 388488160 /nfs/dbraw/zinc/48/81/60/388488160.db2.gz PRGZGENHOLUIRP-LLVKDONJSA-N 1 1 238.375 3.765 20 0 BHADMO C[N@@H+](Cc1ccco1)[C@@H]1CCc2ccc(F)cc21 ZINC000177674083 385271301 /nfs/dbraw/zinc/27/13/01/385271301.db2.gz JYXHKBNOMALSDW-OAHLLOKOSA-N 1 1 245.297 3.538 20 0 BHADMO C[N@@H+](Cc1ccco1)[C@H]1CCc2ccc(F)cc21 ZINC000177674099 385270946 /nfs/dbraw/zinc/27/09/46/385270946.db2.gz JYXHKBNOMALSDW-HNNXBMFYSA-N 1 1 245.297 3.538 20 0 BHADMO CC(C)C[N@@H+](C/C(Cl)=C/Cl)C(C)C ZINC000177704696 632865013 /nfs/dbraw/zinc/86/50/13/632865013.db2.gz NAOJXVLSSKSTTG-YHYXMXQVSA-N 1 1 224.175 3.672 20 0 BHADMO Cl/C=C(\Cl)C[N@H+]1CCC[C@@H]2CCC[C@H]21 ZINC000177769147 643657459 /nfs/dbraw/zinc/65/74/59/643657459.db2.gz ZKZFIWLRXQWWIP-HLLGUJQBSA-N 1 1 234.170 3.570 20 0 BHADMO CC[C@@H](C)C[N@@H+](CC)Cc1sc(C)nc1C ZINC000177848288 385127237 /nfs/dbraw/zinc/12/72/37/385127237.db2.gz DVXSBBZFSKDPIV-SNVBAGLBSA-N 1 1 240.416 3.628 20 0 BHADMO CC[C@H](C)C[N@@H+](CC)Cc1sc(C)nc1C ZINC000177848297 385126127 /nfs/dbraw/zinc/12/61/27/385126127.db2.gz DVXSBBZFSKDPIV-JTQLQIEISA-N 1 1 240.416 3.628 20 0 BHADMO CCc1nc(C[N@H+](CC)C[C@@H](C)CC)cs1 ZINC000177848731 134303777 /nfs/dbraw/zinc/30/37/77/134303777.db2.gz RPBBTQMEAUITQE-NSHDSACASA-N 1 1 240.416 3.574 20 0 BHADMO CCc1nc(C[N@H+](CC)C[C@H](C)CC)cs1 ZINC000177848744 134303687 /nfs/dbraw/zinc/30/36/87/134303687.db2.gz RPBBTQMEAUITQE-LLVKDONJSA-N 1 1 240.416 3.574 20 0 BHADMO CC[C@@H](C)C[N@@H+](CC)Cc1nc2ccccc2o1 ZINC000177857081 388492490 /nfs/dbraw/zinc/49/24/90/388492490.db2.gz KOIVNCLLUHUYRU-GFCCVEGCSA-N 1 1 246.354 3.696 20 0 BHADMO CC[C@H](C)C[N@@H+](CC)Cc1nc2ccccc2o1 ZINC000177857092 388492559 /nfs/dbraw/zinc/49/25/59/388492559.db2.gz KOIVNCLLUHUYRU-LBPRGKRZSA-N 1 1 246.354 3.696 20 0 BHADMO CC[C@@H](C)C[N@@H+](CC)Cc1ccncc1Cl ZINC000177857356 535509152 /nfs/dbraw/zinc/50/91/52/535509152.db2.gz GQBVGJZRSAWGJW-LLVKDONJSA-N 1 1 240.778 3.603 20 0 BHADMO CC[C@H](C)C[N@@H+](CC)Cc1ccncc1Cl ZINC000177857367 134303215 /nfs/dbraw/zinc/30/32/15/134303215.db2.gz GQBVGJZRSAWGJW-NSHDSACASA-N 1 1 240.778 3.603 20 0 BHADMO CCC(CC)[N@H+](Cc1ccccn1)CC(C)C ZINC000177863056 134303257 /nfs/dbraw/zinc/30/32/57/134303257.db2.gz MNALBAJIHDEGSC-UHFFFAOYSA-N 1 1 234.387 3.728 20 0 BHADMO CCC(CC)[N@@H+](CC(C)C)CC1CCOCC1 ZINC000177863567 346941731 /nfs/dbraw/zinc/94/17/31/346941731.db2.gz OAXZBSYCFFLNGB-UHFFFAOYSA-N 1 1 241.419 3.560 20 0 BHADMO CCC(CC)[N@@H+](CCc1ccccn1)CC(C)C ZINC000177864422 388492013 /nfs/dbraw/zinc/49/20/13/388492013.db2.gz PZIUNGBJQYVXDL-UHFFFAOYSA-N 1 1 248.414 3.771 20 0 BHADMO CCC(CC)[N@H+](Cc1cc(C)no1)CC(C)C ZINC000177864749 366068846 /nfs/dbraw/zinc/06/88/46/366068846.db2.gz OQAKXGJEIIPPOY-UHFFFAOYSA-N 1 1 238.375 3.630 20 0 BHADMO CCC(CC)[N@H+](Cc1cc(C)on1)CC(C)C ZINC000177864847 388492666 /nfs/dbraw/zinc/49/26/66/388492666.db2.gz CGUDNQMHRCKQBO-UHFFFAOYSA-N 1 1 238.375 3.630 20 0 BHADMO CCC(CC)[N@@H+](CCc1ccncc1)CC(C)C ZINC000177864925 366069063 /nfs/dbraw/zinc/06/90/63/366069063.db2.gz GIVQNAJFJPYBFD-UHFFFAOYSA-N 1 1 248.414 3.771 20 0 BHADMO CCC(CC)[N@@H+](CCc1cccnc1)CC(C)C ZINC000177865467 388492584 /nfs/dbraw/zinc/49/25/84/388492584.db2.gz FMBVKBVQAKGFMK-UHFFFAOYSA-N 1 1 248.414 3.771 20 0 BHADMO CCC(CC)[N@@H+](CCCCOC)CC(C)C ZINC000177866178 388491957 /nfs/dbraw/zinc/49/19/57/388491957.db2.gz KICXNJITJWCTNP-UHFFFAOYSA-N 1 1 229.408 3.560 20 0 BHADMO CCC(CC)[N@H+](Cc1ncc(C)o1)CC(C)C ZINC000177866207 134303458 /nfs/dbraw/zinc/30/34/58/134303458.db2.gz SKJCVSMQIYXOEG-UHFFFAOYSA-N 1 1 238.375 3.630 20 0 BHADMO C[C@@H]1CC[N@@H+](Cc2nc3ccccc3s2)[C@@H]1C ZINC000177891991 134303800 /nfs/dbraw/zinc/30/38/00/134303800.db2.gz ULQIGZZNBLDDKH-GHMZBOCLSA-N 1 1 246.379 3.527 20 0 BHADMO C[C@@H]1[C@@H](C)CC[N@H+]1Cc1nc2ccccc2s1 ZINC000177892002 134303867 /nfs/dbraw/zinc/30/38/67/134303867.db2.gz ULQIGZZNBLDDKH-WDEREUQCSA-N 1 1 246.379 3.527 20 0 BHADMO CC(C)C[N@@H+](CCc1cccnc1)CC(C)(C)C ZINC000177898915 388524186 /nfs/dbraw/zinc/52/41/86/388524186.db2.gz ACFZODQAGYFBQJ-UHFFFAOYSA-N 1 1 248.414 3.628 20 0 BHADMO CC(C)CC[C@@H]1CCC[N@H+]1Cc1cscn1 ZINC000177934634 534925735 /nfs/dbraw/zinc/92/57/35/534925735.db2.gz IJFRYXVHCSCSCM-ZDUSSCGKSA-N 1 1 238.400 3.544 20 0 BHADMO CC(C)CC[C@H]1CCC[N@H+]1Cc1cscn1 ZINC000177934649 534955958 /nfs/dbraw/zinc/95/59/58/534955958.db2.gz IJFRYXVHCSCSCM-CYBMUJFWSA-N 1 1 238.400 3.544 20 0 BHADMO CCC[C@H](C)[C@@H]1CCC[N@H+]1Cc1cscn1 ZINC000177935505 535656226 /nfs/dbraw/zinc/65/62/26/535656226.db2.gz AFQQVAKXURWFQQ-AAEUAGOBSA-N 1 1 238.400 3.544 20 0 BHADMO CCC[C@@H](C)[C@H]1CCC[N@H+]1Cc1cscn1 ZINC000177935519 136274238 /nfs/dbraw/zinc/27/42/38/136274238.db2.gz AFQQVAKXURWFQQ-DGCLKSJQSA-N 1 1 238.400 3.544 20 0 BHADMO CCC[C@H](C)[C@H]1CCC[N@H+]1Cc1cscn1 ZINC000177935533 535658799 /nfs/dbraw/zinc/65/87/99/535658799.db2.gz AFQQVAKXURWFQQ-WCQYABFASA-N 1 1 238.400 3.544 20 0 BHADMO Cc1cnc(C[NH2+][C@H](C)c2ccc(C)cc2)s1 ZINC000177961941 387921306 /nfs/dbraw/zinc/92/13/06/387921306.db2.gz XTAUEBREWYBFAW-GFCCVEGCSA-N 1 1 246.379 3.611 20 0 BHADMO Cc1cnc(C[NH2+][C@@H](C)c2ccc(C)cc2)s1 ZINC000177961956 387920802 /nfs/dbraw/zinc/92/08/02/387920802.db2.gz XTAUEBREWYBFAW-LBPRGKRZSA-N 1 1 246.379 3.611 20 0 BHADMO CC(C)[N@@H+](C)Cc1ccc(Cl)c2cccnc12 ZINC000177993647 385317037 /nfs/dbraw/zinc/31/70/37/385317037.db2.gz VPUJLRYHSBJCAU-UHFFFAOYSA-N 1 1 248.757 3.728 20 0 BHADMO CC(C)[N@@H+](C)Cc1cc(Cl)cc2cccnc21 ZINC000177993691 187307653 /nfs/dbraw/zinc/30/76/53/187307653.db2.gz IGYJSJWSTWZDLM-UHFFFAOYSA-N 1 1 248.757 3.728 20 0 BHADMO CC(C)C[N@@H+](Cc1cscn1)CC(C)(C)C ZINC000177994894 366074821 /nfs/dbraw/zinc/07/48/21/366074821.db2.gz NEJBSSQTECGHBP-UHFFFAOYSA-N 1 1 240.416 3.647 20 0 BHADMO Cc1ccc2c(c1)[C@H](Nc1cc(C)cc[nH+]1)CC2 ZINC000178051868 366081045 /nfs/dbraw/zinc/08/10/45/366081045.db2.gz ITFLHEFAPPZLAT-OAHLLOKOSA-N 1 1 238.334 3.798 20 0 BHADMO Cc1ccc2c(c1)[C@@H](Nc1cc(C)cc[nH+]1)CC2 ZINC000178051880 366079996 /nfs/dbraw/zinc/07/99/96/366079996.db2.gz ITFLHEFAPPZLAT-HNNXBMFYSA-N 1 1 238.334 3.798 20 0 BHADMO CCc1oc2ccccc2c1C[N@@H+](C)CCCF ZINC000178247009 134305261 /nfs/dbraw/zinc/30/52/61/134305261.db2.gz XXTXDJGGJUUDFR-UHFFFAOYSA-N 1 1 249.329 3.787 20 0 BHADMO CC[N@@H+](CCCF)Cc1ccc(Cl)s1 ZINC000178256679 134305175 /nfs/dbraw/zinc/30/51/75/134305175.db2.gz UZOPBWIQGXTZJF-UHFFFAOYSA-N 1 1 235.755 3.583 20 0 BHADMO FCCC[N@H+]1CCC[C@H]1c1ccc(Cl)cc1 ZINC000178267579 388497088 /nfs/dbraw/zinc/49/70/88/388497088.db2.gz ZQMRKIAPBADRGP-ZDUSSCGKSA-N 1 1 241.737 3.837 20 0 BHADMO FCCC[N@H+]1CCC[C@@H]1c1ccc(Cl)cc1 ZINC000178267591 388497472 /nfs/dbraw/zinc/49/74/72/388497472.db2.gz ZQMRKIAPBADRGP-CYBMUJFWSA-N 1 1 241.737 3.837 20 0 BHADMO CC[C@@H](C)[N@@H+](CCCF)Cc1ccccc1 ZINC000178280100 388497465 /nfs/dbraw/zinc/49/74/65/388497465.db2.gz LAQCVEDJCCNAOB-CYBMUJFWSA-N 1 1 223.335 3.647 20 0 BHADMO CC[C@H](C)[N@@H+](CCCF)Cc1ccccc1 ZINC000178280114 388497526 /nfs/dbraw/zinc/49/75/26/388497526.db2.gz LAQCVEDJCCNAOB-ZDUSSCGKSA-N 1 1 223.335 3.647 20 0 BHADMO CC(C)c1ccc(C[N@@H+](C)CCCF)cc1 ZINC000178287331 388498284 /nfs/dbraw/zinc/49/82/84/388498284.db2.gz AYMSCFAJHCLCQR-UHFFFAOYSA-N 1 1 223.335 3.601 20 0 BHADMO C[N@@H+](CCCF)Cc1cccc2ccccc21 ZINC000178307124 134306067 /nfs/dbraw/zinc/30/60/67/134306067.db2.gz SKLYEJZNEFYNNP-UHFFFAOYSA-N 1 1 231.314 3.631 20 0 BHADMO FCCC[N@H+]1CCCCC[C@H]1c1ccccc1 ZINC000178308133 388498504 /nfs/dbraw/zinc/49/85/04/388498504.db2.gz QMTGSOXXUJCEKA-HNNXBMFYSA-N 1 1 235.346 3.963 20 0 BHADMO FCCC[N@H+]1CCCCC[C@@H]1c1ccccc1 ZINC000178308150 388498220 /nfs/dbraw/zinc/49/82/20/388498220.db2.gz QMTGSOXXUJCEKA-OAHLLOKOSA-N 1 1 235.346 3.963 20 0 BHADMO FC(F)(F)CC[N@@H+](CC1CC1)C1CCCC1 ZINC000178334740 366115105 /nfs/dbraw/zinc/11/51/05/366115105.db2.gz ACWQNFSWDLGCLS-UHFFFAOYSA-N 1 1 235.293 3.593 20 0 BHADMO CC[N@@H+](CC=C(C)C)[C@@H](C)c1cccc(O)c1 ZINC000178372753 366117466 /nfs/dbraw/zinc/11/74/66/366117466.db2.gz KZOUGAZQPHDPQG-ZDUSSCGKSA-N 1 1 233.355 3.741 20 0 BHADMO CC[N@@H+](CC=C(C)C)[C@H](C)c1cccc(O)c1 ZINC000178372769 366118176 /nfs/dbraw/zinc/11/81/76/366118176.db2.gz KZOUGAZQPHDPQG-CYBMUJFWSA-N 1 1 233.355 3.741 20 0 BHADMO CC[N@@H+](C/C=C/Cl)[C@@H](C)c1cccc(O)c1 ZINC000178372837 385360781 /nfs/dbraw/zinc/36/07/81/385360781.db2.gz HZZPMCIRVYYZJV-BWNDKRECSA-N 1 1 239.746 3.528 20 0 BHADMO CC[N@@H+](C/C=C/Cl)[C@H](C)c1cccc(O)c1 ZINC000178372859 385360390 /nfs/dbraw/zinc/36/03/90/385360390.db2.gz HZZPMCIRVYYZJV-AYLMVEPYSA-N 1 1 239.746 3.528 20 0 BHADMO CC[N@@H+]([C@@H](C)c1cccc(O)c1)[C@H]1C=CCCC1 ZINC000178374643 388499680 /nfs/dbraw/zinc/49/96/80/388499680.db2.gz DKHQSVWXJSWNGL-ZFWWWQNUSA-N 1 1 245.366 3.884 20 0 BHADMO CC[N@@H+]([C@@H](C)c1cccc(O)c1)[C@@H]1C=CCCC1 ZINC000178374657 388499922 /nfs/dbraw/zinc/49/99/22/388499922.db2.gz DKHQSVWXJSWNGL-DZGCQCFKSA-N 1 1 245.366 3.884 20 0 BHADMO CC[N@@H+](CC1CCC1)[C@@H](C)c1cccc(O)c1 ZINC000178380423 388499885 /nfs/dbraw/zinc/49/98/85/388499885.db2.gz RMTKVMUABRIXMH-LBPRGKRZSA-N 1 1 233.355 3.575 20 0 BHADMO CC[N@@H+](CC1CCC1)[C@H](C)c1cccc(O)c1 ZINC000178380445 388499477 /nfs/dbraw/zinc/49/94/77/388499477.db2.gz RMTKVMUABRIXMH-GFCCVEGCSA-N 1 1 233.355 3.575 20 0 BHADMO CCOc1ccccc1C[NH2+][C@@H](C)c1ccoc1 ZINC000178467711 366127785 /nfs/dbraw/zinc/12/77/85/366127785.db2.gz VPLABBSYNGWIFL-LBPRGKRZSA-N 1 1 245.322 3.529 20 0 BHADMO CCOc1ccccc1C[NH2+][C@H](C)c1ccoc1 ZINC000178467722 366126983 /nfs/dbraw/zinc/12/69/83/366126983.db2.gz VPLABBSYNGWIFL-GFCCVEGCSA-N 1 1 245.322 3.529 20 0 BHADMO C[N@@H+](Cc1ccco1)Cc1cc2ccccc2o1 ZINC000178509633 388500735 /nfs/dbraw/zinc/50/07/35/388500735.db2.gz PRMLNHAPJZBJLZ-UHFFFAOYSA-N 1 1 241.290 3.658 20 0 BHADMO CC(C)[N@@H+](Cc1cc2ccccc2o1)C1CC1 ZINC000178513567 535088382 /nfs/dbraw/zinc/08/83/82/535088382.db2.gz NUPAHRDVUCVRNE-UHFFFAOYSA-N 1 1 229.323 3.806 20 0 BHADMO CSCC[N@@H+](C1CC1)[C@@H]1CCc2ccccc21 ZINC000178515576 366133274 /nfs/dbraw/zinc/13/32/74/366133274.db2.gz IXZFOJMTQYMFKF-OAHLLOKOSA-N 1 1 247.407 3.501 20 0 BHADMO CSCC[N@@H+](C1CC1)[C@H]1CCc2ccccc21 ZINC000178515592 366132440 /nfs/dbraw/zinc/13/24/40/366132440.db2.gz IXZFOJMTQYMFKF-HNNXBMFYSA-N 1 1 247.407 3.501 20 0 BHADMO C[C@@H](C1CC1)[N@@H+](C)Cc1cc2ccccc2o1 ZINC000178519065 388502222 /nfs/dbraw/zinc/50/22/22/388502222.db2.gz RIDDQSBYSIKPII-NSHDSACASA-N 1 1 229.323 3.663 20 0 BHADMO C[C@H](C1CC1)[N@@H+](C)Cc1cc2ccccc2o1 ZINC000178519076 388501856 /nfs/dbraw/zinc/50/18/56/388501856.db2.gz RIDDQSBYSIKPII-LLVKDONJSA-N 1 1 229.323 3.663 20 0 BHADMO CC[N@@H+](Cc1cc2ccccc2o1)C(C)C ZINC000178523239 388502235 /nfs/dbraw/zinc/50/22/35/388502235.db2.gz AWMVLEYBTNMTFK-UHFFFAOYSA-N 1 1 217.312 3.663 20 0 BHADMO CC[C@@H](C)[N@@H+](C)Cc1cc2ccccc2o1 ZINC000178526116 388501736 /nfs/dbraw/zinc/50/17/36/388501736.db2.gz OCFNNXHIDYMDNV-LLVKDONJSA-N 1 1 217.312 3.663 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1cc2ccccc2o1 ZINC000178526126 388502031 /nfs/dbraw/zinc/50/20/31/388502031.db2.gz OCFNNXHIDYMDNV-NSHDSACASA-N 1 1 217.312 3.663 20 0 BHADMO CC(C)CC[C@@H]1CCC[N@H+]1CCc1cccnc1 ZINC000178549776 534925165 /nfs/dbraw/zinc/92/51/65/534925165.db2.gz CVHCANOALWIAHW-INIZCTEOSA-N 1 1 246.398 3.525 20 0 BHADMO CC(C)CC[C@H]1CCC[N@H+]1CCc1cccnc1 ZINC000178549788 534956322 /nfs/dbraw/zinc/95/63/22/534956322.db2.gz CVHCANOALWIAHW-MRXNPFEDSA-N 1 1 246.398 3.525 20 0 BHADMO CCC[C@@H](C)[C@@H]1CCC[N@H+]1CCc1cccnc1 ZINC000178553095 134307811 /nfs/dbraw/zinc/30/78/11/134307811.db2.gz CVMVORPTCZFZCM-ZBFHGGJFSA-N 1 1 246.398 3.525 20 0 BHADMO CCC[C@H](C)[C@@H]1CCC[N@H+]1CCc1cccnc1 ZINC000178553185 535655676 /nfs/dbraw/zinc/65/56/76/535655676.db2.gz CVMVORPTCZFZCM-HOCLYGCPSA-N 1 1 246.398 3.525 20 0 BHADMO CCC[C@@H](C)[C@H]1CCC[N@H+]1CCc1cccnc1 ZINC000178553201 134307919 /nfs/dbraw/zinc/30/79/19/134307919.db2.gz CVMVORPTCZFZCM-GDBMZVCRSA-N 1 1 246.398 3.525 20 0 BHADMO CCC[C@H](C)[C@H]1CCC[N@H+]1CCc1cccnc1 ZINC000178553207 535659174 /nfs/dbraw/zinc/65/91/74/535659174.db2.gz CVMVORPTCZFZCM-GOEBONIOSA-N 1 1 246.398 3.525 20 0 BHADMO CC(C)[N@@H+](Cc1cscn1)C1CCCCC1 ZINC000178670618 388503679 /nfs/dbraw/zinc/50/36/79/388503679.db2.gz TUARHXMWRAALJW-UHFFFAOYSA-N 1 1 238.400 3.686 20 0 BHADMO Cc1cccc([C@@H]2CCC[N@@H+]2CCC(C)C)n1 ZINC000178672565 346962072 /nfs/dbraw/zinc/96/20/72/346962072.db2.gz YGNCMMOEVDCFJL-HNNXBMFYSA-N 1 1 232.371 3.573 20 0 BHADMO Cc1cccc([C@H]2CCC[N@@H+]2CCC(C)C)n1 ZINC000178672574 134312952 /nfs/dbraw/zinc/31/29/52/134312952.db2.gz YGNCMMOEVDCFJL-OAHLLOKOSA-N 1 1 232.371 3.573 20 0 BHADMO Cc1cccc([C@@H]2CCC[N@H+]2[C@H]2C=CCCC2)n1 ZINC000178673303 134312996 /nfs/dbraw/zinc/31/29/96/134312996.db2.gz JWCBZRHUSOPZLY-HOCLYGCPSA-N 1 1 242.366 3.636 20 0 BHADMO Cc1cccc([C@H]2CCC[N@H+]2[C@H]2C=CCCC2)n1 ZINC000178673318 134312931 /nfs/dbraw/zinc/31/29/31/134312931.db2.gz JWCBZRHUSOPZLY-GOEBONIOSA-N 1 1 242.366 3.636 20 0 BHADMO CCC(C)(C)[C@@H]1CCC[N@H+]1CCc1cccnc1 ZINC000178907533 134313250 /nfs/dbraw/zinc/31/32/50/134313250.db2.gz NNKRJUSDWRQENW-HNNXBMFYSA-N 1 1 246.398 3.525 20 0 BHADMO CCC(C)(C)[C@H]1CCC[N@H+]1CCc1cccnc1 ZINC000178907550 134313443 /nfs/dbraw/zinc/31/34/43/134313443.db2.gz NNKRJUSDWRQENW-OAHLLOKOSA-N 1 1 246.398 3.525 20 0 BHADMO CC[N@@H+](Cc1ccc(OC)c(Cl)c1)C(C)C ZINC000178983840 366196555 /nfs/dbraw/zinc/19/65/55/366196555.db2.gz PVAHGIFRRSEBDR-UHFFFAOYSA-N 1 1 241.762 3.579 20 0 BHADMO CC(C)C[C@@H]1CCCC[N@H+]1Cc1cscn1 ZINC000179039798 134314620 /nfs/dbraw/zinc/31/46/20/134314620.db2.gz SDFJMHXZDSQYDZ-ZDUSSCGKSA-N 1 1 238.400 3.544 20 0 BHADMO CC(C)C[C@H]1CCCC[N@H+]1Cc1cscn1 ZINC000179039811 134314738 /nfs/dbraw/zinc/31/47/38/134314738.db2.gz SDFJMHXZDSQYDZ-CYBMUJFWSA-N 1 1 238.400 3.544 20 0 BHADMO CCCc1[nH+]ccn1Cc1cc(C)sc1C ZINC000179175566 366217605 /nfs/dbraw/zinc/21/76/05/366217605.db2.gz DLJOUIHKDYXABW-UHFFFAOYSA-N 1 1 234.368 3.562 20 0 BHADMO COCc1cccc(C[N@@H+](C)C2CCCCC2)c1 ZINC000179190728 386625191 /nfs/dbraw/zinc/62/51/91/386625191.db2.gz KXENYAAZMFOXEV-UHFFFAOYSA-N 1 1 247.382 3.598 20 0 BHADMO CC[N@@H+](Cc1cccc(COC)c1)C1CCCC1 ZINC000179197016 366222168 /nfs/dbraw/zinc/22/21/68/366222168.db2.gz SFMHCZBMFWDSRY-UHFFFAOYSA-N 1 1 247.382 3.598 20 0 BHADMO COCc1cccc(C[N@@H+](C(C)C)C2CCC2)c1 ZINC000179237676 134318611 /nfs/dbraw/zinc/31/86/11/134318611.db2.gz ABCVMALVKPFUEO-UHFFFAOYSA-N 1 1 247.382 3.596 20 0 BHADMO c1cc(C[N@@H+](C2CC2)C2CCCC2)cs1 ZINC000179296985 366240495 /nfs/dbraw/zinc/24/04/95/366240495.db2.gz SOMBLJPNTVTYES-UHFFFAOYSA-N 1 1 221.369 3.655 20 0 BHADMO CC[N@H+](Cc1cccc2[nH]ccc21)CC(C)C ZINC000179302464 386633976 /nfs/dbraw/zinc/63/39/76/386633976.db2.gz HEXOXDBWYQSCFK-UHFFFAOYSA-N 1 1 230.355 3.646 20 0 BHADMO C[N@@H+](Cc1ccc(-c2ccccc2)o1)C1CC1 ZINC000179303872 386633412 /nfs/dbraw/zinc/63/34/12/386633412.db2.gz HRDPBEKCYRCXLK-UHFFFAOYSA-N 1 1 227.307 3.541 20 0 BHADMO C[N@@H+](Cc1ccc(-c2ccc(F)cc2)o1)C1CC1 ZINC000179305886 386634105 /nfs/dbraw/zinc/63/41/05/386634105.db2.gz FNPLITUHEBZEFW-UHFFFAOYSA-N 1 1 245.297 3.680 20 0 BHADMO CC[C@@H](C)[N@@H+](C)Cc1coc2ccccc12 ZINC000179323172 386637470 /nfs/dbraw/zinc/63/74/70/386637470.db2.gz STGUFQKJWCEGBF-LLVKDONJSA-N 1 1 217.312 3.663 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1coc2ccccc12 ZINC000179323182 386637447 /nfs/dbraw/zinc/63/74/47/386637447.db2.gz STGUFQKJWCEGBF-NSHDSACASA-N 1 1 217.312 3.663 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1ccc([C@@H]2C[C@@H]2C)o1 ZINC000179324110 386639026 /nfs/dbraw/zinc/63/90/26/386639026.db2.gz CAUPHKOMHCUNGN-GMXVVIOVSA-N 1 1 221.344 3.633 20 0 BHADMO CC[C@@H](C)[N@@H+](C)C/C=C/c1ccc(F)cc1 ZINC000179324462 256669889 /nfs/dbraw/zinc/66/98/89/256669889.db2.gz UXUWNNBLQCEWOW-BTDICHCPSA-N 1 1 221.319 3.569 20 0 BHADMO CC[C@H](C)[N@@H+](C)C/C=C/c1ccc(F)cc1 ZINC000179324471 386636848 /nfs/dbraw/zinc/63/68/48/386636848.db2.gz UXUWNNBLQCEWOW-FYJFLYSWSA-N 1 1 221.319 3.569 20 0 BHADMO CC[C@@H](C)[N@@H+](C)Cc1ccc(OC)c(Cl)c1 ZINC000179401108 384286771 /nfs/dbraw/zinc/28/67/71/384286771.db2.gz IMHGZLWZFYGWME-SNVBAGLBSA-N 1 1 241.762 3.579 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1ccc(OC)c(Cl)c1 ZINC000179401116 384286837 /nfs/dbraw/zinc/28/68/37/384286837.db2.gz IMHGZLWZFYGWME-JTQLQIEISA-N 1 1 241.762 3.579 20 0 BHADMO CC(C)[N@@H+](Cc1coc2ccccc12)C1CC1 ZINC000179484605 346985909 /nfs/dbraw/zinc/98/59/09/346985909.db2.gz RMJWIFLCXHRAST-UHFFFAOYSA-N 1 1 229.323 3.806 20 0 BHADMO COc1ccccc1/C=C/C[N@@H+](C(C)C)C1CC1 ZINC000179485105 384295980 /nfs/dbraw/zinc/29/59/80/384295980.db2.gz NZMYGOCKXDESIP-SOFGYWHQSA-N 1 1 245.366 3.581 20 0 BHADMO Cc1cc(F)ccc1C[N@H+](C(C)C)C1CC1 ZINC000179485194 366262365 /nfs/dbraw/zinc/26/23/65/366262365.db2.gz FFGJCLLLJNCUAS-UHFFFAOYSA-N 1 1 221.319 3.507 20 0 BHADMO CC(C)[N@@H+](Cc1cccc2[nH]ccc21)C1CC1 ZINC000179485614 385469856 /nfs/dbraw/zinc/46/98/56/385469856.db2.gz QYUXFYQDVAVEHW-UHFFFAOYSA-N 1 1 228.339 3.541 20 0 BHADMO CC[N@@H+](Cc1cnn(C(C)C)c1)C1CCCCC1 ZINC000179494994 384296212 /nfs/dbraw/zinc/29/62/12/384296212.db2.gz VGVJMGYKOKLYKF-UHFFFAOYSA-N 1 1 249.402 3.619 20 0 BHADMO CC(C)[C@@H](C)[N@@H+](Cc1ccsc1)C1CC1 ZINC000179496834 384294458 /nfs/dbraw/zinc/29/44/58/384294458.db2.gz RHJHBNTYIYRVQA-LLVKDONJSA-N 1 1 223.385 3.757 20 0 BHADMO CC(C)[C@H](C)[N@@H+](Cc1ccsc1)C1CC1 ZINC000179496841 384295892 /nfs/dbraw/zinc/29/58/92/384295892.db2.gz RHJHBNTYIYRVQA-NSHDSACASA-N 1 1 223.385 3.757 20 0 BHADMO CCC[C@@H]1CCCC[N@H+]1Cc1csc(C)n1 ZINC000179519662 535410094 /nfs/dbraw/zinc/41/00/94/535410094.db2.gz CYSHZCOSSSNEKA-CYBMUJFWSA-N 1 1 238.400 3.606 20 0 BHADMO CCC[C@H]1CCCC[N@H+]1Cc1csc(C)n1 ZINC000179519668 134321177 /nfs/dbraw/zinc/32/11/77/134321177.db2.gz CYSHZCOSSSNEKA-ZDUSSCGKSA-N 1 1 238.400 3.606 20 0 BHADMO CCC[C@@H]1CCCC[N@H+]1Cc1nc(C)cs1 ZINC000179519735 535410136 /nfs/dbraw/zinc/41/01/36/535410136.db2.gz XPGUFRKJETVTEO-GFCCVEGCSA-N 1 1 238.400 3.606 20 0 BHADMO CCC[C@H]1CCCC[N@H+]1Cc1nc(C)cs1 ZINC000179519748 134321531 /nfs/dbraw/zinc/32/15/31/134321531.db2.gz XPGUFRKJETVTEO-LBPRGKRZSA-N 1 1 238.400 3.606 20 0 BHADMO CCC[C@@H]1CCCC[N@H+]1Cc1cnc(C)s1 ZINC000179519809 535410319 /nfs/dbraw/zinc/41/03/19/535410319.db2.gz UBFRNHFBCSYOKX-GFCCVEGCSA-N 1 1 238.400 3.606 20 0 BHADMO CCC[C@H]1CCCC[N@H+]1Cc1cnc(C)s1 ZINC000179519815 134321534 /nfs/dbraw/zinc/32/15/34/134321534.db2.gz UBFRNHFBCSYOKX-LBPRGKRZSA-N 1 1 238.400 3.606 20 0 BHADMO CCC[C@@H]1CCCC[N@H+]1Cc1ccn(C(C)C)n1 ZINC000179520264 385376472 /nfs/dbraw/zinc/37/64/72/385376472.db2.gz VKZIECWJPVVPPF-OAHLLOKOSA-N 1 1 249.402 3.619 20 0 BHADMO CCC[C@H]1CCCC[N@H+]1Cc1ccn(C(C)C)n1 ZINC000179520275 385376657 /nfs/dbraw/zinc/37/66/57/385376657.db2.gz VKZIECWJPVVPPF-HNNXBMFYSA-N 1 1 249.402 3.619 20 0 BHADMO CCC[C@@H]1CCCC[N@H+]1Cc1nccn1C(C)C ZINC000179522118 535411614 /nfs/dbraw/zinc/41/16/14/535411614.db2.gz POJAHIOPQXMOKA-CQSZACIVSA-N 1 1 249.402 3.619 20 0 BHADMO CCC[C@H]1CCCC[N@H+]1Cc1nccn1C(C)C ZINC000179522128 134321153 /nfs/dbraw/zinc/32/11/53/134321153.db2.gz POJAHIOPQXMOKA-AWEZNQCLSA-N 1 1 249.402 3.619 20 0 BHADMO C[C@@H]1C[N@H+](C2CCC2)CC[C@@H]1c1ccccc1 ZINC000179580199 366270791 /nfs/dbraw/zinc/27/07/91/366270791.db2.gz KYXUCPFUUIGEKZ-CJNGLKHVSA-N 1 1 229.367 3.665 20 0 BHADMO C[C@H]1C[N@H+](C2CCC2)CC[C@@H]1c1ccccc1 ZINC000179580212 366273298 /nfs/dbraw/zinc/27/32/98/366273298.db2.gz KYXUCPFUUIGEKZ-BBRMVZONSA-N 1 1 229.367 3.665 20 0 BHADMO CCC[C@@H](C)C[N@H+]1CCC[C@@H]1c1cccn1C ZINC000179598545 366275319 /nfs/dbraw/zinc/27/53/19/366275319.db2.gz KMPBMIZYDWABOZ-UKRRQHHQSA-N 1 1 234.387 3.598 20 0 BHADMO CCC[C@H](C)C[N@H+]1CCC[C@@H]1c1cccn1C ZINC000179598554 366275625 /nfs/dbraw/zinc/27/56/25/366275625.db2.gz KMPBMIZYDWABOZ-DZGCQCFKSA-N 1 1 234.387 3.598 20 0 BHADMO Cc1ccc(C[N@H+](C)Cc2sccc2C)o1 ZINC000179618666 384313641 /nfs/dbraw/zinc/31/36/41/384313641.db2.gz RHZRZJRGLKWZFL-UHFFFAOYSA-N 1 1 235.352 3.590 20 0 BHADMO FC(F)(F)[C@H]1CCC[N@@H+](C[C@H]2CC=CCC2)C1 ZINC000179619665 384313858 /nfs/dbraw/zinc/31/38/58/384313858.db2.gz VNTPGUNXRNZMRN-RYUDHWBXSA-N 1 1 247.304 3.617 20 0 BHADMO FC(F)(F)[C@@H]1CCC[N@@H+](C[C@H]2CC=CCC2)C1 ZINC000179619679 384314457 /nfs/dbraw/zinc/31/44/57/384314457.db2.gz VNTPGUNXRNZMRN-NWDGAFQWSA-N 1 1 247.304 3.617 20 0 BHADMO FC(F)(F)[C@H]1CCC[N@@H+](Cc2ccsc2)C1 ZINC000179623925 366277908 /nfs/dbraw/zinc/27/79/08/366277908.db2.gz ORZKFNWBRWGFPN-JTQLQIEISA-N 1 1 249.301 3.522 20 0 BHADMO FC(F)(F)[C@@H]1CCC[N@@H+](Cc2ccsc2)C1 ZINC000179623943 366277467 /nfs/dbraw/zinc/27/74/67/366277467.db2.gz ORZKFNWBRWGFPN-SNVBAGLBSA-N 1 1 249.301 3.522 20 0 BHADMO COc1ccc([C@@H](C)C[N@@H+](C)C2CCCC2)cc1 ZINC000179630243 366277813 /nfs/dbraw/zinc/27/78/13/366277813.db2.gz XDPKKYGWZXZGLI-ZDUSSCGKSA-N 1 1 247.382 3.673 20 0 BHADMO COc1ccc([C@H](C)C[N@@H+](C)C2CCCC2)cc1 ZINC000179630255 366277309 /nfs/dbraw/zinc/27/73/09/366277309.db2.gz XDPKKYGWZXZGLI-CYBMUJFWSA-N 1 1 247.382 3.673 20 0 BHADMO CCC[C@@H](C)C[N@@H+](C)Cc1ccc(Cl)nc1 ZINC000179664224 642738245 /nfs/dbraw/zinc/73/82/45/642738245.db2.gz YODXGYMOBBZWSK-LLVKDONJSA-N 1 1 240.778 3.603 20 0 BHADMO CCC[C@H](C)C[N@@H+](C)Cc1ccc(Cl)nc1 ZINC000179664238 633865216 /nfs/dbraw/zinc/86/52/16/633865216.db2.gz YODXGYMOBBZWSK-NSHDSACASA-N 1 1 240.778 3.603 20 0 BHADMO CC[N@@H+](C[C@@H](C)c1ccc(OC)cc1)C(C)C ZINC000179666539 366282277 /nfs/dbraw/zinc/28/22/77/366282277.db2.gz XCFDBASNMOPOLS-CYBMUJFWSA-N 1 1 235.371 3.529 20 0 BHADMO CC[N@@H+](C[C@H](C)c1ccc(OC)cc1)C(C)C ZINC000179666551 366281699 /nfs/dbraw/zinc/28/16/99/366281699.db2.gz XCFDBASNMOPOLS-ZDUSSCGKSA-N 1 1 235.371 3.529 20 0 BHADMO C[C@@H]1C[C@@H]1c1ccc(C[N@@H+](C)Cc2ccco2)o1 ZINC000179670407 384326000 /nfs/dbraw/zinc/32/60/00/384326000.db2.gz RVOISRIYIYGQSW-RISCZKNCSA-N 1 1 245.322 3.628 20 0 BHADMO C[C@@H]1C[C@@H]1c1ccc(C[N@H+](C)Cc2ccco2)o1 ZINC000179670407 384325994 /nfs/dbraw/zinc/32/59/94/384325994.db2.gz RVOISRIYIYGQSW-RISCZKNCSA-N 1 1 245.322 3.628 20 0 BHADMO C[C@H]1C[C@@H]1c1ccc(C[N@@H+](C)Cc2ccco2)o1 ZINC000179670418 384324737 /nfs/dbraw/zinc/32/47/37/384324737.db2.gz RVOISRIYIYGQSW-FZMZJTMJSA-N 1 1 245.322 3.628 20 0 BHADMO C[C@H]1C[C@@H]1c1ccc(C[N@H+](C)Cc2ccco2)o1 ZINC000179670418 384324735 /nfs/dbraw/zinc/32/47/35/384324735.db2.gz RVOISRIYIYGQSW-FZMZJTMJSA-N 1 1 245.322 3.628 20 0 BHADMO C[C@@H]1C[C@H]1c1ccc(C[N@@H+](C)Cc2ccco2)o1 ZINC000179670425 384324854 /nfs/dbraw/zinc/32/48/54/384324854.db2.gz RVOISRIYIYGQSW-BXUZGUMPSA-N 1 1 245.322 3.628 20 0 BHADMO C[C@@H]1C[C@H]1c1ccc(C[N@H+](C)Cc2ccco2)o1 ZINC000179670425 384324848 /nfs/dbraw/zinc/32/48/48/384324848.db2.gz RVOISRIYIYGQSW-BXUZGUMPSA-N 1 1 245.322 3.628 20 0 BHADMO C[C@H]1C[C@H]1c1ccc(C[N@@H+](C)Cc2ccco2)o1 ZINC000179670434 384325741 /nfs/dbraw/zinc/32/57/41/384325741.db2.gz RVOISRIYIYGQSW-SMDDNHRTSA-N 1 1 245.322 3.628 20 0 BHADMO C[C@H]1C[C@H]1c1ccc(C[N@H+](C)Cc2ccco2)o1 ZINC000179670434 384325733 /nfs/dbraw/zinc/32/57/33/384325733.db2.gz RVOISRIYIYGQSW-SMDDNHRTSA-N 1 1 245.322 3.628 20 0 BHADMO CCC[C@@H](C)C[N@@H+](C)[C@@H](C)c1ccco1 ZINC000179682716 366284000 /nfs/dbraw/zinc/28/40/00/366284000.db2.gz QIUFLRREPLFCGO-NEPJUHHUSA-N 1 1 209.333 3.709 20 0 BHADMO CCC[C@H](C)C[N@@H+](C)[C@@H](C)c1ccco1 ZINC000179682727 366284719 /nfs/dbraw/zinc/28/47/19/366284719.db2.gz QIUFLRREPLFCGO-RYUDHWBXSA-N 1 1 209.333 3.709 20 0 BHADMO CC[C@@H](C)[N@@H+](C)C[C@@H](C)c1ccc(OC)cc1 ZINC000179696791 366286969 /nfs/dbraw/zinc/28/69/69/366286969.db2.gz KFKWZBRCWKNELT-CHWSQXEVSA-N 1 1 235.371 3.529 20 0 BHADMO CC[C@H](C)[N@@H+](C)C[C@@H](C)c1ccc(OC)cc1 ZINC000179696807 366287443 /nfs/dbraw/zinc/28/74/43/366287443.db2.gz KFKWZBRCWKNELT-OLZOCXBDSA-N 1 1 235.371 3.529 20 0 BHADMO Cc1ncccc1C[N@H+](C)[C@@H](C)c1ccccc1 ZINC000179702128 384336210 /nfs/dbraw/zinc/33/62/10/384336210.db2.gz SEXNMHJHODXXJF-AWEZNQCLSA-N 1 1 240.350 3.583 20 0 BHADMO Cc1ncccc1C[N@H+](C)[C@H](C)c1ccccc1 ZINC000179702142 384335770 /nfs/dbraw/zinc/33/57/70/384335770.db2.gz SEXNMHJHODXXJF-CQSZACIVSA-N 1 1 240.350 3.583 20 0 BHADMO Cn1cccc1[C@@H]1CCC[N@H+]1C[C@H]1CC=CCC1 ZINC000179704590 384332691 /nfs/dbraw/zinc/33/26/91/384332691.db2.gz HLUHXLWIGTXUOC-HOCLYGCPSA-N 1 1 244.382 3.518 20 0 BHADMO Cn1cccc1[C@H]1CCC[N@H+]1C[C@H]1CC=CCC1 ZINC000179704600 384332275 /nfs/dbraw/zinc/33/22/75/384332275.db2.gz HLUHXLWIGTXUOC-GOEBONIOSA-N 1 1 244.382 3.518 20 0 BHADMO CCC(CC)C[N@H+]1CCC[C@@H]1c1cccn1C ZINC000179709695 384331662 /nfs/dbraw/zinc/33/16/62/384331662.db2.gz PJNVOYDSQXBHSS-OAHLLOKOSA-N 1 1 234.387 3.598 20 0 BHADMO CCC(CC)C[N@H+]1CCC[C@H]1c1cccn1C ZINC000179709709 384332208 /nfs/dbraw/zinc/33/22/08/384332208.db2.gz PJNVOYDSQXBHSS-HNNXBMFYSA-N 1 1 234.387 3.598 20 0 BHADMO COc1ccc([C@@H](C)C[N@@H+](C)[C@@H](C)C2CC2)cc1 ZINC000179714765 366292014 /nfs/dbraw/zinc/29/20/14/366292014.db2.gz RTEZHNZDEUCGTA-STQMWFEESA-N 1 1 247.382 3.529 20 0 BHADMO COc1ccc([C@H](C)C[N@@H+](C)[C@@H](C)C2CC2)cc1 ZINC000179714779 366291900 /nfs/dbraw/zinc/29/19/00/366291900.db2.gz RTEZHNZDEUCGTA-OLZOCXBDSA-N 1 1 247.382 3.529 20 0 BHADMO CC[N@@H+](Cc1ccc(C)o1)Cc1cccs1 ZINC000179720262 259304868 /nfs/dbraw/zinc/30/48/68/259304868.db2.gz OGOHBKMVLGFDLK-UHFFFAOYSA-N 1 1 235.352 3.672 20 0 BHADMO CC[N@H+](Cc1ccsc1)Cc1cccs1 ZINC000179721269 259304852 /nfs/dbraw/zinc/30/48/52/259304852.db2.gz MNOSTYCSYXQJQN-UHFFFAOYSA-N 1 1 237.393 3.832 20 0 BHADMO COc1ccc([C@H](C)C[N@@H+](C(C)C)C2CC2)cc1 ZINC000179725655 366294155 /nfs/dbraw/zinc/29/41/55/366294155.db2.gz NWHYSPCGBHDRDU-CYBMUJFWSA-N 1 1 247.382 3.672 20 0 BHADMO COc1ccc([C@@H](C)C[N@@H+](C(C)C)C2CC2)cc1 ZINC000179725664 366294464 /nfs/dbraw/zinc/29/44/64/366294464.db2.gz NWHYSPCGBHDRDU-ZDUSSCGKSA-N 1 1 247.382 3.672 20 0 BHADMO CC(C)n1cc(C[N@@H+](C)C2CCCCCC2)cn1 ZINC000179793906 384355923 /nfs/dbraw/zinc/35/59/23/384355923.db2.gz UTBJETSPSGFYHV-UHFFFAOYSA-N 1 1 249.402 3.619 20 0 BHADMO COc1ccccc1/C=C/C[N@@H+](C)C1CCCC1 ZINC000179798022 384359901 /nfs/dbraw/zinc/35/99/01/384359901.db2.gz NGWHWIVUTBLBJJ-VQHVLOKHSA-N 1 1 245.366 3.583 20 0 BHADMO C[N@@H+](Cc1cccc2[nH]ccc21)C1CCCC1 ZINC000179799446 385492973 /nfs/dbraw/zinc/49/29/73/385492973.db2.gz UIZWHJRJHKANDY-UHFFFAOYSA-N 1 1 228.339 3.542 20 0 BHADMO CC[C@@H]1CCCCC[N@H+]1Cc1cnn(C(C)C)c1 ZINC000179805582 134323946 /nfs/dbraw/zinc/32/39/46/134323946.db2.gz DTQROVOBLDZNHF-OAHLLOKOSA-N 1 1 249.402 3.619 20 0 BHADMO CC[C@H]1CCCCC[N@H+]1Cc1cnn(C(C)C)c1 ZINC000179805592 134323346 /nfs/dbraw/zinc/32/33/46/134323346.db2.gz DTQROVOBLDZNHF-HNNXBMFYSA-N 1 1 249.402 3.619 20 0 BHADMO CC1(C)CCC[N@H+]1Cc1cccc2[nH]ccc21 ZINC000179818373 134324167 /nfs/dbraw/zinc/32/41/67/134324167.db2.gz QPBNFEUFYFQBPB-UHFFFAOYSA-N 1 1 228.339 3.542 20 0 BHADMO Cc1ncsc1C[N@H+](C)C1CCCCCC1 ZINC000179884737 385381479 /nfs/dbraw/zinc/38/14/79/385381479.db2.gz JXOWTLJMTXQHTQ-UHFFFAOYSA-N 1 1 238.400 3.606 20 0 BHADMO CCC(CC)C[N@@H+](C)[C@@H](C)c1cccnc1 ZINC000179885569 168347397 /nfs/dbraw/zinc/34/73/97/168347397.db2.gz CHCASPKIESBPQI-LBPRGKRZSA-N 1 1 220.360 3.511 20 0 BHADMO CCC(CC)C[N@@H+](C)[C@H](C)c1cccnc1 ZINC000179885583 168349294 /nfs/dbraw/zinc/34/92/94/168349294.db2.gz CHCASPKIESBPQI-GFCCVEGCSA-N 1 1 220.360 3.511 20 0 BHADMO Cc1ccc(C[N@H+]2CCc3sccc3C2)s1 ZINC000179887201 342878418 /nfs/dbraw/zinc/87/84/18/342878418.db2.gz COWYIMAUBJELRB-UHFFFAOYSA-N 1 1 249.404 3.676 20 0 BHADMO Cc1ccsc1C[N@H+]1CCc2sccc2C1 ZINC000179887877 342878121 /nfs/dbraw/zinc/87/81/21/342878121.db2.gz LAOQAFUEWDHDEO-UHFFFAOYSA-N 1 1 249.404 3.676 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@@H]2CCc3ccccc32)o1 ZINC000179906497 384389441 /nfs/dbraw/zinc/38/94/41/384389441.db2.gz YRVYPSJFJUERMO-MRXNPFEDSA-N 1 1 241.334 3.707 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@H]2CCc3ccccc32)o1 ZINC000179906513 259305957 /nfs/dbraw/zinc/30/59/57/259305957.db2.gz YRVYPSJFJUERMO-INIZCTEOSA-N 1 1 241.334 3.707 20 0 BHADMO C[N@@H+](Cc1ccsc1)[C@@H]1CCc2ccccc21 ZINC000179909098 259305758 /nfs/dbraw/zinc/30/57/58/259305758.db2.gz NRNBZYSVKKSYPI-OAHLLOKOSA-N 1 1 243.375 3.867 20 0 BHADMO C[N@@H+](Cc1ccsc1)[C@H]1CCc2ccccc21 ZINC000179909118 259305976 /nfs/dbraw/zinc/30/59/76/259305976.db2.gz NRNBZYSVKKSYPI-HNNXBMFYSA-N 1 1 243.375 3.867 20 0 BHADMO Cc1ccc(F)cc1C[N@H+](C)[C@@H](C)c1ccco1 ZINC000179929176 347004209 /nfs/dbraw/zinc/00/42/09/347004209.db2.gz KTEOXUGHVNNJAR-LBPRGKRZSA-N 1 1 247.313 3.920 20 0 BHADMO Cc1ccc(F)cc1C[N@H+](C)[C@H](C)c1ccco1 ZINC000179929193 134325583 /nfs/dbraw/zinc/32/55/83/134325583.db2.gz KTEOXUGHVNNJAR-GFCCVEGCSA-N 1 1 247.313 3.920 20 0 BHADMO Cc1ccc(F)cc1C[N@H+](C(C)C)C1CC1 ZINC000179937520 134325331 /nfs/dbraw/zinc/32/53/31/134325331.db2.gz FNNGGALBRAQKOZ-UHFFFAOYSA-N 1 1 221.319 3.507 20 0 BHADMO CC[N@@H+](C)Cc1ccc(-c2ccc(F)cc2)o1 ZINC000179949391 259305903 /nfs/dbraw/zinc/30/59/03/259305903.db2.gz CPOVKTUSVXYTFI-UHFFFAOYSA-N 1 1 233.286 3.537 20 0 BHADMO CCCCCC[C@@H](C)[NH2+][C@@H](C)c1cn[nH]c1C ZINC000179952386 642759965 /nfs/dbraw/zinc/75/99/65/642759965.db2.gz FWRVLUOMLWIDFR-NEPJUHHUSA-N 1 1 237.391 3.728 20 0 BHADMO CCCCCC[C@H](C)[NH2+][C@@H](C)c1cn[nH]c1C ZINC000179952398 642760427 /nfs/dbraw/zinc/76/04/27/642760427.db2.gz FWRVLUOMLWIDFR-RYUDHWBXSA-N 1 1 237.391 3.728 20 0 BHADMO CCCCCC[C@@H](C)[NH2+][C@H](C)c1cn[nH]c1C ZINC000179952413 642760105 /nfs/dbraw/zinc/76/01/05/642760105.db2.gz FWRVLUOMLWIDFR-VXGBXAGGSA-N 1 1 237.391 3.728 20 0 BHADMO CCCCCC[C@H](C)[NH2+][C@H](C)c1cn[nH]c1C ZINC000179952426 642760020 /nfs/dbraw/zinc/76/00/20/642760020.db2.gz FWRVLUOMLWIDFR-NWDGAFQWSA-N 1 1 237.391 3.728 20 0 BHADMO Cc1[nH]ncc1[C@@H](C)[NH2+][C@@H](C)CCCC(C)C ZINC000179957657 538956914 /nfs/dbraw/zinc/95/69/14/538956914.db2.gz XRDDZRWJNGEGDN-NWDGAFQWSA-N 1 1 237.391 3.584 20 0 BHADMO Cc1[nH]ncc1[C@H](C)[NH2+][C@@H](C)CCCC(C)C ZINC000179957671 538956634 /nfs/dbraw/zinc/95/66/34/538956634.db2.gz XRDDZRWJNGEGDN-RYUDHWBXSA-N 1 1 237.391 3.584 20 0 BHADMO Cc1[nH]ncc1[C@@H](C)[NH2+][C@H](C)CCCC(C)C ZINC000179957686 538956563 /nfs/dbraw/zinc/95/65/63/538956563.db2.gz XRDDZRWJNGEGDN-VXGBXAGGSA-N 1 1 237.391 3.584 20 0 BHADMO Cc1[nH]ncc1[C@H](C)[NH2+][C@H](C)CCCC(C)C ZINC000179957701 538956869 /nfs/dbraw/zinc/95/68/69/538956869.db2.gz XRDDZRWJNGEGDN-NEPJUHHUSA-N 1 1 237.391 3.584 20 0 BHADMO CCCC[C@@H](CC)C[NH2+][C@@H](C)c1cn[nH]c1C ZINC000179971227 538956650 /nfs/dbraw/zinc/95/66/50/538956650.db2.gz LLJRUADJHXXCMO-WCQYABFASA-N 1 1 237.391 3.585 20 0 BHADMO CCCC[C@H](CC)C[NH2+][C@@H](C)c1cn[nH]c1C ZINC000179971239 538956668 /nfs/dbraw/zinc/95/66/68/538956668.db2.gz LLJRUADJHXXCMO-AAEUAGOBSA-N 1 1 237.391 3.585 20 0 BHADMO CCCC[C@@H](CC)C[NH2+][C@H](C)c1cn[nH]c1C ZINC000179971253 538956529 /nfs/dbraw/zinc/95/65/29/538956529.db2.gz LLJRUADJHXXCMO-DGCLKSJQSA-N 1 1 237.391 3.585 20 0 BHADMO CCCC[C@H](CC)C[NH2+][C@H](C)c1cn[nH]c1C ZINC000179971270 538956542 /nfs/dbraw/zinc/95/65/42/538956542.db2.gz LLJRUADJHXXCMO-YPMHNXCESA-N 1 1 237.391 3.585 20 0 BHADMO CC[C@H]([NH2+]CC(F)F)C(C)(C)c1ccccc1 ZINC000180006595 541507040 /nfs/dbraw/zinc/50/70/40/541507040.db2.gz ZVRZYBANCAPLRX-LBPRGKRZSA-N 1 1 241.325 3.598 20 0 BHADMO CC[C@@H]([NH2+]CC(F)F)C(C)(C)c1ccccc1 ZINC000180006612 541506163 /nfs/dbraw/zinc/50/61/63/541506163.db2.gz ZVRZYBANCAPLRX-GFCCVEGCSA-N 1 1 241.325 3.598 20 0 BHADMO c1csc(C[N@@H+](Cc2ccsc2)C2CC2)c1 ZINC000180035735 384432508 /nfs/dbraw/zinc/43/25/08/384432508.db2.gz SWZSPBPJISXNDD-UHFFFAOYSA-N 1 1 249.404 3.974 20 0 BHADMO CC(C)CC[N@@H+](C)Cc1cccc2[nH]ccc21 ZINC000180047656 384432081 /nfs/dbraw/zinc/43/20/81/384432081.db2.gz IOGRFBKDPFUYRK-UHFFFAOYSA-N 1 1 230.355 3.646 20 0 BHADMO CCC[N@@H+](C/C=C/c1ccccc1OC)C1CC1 ZINC000180097918 262713160 /nfs/dbraw/zinc/71/31/60/262713160.db2.gz ONNAVAARAHKSPY-SOFGYWHQSA-N 1 1 245.366 3.583 20 0 BHADMO CCC[N@@H+](Cc1cccc2[nH]ccc21)C1CC1 ZINC000180099028 384437212 /nfs/dbraw/zinc/43/72/12/384437212.db2.gz BWAMTJALDCVEEP-UHFFFAOYSA-N 1 1 228.339 3.542 20 0 BHADMO Cc1[nH]ncc1[C@@H](C)[NH2+]CCCC1CCCCC1 ZINC000180103045 538957407 /nfs/dbraw/zinc/95/74/07/538957407.db2.gz VCYDTMBSBZTIQG-GFCCVEGCSA-N 1 1 249.402 3.729 20 0 BHADMO Cc1[nH]ncc1[C@H](C)[NH2+]CCCC1CCCCC1 ZINC000180103063 538957526 /nfs/dbraw/zinc/95/75/26/538957526.db2.gz VCYDTMBSBZTIQG-LBPRGKRZSA-N 1 1 249.402 3.729 20 0 BHADMO Cc1[nH]ncc1[C@@H](C)[NH2+]CC1CCCCCCC1 ZINC000180177472 711887529 /nfs/dbraw/zinc/88/75/29/711887529.db2.gz MRXZGDMQXOJCOY-GFCCVEGCSA-N 1 1 249.402 3.729 20 0 BHADMO Cc1[nH]ncc1[C@H](C)[NH2+]CC1CCCCCCC1 ZINC000180177488 711887276 /nfs/dbraw/zinc/88/72/76/711887276.db2.gz MRXZGDMQXOJCOY-LBPRGKRZSA-N 1 1 249.402 3.729 20 0 BHADMO CCCO[C@H]1CCC[N@@H+](C[C@H](C)CCC)CC1 ZINC000180180490 366390734 /nfs/dbraw/zinc/39/07/34/366390734.db2.gz KYFBSSZARRHKKP-CABCVRRESA-N 1 1 241.419 3.704 20 0 BHADMO CCCO[C@H]1CCC[N@@H+](C[C@@H](C)CCC)CC1 ZINC000180180507 366390945 /nfs/dbraw/zinc/39/09/45/366390945.db2.gz KYFBSSZARRHKKP-GJZGRUSLSA-N 1 1 241.419 3.704 20 0 BHADMO CCCC1CCC([NH2+][C@@H](C)c2cn[nH]c2C)CC1 ZINC000180221617 538957416 /nfs/dbraw/zinc/95/74/16/538957416.db2.gz OSKZRWQKOSBRLG-XGNXJENSSA-N 1 1 249.402 3.728 20 0 BHADMO CCCC1CCC([NH2+][C@H](C)c2cn[nH]c2C)CC1 ZINC000180221632 538957137 /nfs/dbraw/zinc/95/71/37/538957137.db2.gz OSKZRWQKOSBRLG-LMWSTFAQSA-N 1 1 249.402 3.728 20 0 BHADMO CC[N@@H+](C[C@@H](C)c1ccc(OC)cc1)CC1CC1 ZINC000180232587 366398567 /nfs/dbraw/zinc/39/85/67/366398567.db2.gz KASJEGGVRHXKFG-CYBMUJFWSA-N 1 1 247.382 3.531 20 0 BHADMO CC[N@@H+](C[C@H](C)c1ccc(OC)cc1)CC1CC1 ZINC000180232606 366399256 /nfs/dbraw/zinc/39/92/56/366399256.db2.gz KASJEGGVRHXKFG-ZDUSSCGKSA-N 1 1 247.382 3.531 20 0 BHADMO CCCCCC[N@@H+](Cc1cccnc1)C1CC1 ZINC000180267265 633002368 /nfs/dbraw/zinc/00/23/68/633002368.db2.gz CLWDVGIEQMXZOY-UHFFFAOYSA-N 1 1 232.371 3.626 20 0 BHADMO CCC[C@@H](C)C[N@H+]1CCC[C@@H]1c1cccc(C)n1 ZINC000180277933 366409767 /nfs/dbraw/zinc/40/97/67/366409767.db2.gz MPBCOGQWBSNIIX-CZUORRHYSA-N 1 1 246.398 3.963 20 0 BHADMO CCC[C@H](C)C[N@H+]1CCC[C@@H]1c1cccc(C)n1 ZINC000180277947 344728025 /nfs/dbraw/zinc/72/80/25/344728025.db2.gz MPBCOGQWBSNIIX-XJKSGUPXSA-N 1 1 246.398 3.963 20 0 BHADMO Cc1cnc(C[N@H+](C)C2CCCCCC2)s1 ZINC000180412137 134327069 /nfs/dbraw/zinc/32/70/69/134327069.db2.gz MEKXIHGUDYYKCA-UHFFFAOYSA-N 1 1 238.400 3.606 20 0 BHADMO Cc1cnc(C[N@H+](C)[C@@H](C)c2ccccc2)s1 ZINC000180417201 385521652 /nfs/dbraw/zinc/52/16/52/385521652.db2.gz KZDHJTNEOUKQBL-LBPRGKRZSA-N 1 1 246.379 3.645 20 0 BHADMO Cc1cnc(C[N@@H+](C)[C@@H](C)c2ccccc2)s1 ZINC000180417201 385521649 /nfs/dbraw/zinc/52/16/49/385521649.db2.gz KZDHJTNEOUKQBL-LBPRGKRZSA-N 1 1 246.379 3.645 20 0 BHADMO Cc1cnc(C[N@H+](C)[C@H](C)c2ccccc2)s1 ZINC000180417221 385521435 /nfs/dbraw/zinc/52/14/35/385521435.db2.gz KZDHJTNEOUKQBL-GFCCVEGCSA-N 1 1 246.379 3.645 20 0 BHADMO Cc1cnc(C[N@@H+](C)[C@H](C)c2ccccc2)s1 ZINC000180417221 385521433 /nfs/dbraw/zinc/52/14/33/385521433.db2.gz KZDHJTNEOUKQBL-GFCCVEGCSA-N 1 1 246.379 3.645 20 0 BHADMO CCCC[C@@H]1CCC[C@@H]1[NH2+][C@@H](C)c1cn[nH]c1C ZINC000180419712 585032955 /nfs/dbraw/zinc/03/29/55/585032955.db2.gz TYBSQZPFQIIJMB-LNSITVRQSA-N 1 1 249.402 3.728 20 0 BHADMO CCCC[C@@H]1CCC[C@H]1[NH2+][C@@H](C)c1cn[nH]c1C ZINC000180419745 585033179 /nfs/dbraw/zinc/03/31/79/585033179.db2.gz TYBSQZPFQIIJMB-NJZAAPMLSA-N 1 1 249.402 3.728 20 0 BHADMO CC[N@@H+](C)Cc1ccc(Oc2ccccc2)o1 ZINC000180419981 134327075 /nfs/dbraw/zinc/32/70/75/134327075.db2.gz OXXQQOMSEWZHGZ-UHFFFAOYSA-N 1 1 231.295 3.524 20 0 BHADMO C[N@@H+](Cc1ccc(Oc2ccccc2)o1)C1CC1 ZINC000180421169 134327123 /nfs/dbraw/zinc/32/71/23/134327123.db2.gz WQZPJJUROJDJLB-UHFFFAOYSA-N 1 1 243.306 3.666 20 0 BHADMO CCCCC[N@@H+](Cc1ncc(C)s1)C(C)C ZINC000180429949 535043796 /nfs/dbraw/zinc/04/37/96/535043796.db2.gz DSTFDNJHNUBSOK-UHFFFAOYSA-N 1 1 240.416 3.852 20 0 BHADMO Cc1[nH]ncc1[C@H](C)[NH2+][C@@H]1CCC[C@H](C(C)C)C1 ZINC000180430640 585032914 /nfs/dbraw/zinc/03/29/14/585032914.db2.gz IUAOWQRDHKDAMT-FPMFFAJLSA-N 1 1 249.402 3.584 20 0 BHADMO Cc1[nH]ncc1[C@H](C)[NH2+][C@H]1CCC[C@H](C(C)C)C1 ZINC000180430674 585033190 /nfs/dbraw/zinc/03/31/90/585033190.db2.gz IUAOWQRDHKDAMT-UBHSHLNASA-N 1 1 249.402 3.584 20 0 BHADMO CCC(CC)C[N@@H+](CC)Cc1ncc(C)s1 ZINC000180431925 347028602 /nfs/dbraw/zinc/02/86/02/347028602.db2.gz RVKLOGSSUFHKLK-UHFFFAOYSA-N 1 1 240.416 3.710 20 0 BHADMO Cc1[nH]ncc1[C@@H](C)[NH2+]CCCCC(C)(C)C ZINC000180432115 538958407 /nfs/dbraw/zinc/95/84/07/538958407.db2.gz DUZYZTBIQNSDGC-LLVKDONJSA-N 1 1 237.391 3.585 20 0 BHADMO Cc1[nH]ncc1[C@H](C)[NH2+]CCCCC(C)(C)C ZINC000180432134 538958033 /nfs/dbraw/zinc/95/80/33/538958033.db2.gz DUZYZTBIQNSDGC-NSHDSACASA-N 1 1 237.391 3.585 20 0 BHADMO CC[N@@H+](Cc1ncc(C)s1)C1CCCCC1 ZINC000180433498 347028388 /nfs/dbraw/zinc/02/83/88/347028388.db2.gz NXPBAVYBMZCOGI-UHFFFAOYSA-N 1 1 238.400 3.606 20 0 BHADMO CCC1CCC(C[NH2+][C@@H](C)c2cn[nH]c2C)CC1 ZINC000180447545 538958350 /nfs/dbraw/zinc/95/83/50/538958350.db2.gz KPQHWUYGVQREPF-XGNXJENSSA-N 1 1 249.402 3.585 20 0 BHADMO CCC1CCC(C[NH2+][C@H](C)c2cn[nH]c2C)CC1 ZINC000180447565 538958227 /nfs/dbraw/zinc/95/82/27/538958227.db2.gz KPQHWUYGVQREPF-LMWSTFAQSA-N 1 1 249.402 3.585 20 0 BHADMO CC[C@@H]1CCCCC[N@H+]1Cc1ncc(C)s1 ZINC000180505535 134329722 /nfs/dbraw/zinc/32/97/22/134329722.db2.gz JMMQJZQVMWQMCW-GFCCVEGCSA-N 1 1 238.400 3.606 20 0 BHADMO CC[C@H]1CCCCC[N@H+]1Cc1ncc(C)s1 ZINC000180505557 134329606 /nfs/dbraw/zinc/32/96/06/134329606.db2.gz JMMQJZQVMWQMCW-LBPRGKRZSA-N 1 1 238.400 3.606 20 0 BHADMO CC(C)=CC[N@H+](C)Cc1cc(F)c(F)c(F)c1 ZINC000180514683 366490666 /nfs/dbraw/zinc/49/06/66/366490666.db2.gz MZJAZSZCNDKZAW-UHFFFAOYSA-N 1 1 243.272 3.502 20 0 BHADMO Cc1cnc(C[N@H+](C(C)C)C2CCCC2)s1 ZINC000180577409 711889366 /nfs/dbraw/zinc/88/93/66/711889366.db2.gz QNHPYINKQSSLCA-UHFFFAOYSA-N 1 1 238.400 3.605 20 0 BHADMO Cc1[nH]ncc1[C@@H](C)[NH2+][C@@H](C)CCC(C)(C)C ZINC000180579321 538958617 /nfs/dbraw/zinc/95/86/17/538958617.db2.gz NASGSFPPHNTCPP-WDEREUQCSA-N 1 1 237.391 3.584 20 0 BHADMO Cc1[nH]ncc1[C@H](C)[NH2+][C@@H](C)CCC(C)(C)C ZINC000180579343 538958478 /nfs/dbraw/zinc/95/84/78/538958478.db2.gz NASGSFPPHNTCPP-QWRGUYRKSA-N 1 1 237.391 3.584 20 0 BHADMO Cc1[nH]ncc1[C@@H](C)[NH2+][C@H](C)CCC(C)(C)C ZINC000180579358 538958144 /nfs/dbraw/zinc/95/81/44/538958144.db2.gz NASGSFPPHNTCPP-GHMZBOCLSA-N 1 1 237.391 3.584 20 0 BHADMO Cc1[nH]ncc1[C@H](C)[NH2+][C@H](C)CCC(C)(C)C ZINC000180579370 538958558 /nfs/dbraw/zinc/95/85/58/538958558.db2.gz NASGSFPPHNTCPP-MNOVXSKESA-N 1 1 237.391 3.584 20 0 BHADMO Cc1[nH]ncc1[C@@H](C)[NH2+]CCCCC1CCCC1 ZINC000180670864 538958754 /nfs/dbraw/zinc/95/87/54/538958754.db2.gz ZUHINVMRWYQDIH-GFCCVEGCSA-N 1 1 249.402 3.729 20 0 BHADMO Cc1[nH]ncc1[C@H](C)[NH2+]CCCCC1CCCC1 ZINC000180670882 538117732 /nfs/dbraw/zinc/11/77/32/538117732.db2.gz ZUHINVMRWYQDIH-LBPRGKRZSA-N 1 1 249.402 3.729 20 0 BHADMO Cc1[nH]ncc1[C@H](C)[NH2+][C@@H]1CCC(C)(C)C[C@@H]1C ZINC000180708692 538958917 /nfs/dbraw/zinc/95/89/17/538958917.db2.gz AWHCISQWUDGCHH-COPLHBTASA-N 1 1 249.402 3.584 20 0 BHADMO Cc1[nH]ncc1[C@H](C)[NH2+][C@H]1CCC(C)(C)C[C@@H]1C ZINC000180708737 538958945 /nfs/dbraw/zinc/95/89/45/538958945.db2.gz AWHCISQWUDGCHH-MJVIPROJSA-N 1 1 249.402 3.584 20 0 BHADMO CCCC[C@@H](CCC)[NH2+][C@@H](C)c1cn[nH]c1C ZINC000180712803 538959114 /nfs/dbraw/zinc/95/91/14/538959114.db2.gz OZINIXCYSRHFFC-WCQYABFASA-N 1 1 237.391 3.728 20 0 BHADMO CCCC[C@H](CCC)[NH2+][C@@H](C)c1cn[nH]c1C ZINC000180712820 538958856 /nfs/dbraw/zinc/95/88/56/538958856.db2.gz OZINIXCYSRHFFC-AAEUAGOBSA-N 1 1 237.391 3.728 20 0 BHADMO CCCC[C@@H](CCC)[NH2+][C@H](C)c1cn[nH]c1C ZINC000180712840 538959199 /nfs/dbraw/zinc/95/91/99/538959199.db2.gz OZINIXCYSRHFFC-DGCLKSJQSA-N 1 1 237.391 3.728 20 0 BHADMO CCCC[C@H](CCC)[NH2+][C@H](C)c1cn[nH]c1C ZINC000180712855 538959270 /nfs/dbraw/zinc/95/92/70/538959270.db2.gz OZINIXCYSRHFFC-YPMHNXCESA-N 1 1 237.391 3.728 20 0 BHADMO CCCCCSCCCCn1cc[nH+]c1C ZINC000180735817 366541993 /nfs/dbraw/zinc/54/19/93/366541993.db2.gz UJTUMGNNIMWOJG-UHFFFAOYSA-N 1 1 240.416 3.895 20 0 BHADMO Cc1[nH]ncc1[C@@H](C)[NH2+]CC1(CC(C)C)CCC1 ZINC000180756481 538958785 /nfs/dbraw/zinc/95/87/85/538958785.db2.gz DOCRDGWNJOWZCQ-GFCCVEGCSA-N 1 1 249.402 3.585 20 0 BHADMO Cc1[nH]ncc1[C@H](C)[NH2+]CC1(CC(C)C)CCC1 ZINC000180756501 538959045 /nfs/dbraw/zinc/95/90/45/538959045.db2.gz DOCRDGWNJOWZCQ-LBPRGKRZSA-N 1 1 249.402 3.585 20 0 BHADMO COc1ccc([C@@H](C)C[N@@H+](C)CCC2CC2)cc1 ZINC000180766975 366546463 /nfs/dbraw/zinc/54/64/63/366546463.db2.gz DCERJQPVKNPNFO-ZDUSSCGKSA-N 1 1 247.382 3.531 20 0 BHADMO COc1ccc([C@H](C)C[N@@H+](C)CCC2CC2)cc1 ZINC000180766991 366545666 /nfs/dbraw/zinc/54/56/66/366545666.db2.gz DCERJQPVKNPNFO-CYBMUJFWSA-N 1 1 247.382 3.531 20 0 BHADMO Cc1[nH]ncc1[C@@H](C)[NH2+]C1CCC(C(C)C)CC1 ZINC000180786090 538959240 /nfs/dbraw/zinc/95/92/40/538959240.db2.gz LXMVTRNWZNRZKA-LMWSTFAQSA-N 1 1 249.402 3.584 20 0 BHADMO Cc1[nH]ncc1[C@H](C)[NH2+]C1CCC(C(C)C)CC1 ZINC000180786113 538959068 /nfs/dbraw/zinc/95/90/68/538959068.db2.gz LXMVTRNWZNRZKA-XGNXJENSSA-N 1 1 249.402 3.584 20 0 BHADMO c1ccc(C[N@H+](CCC2CCCC2)C2CC2)nc1 ZINC000180865993 134331595 /nfs/dbraw/zinc/33/15/95/134331595.db2.gz RPLKRARMZFYZSW-UHFFFAOYSA-N 1 1 244.382 3.626 20 0 BHADMO CCCC[N@@H+](C)[C@@H](C)c1nc2ccccc2o1 ZINC000180896428 385554265 /nfs/dbraw/zinc/55/42/65/385554265.db2.gz WABWNADJTAFHBI-NSHDSACASA-N 1 1 232.327 3.621 20 0 BHADMO CCCC[N@@H+](C)[C@H](C)c1nc2ccccc2o1 ZINC000180896447 385554541 /nfs/dbraw/zinc/55/45/41/385554541.db2.gz WABWNADJTAFHBI-LLVKDONJSA-N 1 1 232.327 3.621 20 0 BHADMO C[C@@H](c1nc2ccccc2o1)[N@H+]1CCC[C@@H](C)C1 ZINC000180938281 176038988 /nfs/dbraw/zinc/03/89/88/176038988.db2.gz DOQVCEGFXVGXKH-NEPJUHHUSA-N 1 1 244.338 3.621 20 0 BHADMO C[C@@H](c1nc2ccccc2o1)[N@H+]1CCC[C@H](C)C1 ZINC000180938301 177104029 /nfs/dbraw/zinc/10/40/29/177104029.db2.gz DOQVCEGFXVGXKH-RYUDHWBXSA-N 1 1 244.338 3.621 20 0 BHADMO CCC(CC)(CC)C[NH2+][C@@H](C)c1cn[nH]c1C ZINC000180941400 538959402 /nfs/dbraw/zinc/95/94/02/538959402.db2.gz RHHHPTYSUNXEKS-NSHDSACASA-N 1 1 237.391 3.585 20 0 BHADMO CCC(CC)(CC)C[NH2+][C@H](C)c1cn[nH]c1C ZINC000180941418 538959654 /nfs/dbraw/zinc/95/96/54/538959654.db2.gz RHHHPTYSUNXEKS-LLVKDONJSA-N 1 1 237.391 3.585 20 0 BHADMO CC[N@@H+](CC(C)C)[C@@H](C)c1nc2ccccc2o1 ZINC000180967852 259346136 /nfs/dbraw/zinc/34/61/36/259346136.db2.gz FBFOKKJJUGMCPQ-LBPRGKRZSA-N 1 1 246.354 3.867 20 0 BHADMO CC[N@@H+](CC(C)C)[C@H](C)c1nc2ccccc2o1 ZINC000180967872 259346181 /nfs/dbraw/zinc/34/61/81/259346181.db2.gz FBFOKKJJUGMCPQ-GFCCVEGCSA-N 1 1 246.354 3.867 20 0 BHADMO CC(C)CC[N@@H+](C)[C@@H](C)c1nc2ccccc2o1 ZINC000180983130 538959496 /nfs/dbraw/zinc/95/94/96/538959496.db2.gz VREODYDVMYCQKD-LBPRGKRZSA-N 1 1 246.354 3.867 20 0 BHADMO CC(C)CC[N@@H+](C)[C@H](C)c1nc2ccccc2o1 ZINC000180983152 538959584 /nfs/dbraw/zinc/95/95/84/538959584.db2.gz VREODYDVMYCQKD-GFCCVEGCSA-N 1 1 246.354 3.867 20 0 BHADMO Cc1[nH]ncc1[C@@H](C)[NH2+]CC(C)(C)C1CCCC1 ZINC000181008318 538959559 /nfs/dbraw/zinc/95/95/59/538959559.db2.gz HHILRNJUQXBWND-LLVKDONJSA-N 1 1 249.402 3.585 20 0 BHADMO Cc1[nH]ncc1[C@H](C)[NH2+]CC(C)(C)C1CCCC1 ZINC000181008337 538959480 /nfs/dbraw/zinc/95/94/80/538959480.db2.gz HHILRNJUQXBWND-NSHDSACASA-N 1 1 249.402 3.585 20 0 BHADMO Cc1[nH]ncc1[C@@H](C)[NH2+]CC1CCC(C)(C)CC1 ZINC000181028638 538959395 /nfs/dbraw/zinc/95/93/95/538959395.db2.gz QEACRIIXCOOLHU-LLVKDONJSA-N 1 1 249.402 3.585 20 0 BHADMO Cc1[nH]ncc1[C@H](C)[NH2+]CC1CCC(C)(C)CC1 ZINC000181028656 538959635 /nfs/dbraw/zinc/95/96/35/538959635.db2.gz QEACRIIXCOOLHU-NSHDSACASA-N 1 1 249.402 3.585 20 0 BHADMO Cc1[nH]ncc1[C@@H](C)[NH2+]CC1(C)CCCCCC1 ZINC000181064568 538959555 /nfs/dbraw/zinc/95/95/55/538959555.db2.gz MZRLZUINNAHODF-GFCCVEGCSA-N 1 1 249.402 3.729 20 0 BHADMO Cc1[nH]ncc1[C@H](C)[NH2+]CC1(C)CCCCCC1 ZINC000181064586 538959409 /nfs/dbraw/zinc/95/94/09/538959409.db2.gz MZRLZUINNAHODF-LBPRGKRZSA-N 1 1 249.402 3.729 20 0 BHADMO CC[C@@H](C)C[N@@H+](C)[C@@H](C)c1nc2ccccc2o1 ZINC000181106497 384442659 /nfs/dbraw/zinc/44/26/59/384442659.db2.gz RBEBQXBCGNZBGS-NEPJUHHUSA-N 1 1 246.354 3.867 20 0 BHADMO CC[C@H](C)C[N@@H+](C)[C@@H](C)c1nc2ccccc2o1 ZINC000181106517 384443597 /nfs/dbraw/zinc/44/35/97/384443597.db2.gz RBEBQXBCGNZBGS-RYUDHWBXSA-N 1 1 246.354 3.867 20 0 BHADMO C[C@@H](c1nc2ccccc2o1)[N@@H+](C)CC1CCC1 ZINC000181107292 134333619 /nfs/dbraw/zinc/33/36/19/134333619.db2.gz NLVKMNPXRFQOPS-NSHDSACASA-N 1 1 244.338 3.621 20 0 BHADMO C[C@H](c1nc2ccccc2o1)[N@@H+](C)CC1CCC1 ZINC000181107309 134333698 /nfs/dbraw/zinc/33/36/98/134333698.db2.gz NLVKMNPXRFQOPS-LLVKDONJSA-N 1 1 244.338 3.621 20 0 BHADMO CC[N@@H+](CC1CC1)[C@@H](C)c1nc2ccccc2o1 ZINC000181108172 385563700 /nfs/dbraw/zinc/56/37/00/385563700.db2.gz OTMCBEVXCFQPOJ-NSHDSACASA-N 1 1 244.338 3.621 20 0 BHADMO CC[N@@H+](CC1CC1)[C@H](C)c1nc2ccccc2o1 ZINC000181108189 385563762 /nfs/dbraw/zinc/56/37/62/385563762.db2.gz OTMCBEVXCFQPOJ-LLVKDONJSA-N 1 1 244.338 3.621 20 0 BHADMO C[C@@H](c1nc2ccccc2o1)[N@H+]1CCC(C)(C)C1 ZINC000181125638 176039220 /nfs/dbraw/zinc/03/92/20/176039220.db2.gz COPXUGZJLATJDG-NSHDSACASA-N 1 1 244.338 3.621 20 0 BHADMO C[C@H](c1nc2ccccc2o1)[N@H+]1CCC(C)(C)C1 ZINC000181125650 177054007 /nfs/dbraw/zinc/05/40/07/177054007.db2.gz COPXUGZJLATJDG-LLVKDONJSA-N 1 1 244.338 3.621 20 0 BHADMO CC[C@@H](C)[N@H+]1CCC[C@@H]1c1cccc(N(C)C)c1 ZINC000181131049 384449277 /nfs/dbraw/zinc/44/92/77/384449277.db2.gz VNRNLEKKSPSVBK-CZUORRHYSA-N 1 1 246.398 3.688 20 0 BHADMO CC[C@H](C)[N@H+]1CCC[C@@H]1c1cccc(N(C)C)c1 ZINC000181131067 384448944 /nfs/dbraw/zinc/44/89/44/384448944.db2.gz VNRNLEKKSPSVBK-XJKSGUPXSA-N 1 1 246.398 3.688 20 0 BHADMO C[C@@H](c1nc2ccccc2o1)[N@H+]1CC[C@@H](C)[C@H]1C ZINC000181134657 176039426 /nfs/dbraw/zinc/03/94/26/176039426.db2.gz LHLVNMCHWQRGND-UTUOFQBUSA-N 1 1 244.338 3.619 20 0 BHADMO C[C@@H](c1nc2ccccc2o1)[N@H+]1CC[C@H](C)[C@H]1C ZINC000181134675 177170064 /nfs/dbraw/zinc/17/00/64/177170064.db2.gz LHLVNMCHWQRGND-TUAOUCFPSA-N 1 1 244.338 3.619 20 0 BHADMO CC[C@@H]1CC[N@H+]([C@@H](C)c2nc3ccccc3o2)C1 ZINC000181144256 171013488 /nfs/dbraw/zinc/01/34/88/171013488.db2.gz PUBFRLUWMIGDBN-NWDGAFQWSA-N 1 1 244.338 3.621 20 0 BHADMO CC[C@H]1CC[N@H+]([C@@H](C)c2nc3ccccc3o2)C1 ZINC000181144271 385565502 /nfs/dbraw/zinc/56/55/02/385565502.db2.gz PUBFRLUWMIGDBN-RYUDHWBXSA-N 1 1 244.338 3.621 20 0 BHADMO C[C@@H](c1nc2ccccc2o1)[N@@H+](C)CCC1CC1 ZINC000181185952 176039327 /nfs/dbraw/zinc/03/93/27/176039327.db2.gz GSDZDWFXIQSDSK-NSHDSACASA-N 1 1 244.338 3.621 20 0 BHADMO C[C@H](c1nc2ccccc2o1)[N@@H+](C)CCC1CC1 ZINC000181185969 177054171 /nfs/dbraw/zinc/05/41/71/177054171.db2.gz GSDZDWFXIQSDSK-LLVKDONJSA-N 1 1 244.338 3.621 20 0 BHADMO CCCCCC[N@@H+](Cc1ccccn1)C1CC1 ZINC000181302508 633078658 /nfs/dbraw/zinc/07/86/58/633078658.db2.gz BHGMUJPTHOUNGM-UHFFFAOYSA-N 1 1 232.371 3.626 20 0 BHADMO C[N@@H+](CCCC1CCCC1)CCc1ccncc1 ZINC000181491073 536328762 /nfs/dbraw/zinc/32/87/62/536328762.db2.gz WYQUUNSCXINWLD-UHFFFAOYSA-N 1 1 246.398 3.526 20 0 BHADMO CC(C)c1ccc([C@@H](C)[N@@H+](C)CC(C)(C)O)cc1 ZINC000181550292 366824984 /nfs/dbraw/zinc/82/49/84/366824984.db2.gz PDJCZCBQTKEQAT-CYBMUJFWSA-N 1 1 249.398 3.574 20 0 BHADMO CC(C)c1ccc([C@H](C)[N@@H+](C)CC(C)(C)O)cc1 ZINC000181550307 366825764 /nfs/dbraw/zinc/82/57/64/366825764.db2.gz PDJCZCBQTKEQAT-ZDUSSCGKSA-N 1 1 249.398 3.574 20 0 BHADMO Cc1oncc1C[N@H+](C)C1CCCCCCC1 ZINC000181667362 642894680 /nfs/dbraw/zinc/89/46/80/642894680.db2.gz FTWNQBLMWRCRBH-UHFFFAOYSA-N 1 1 236.359 3.528 20 0 BHADMO Cc1oncc1C[N@@H+](CC1CC1)C1CCCCC1 ZINC000181679696 366837735 /nfs/dbraw/zinc/83/77/35/366837735.db2.gz CLOINQKMSDYMHW-UHFFFAOYSA-N 1 1 248.370 3.528 20 0 BHADMO CC[C@H]([NH2+]Cc1ncc(C)o1)c1ccc(C)cc1 ZINC000181696260 385410606 /nfs/dbraw/zinc/41/06/06/385410606.db2.gz SRGZNWYXAVNDHM-AWEZNQCLSA-N 1 1 244.338 3.532 20 0 BHADMO CC[C@@H]([NH2+]Cc1ncc(C)o1)c1ccc(C)cc1 ZINC000181696283 385410001 /nfs/dbraw/zinc/41/00/01/385410001.db2.gz SRGZNWYXAVNDHM-CQSZACIVSA-N 1 1 244.338 3.532 20 0 BHADMO C[C@H]([NH2+]C/C=C/Cl)c1c(F)cccc1Cl ZINC000181760494 642899086 /nfs/dbraw/zinc/89/90/86/642899086.db2.gz NZRJFYHPYSKBFH-HFSLJOEWSA-N 1 1 248.128 3.882 20 0 BHADMO C[C@@H]([NH2+]C/C=C/Cl)c1c(F)cccc1Cl ZINC000181760511 642899928 /nfs/dbraw/zinc/89/99/28/642899928.db2.gz NZRJFYHPYSKBFH-GWSCVKMXSA-N 1 1 248.128 3.882 20 0 BHADMO CC[C@H]([NH2+][C@@H](C)c1ccoc1)c1c(C)noc1C ZINC000181774006 345037712 /nfs/dbraw/zinc/03/77/12/345037712.db2.gz AKUPCXFKODFFQC-ZANVPECISA-N 1 1 248.326 3.686 20 0 BHADMO CC[C@@H]([NH2+][C@@H](C)c1ccoc1)c1c(C)noc1C ZINC000181774028 366848332 /nfs/dbraw/zinc/84/83/32/366848332.db2.gz AKUPCXFKODFFQC-TVQRCGJNSA-N 1 1 248.326 3.686 20 0 BHADMO CC[C@H]([NH2+][C@H](C)c1ccoc1)c1c(C)noc1C ZINC000181774050 366848449 /nfs/dbraw/zinc/84/84/49/366848449.db2.gz AKUPCXFKODFFQC-RNCFNFMXSA-N 1 1 248.326 3.686 20 0 BHADMO CC[C@@H]([NH2+][C@H](C)c1ccoc1)c1c(C)noc1C ZINC000181774069 366848434 /nfs/dbraw/zinc/84/84/34/366848434.db2.gz AKUPCXFKODFFQC-NOZJJQNGSA-N 1 1 248.326 3.686 20 0 BHADMO CCC[C@H]([NH2+]Cc1ncc(C)o1)c1ccccc1 ZINC000181776241 385602891 /nfs/dbraw/zinc/60/28/91/385602891.db2.gz LUKIJYUXBNJRAA-AWEZNQCLSA-N 1 1 244.338 3.614 20 0 BHADMO CCC[C@@H]([NH2+]Cc1ncc(C)o1)c1ccccc1 ZINC000181776258 385602265 /nfs/dbraw/zinc/60/22/65/385602265.db2.gz LUKIJYUXBNJRAA-CQSZACIVSA-N 1 1 244.338 3.614 20 0 BHADMO CC(C)c1ccc([C@@H](C)[N@H+](C)CC[C@@H](C)O)cc1 ZINC000181915142 366854561 /nfs/dbraw/zinc/85/45/61/366854561.db2.gz SNGCMSCUZHQIAK-ZIAGYGMSSA-N 1 1 249.398 3.574 20 0 BHADMO CC(C)c1ccc([C@H](C)[N@H+](C)CC[C@@H](C)O)cc1 ZINC000181915162 366854392 /nfs/dbraw/zinc/85/43/92/366854392.db2.gz SNGCMSCUZHQIAK-KGLIPLIRSA-N 1 1 249.398 3.574 20 0 BHADMO CCCC[N@@H+](C)Cc1ncc(Cl)cc1Cl ZINC000181939337 366855899 /nfs/dbraw/zinc/85/58/99/366855899.db2.gz IGOQWLLIHAMKFD-UHFFFAOYSA-N 1 1 247.169 3.620 20 0 BHADMO CCCC[N@H+](C)Cc1ncc(Cl)cc1Cl ZINC000181939337 366855894 /nfs/dbraw/zinc/85/58/94/366855894.db2.gz IGOQWLLIHAMKFD-UHFFFAOYSA-N 1 1 247.169 3.620 20 0 BHADMO CCC[C@@H](C)C[N@@H+](C)[C@@H](C)c1ccccn1 ZINC000182062346 169358131 /nfs/dbraw/zinc/35/81/31/169358131.db2.gz KZKZGPBNDONJLZ-OLZOCXBDSA-N 1 1 220.360 3.511 20 0 BHADMO CCC[C@H](C)C[N@@H+](C)[C@@H](C)c1ccccn1 ZINC000182062369 385633492 /nfs/dbraw/zinc/63/34/92/385633492.db2.gz KZKZGPBNDONJLZ-STQMWFEESA-N 1 1 220.360 3.511 20 0 BHADMO CC[N@@H+](Cc1ncc(Cl)cc1Cl)C(C)C ZINC000182068618 366865025 /nfs/dbraw/zinc/86/50/25/366865025.db2.gz WTNRHNABLBEHPL-UHFFFAOYSA-N 1 1 247.169 3.619 20 0 BHADMO CC[N@H+](Cc1ncc(Cl)cc1Cl)C(C)C ZINC000182068618 366865020 /nfs/dbraw/zinc/86/50/20/366865020.db2.gz WTNRHNABLBEHPL-UHFFFAOYSA-N 1 1 247.169 3.619 20 0 BHADMO CO[C@@H](C)C[N@H+]1CCCCC[C@@H]1c1ccccc1 ZINC000182070652 366864689 /nfs/dbraw/zinc/86/46/89/366864689.db2.gz UKSQXLDCUYGDGR-GOEBONIOSA-N 1 1 247.382 3.639 20 0 BHADMO CO[C@H](C)C[N@H+]1CCCCC[C@@H]1c1ccccc1 ZINC000182070669 366865112 /nfs/dbraw/zinc/86/51/12/366865112.db2.gz UKSQXLDCUYGDGR-GDBMZVCRSA-N 1 1 247.382 3.639 20 0 BHADMO CC(C)c1ccc([C@@H](C)[NH2+]Cc2cocn2)cc1 ZINC000182071921 385428278 /nfs/dbraw/zinc/42/82/78/385428278.db2.gz KZCJNHQFDMPBTP-GFCCVEGCSA-N 1 1 244.338 3.649 20 0 BHADMO CC(C)c1ccc([C@H](C)[NH2+]Cc2cocn2)cc1 ZINC000182071940 385428946 /nfs/dbraw/zinc/42/89/46/385428946.db2.gz KZCJNHQFDMPBTP-LBPRGKRZSA-N 1 1 244.338 3.649 20 0 BHADMO Cc1[nH+]cn(CCCc2ccccc2Cl)c1C ZINC000182100371 366865781 /nfs/dbraw/zinc/86/57/81/366865781.db2.gz PHZIXKMDLCYGDK-UHFFFAOYSA-N 1 1 248.757 3.786 20 0 BHADMO CO[C@H](C)C[N@H+]1CCCC[C@H]1c1ccc(C)cc1 ZINC000182189067 366874546 /nfs/dbraw/zinc/87/45/46/366874546.db2.gz DVEADIGMAJRWCE-ZBFHGGJFSA-N 1 1 247.382 3.557 20 0 BHADMO CO[C@H](C)C[N@H+]1CCCC[C@@H]1c1ccc(C)cc1 ZINC000182189092 366874931 /nfs/dbraw/zinc/87/49/31/366874931.db2.gz DVEADIGMAJRWCE-GDBMZVCRSA-N 1 1 247.382 3.557 20 0 BHADMO C[C@H]([NH2+]C1(c2cccc(F)c2)CC1)c1ccco1 ZINC000182210007 366874884 /nfs/dbraw/zinc/87/48/84/366874884.db2.gz VEBMQNBPKIYGRG-NSHDSACASA-N 1 1 245.297 3.759 20 0 BHADMO C[C@@H]([NH2+]C1(c2cccc(F)c2)CC1)c1ccco1 ZINC000182210035 366874591 /nfs/dbraw/zinc/87/45/91/366874591.db2.gz VEBMQNBPKIYGRG-LLVKDONJSA-N 1 1 245.297 3.759 20 0 BHADMO C[C@H]([NH2+]C1(c2ccccc2F)CC1)c1ccoc1 ZINC000182235766 366877693 /nfs/dbraw/zinc/87/76/93/366877693.db2.gz UNGVSLIIHLKJPW-NSHDSACASA-N 1 1 245.297 3.759 20 0 BHADMO C[C@@H]([NH2+]C1(c2ccccc2F)CC1)c1ccoc1 ZINC000182235787 366877352 /nfs/dbraw/zinc/87/73/52/366877352.db2.gz UNGVSLIIHLKJPW-LLVKDONJSA-N 1 1 245.297 3.759 20 0 BHADMO COc1ccccc1CCC[N@@H+](C)C1CCCC1 ZINC000182385760 386108472 /nfs/dbraw/zinc/10/84/72/386108472.db2.gz UKBNRYXQTCGIKE-UHFFFAOYSA-N 1 1 247.382 3.502 20 0 BHADMO COc1ccccc1CCC[N@@H+](C(C)C)C1CC1 ZINC000182403115 386169248 /nfs/dbraw/zinc/16/92/48/386169248.db2.gz UKTSMGJSSCDMSN-UHFFFAOYSA-N 1 1 247.382 3.501 20 0 BHADMO Cc1cc[nH+]c(N[C@@H](C)c2cc(F)cc(F)c2)c1 ZINC000182636862 366925683 /nfs/dbraw/zinc/92/56/83/366925683.db2.gz ZCYPWGNYWISBBA-JTQLQIEISA-N 1 1 248.276 3.841 20 0 BHADMO Cc1cc[nH+]c(N[C@H](C)c2cc(F)cc(F)c2)c1 ZINC000182636881 366925528 /nfs/dbraw/zinc/92/55/28/366925528.db2.gz ZCYPWGNYWISBBA-SNVBAGLBSA-N 1 1 248.276 3.841 20 0 BHADMO Cc1cccc([C@@H](C)Nc2cc(C)cc[nH+]2)c1 ZINC000182637364 366926074 /nfs/dbraw/zinc/92/60/74/366926074.db2.gz HCGHNBNBZOKNFE-CYBMUJFWSA-N 1 1 226.323 3.872 20 0 BHADMO Cc1cccc([C@H](C)Nc2cc(C)cc[nH+]2)c1 ZINC000182637380 366925941 /nfs/dbraw/zinc/92/59/41/366925941.db2.gz HCGHNBNBZOKNFE-ZDUSSCGKSA-N 1 1 226.323 3.872 20 0 BHADMO CCc1ccc([C@@H](C)Nc2cc(C)cc[nH+]2)o1 ZINC000182637661 366926245 /nfs/dbraw/zinc/92/62/45/366926245.db2.gz AIHLAVXLXGRWJW-LLVKDONJSA-N 1 1 230.311 3.719 20 0 BHADMO CCc1ccc([C@H](C)Nc2cc(C)cc[nH+]2)o1 ZINC000182637676 366925848 /nfs/dbraw/zinc/92/58/48/366925848.db2.gz AIHLAVXLXGRWJW-NSHDSACASA-N 1 1 230.311 3.719 20 0 BHADMO Cc1cc[nH+]c(N[C@@H](C)c2cccnc2Cl)c1 ZINC000182638957 633953058 /nfs/dbraw/zinc/95/30/58/633953058.db2.gz ZTZGNLCDLOYUKR-JTQLQIEISA-N 1 1 247.729 3.612 20 0 BHADMO Cc1cc[nH+]c(N[C@H](C)c2cccnc2Cl)c1 ZINC000182638973 633952658 /nfs/dbraw/zinc/95/26/58/633952658.db2.gz ZTZGNLCDLOYUKR-SNVBAGLBSA-N 1 1 247.729 3.612 20 0 BHADMO Cc1cc[nH+]c(N[C@@H](C)c2cc(F)ccc2F)c1 ZINC000182639542 366925635 /nfs/dbraw/zinc/92/56/35/366925635.db2.gz FGTRIWMLXUAOHH-JTQLQIEISA-N 1 1 248.276 3.841 20 0 BHADMO Cc1cc[nH+]c(N[C@H](C)c2cc(F)ccc2F)c1 ZINC000182639563 366926192 /nfs/dbraw/zinc/92/61/92/366926192.db2.gz FGTRIWMLXUAOHH-SNVBAGLBSA-N 1 1 248.276 3.841 20 0 BHADMO Cc1cc[nH+]c(N[C@@H]2c3ccccc3C[C@@H]2C)c1 ZINC000182640906 366926043 /nfs/dbraw/zinc/92/60/43/366926043.db2.gz SBCZANVVAJYFFM-LRDDRELGSA-N 1 1 238.334 3.735 20 0 BHADMO Cc1cc[nH+]c(N[C@H]2c3ccccc3C[C@@H]2C)c1 ZINC000182640924 366925591 /nfs/dbraw/zinc/92/55/91/366925591.db2.gz SBCZANVVAJYFFM-BLLLJJGKSA-N 1 1 238.334 3.735 20 0 BHADMO Cc1cc[nH+]c(N[C@@H]2c3ccccc3C[C@H]2C)c1 ZINC000182640943 366925395 /nfs/dbraw/zinc/92/53/95/366925395.db2.gz SBCZANVVAJYFFM-WBMJQRKESA-N 1 1 238.334 3.735 20 0 BHADMO Cc1cc[nH+]c(N[C@H]2c3ccccc3C[C@H]2C)c1 ZINC000182640955 366925795 /nfs/dbraw/zinc/92/57/95/366925795.db2.gz SBCZANVVAJYFFM-MLGOLLRUSA-N 1 1 238.334 3.735 20 0 BHADMO CC[C@@H](C)[N@@H+](C)Cc1ncc(Cl)cc1Cl ZINC000182643696 366926215 /nfs/dbraw/zinc/92/62/15/366926215.db2.gz LOWDGPBYXNXEDQ-MRVPVSSYSA-N 1 1 247.169 3.619 20 0 BHADMO CC[C@@H](C)[N@H+](C)Cc1ncc(Cl)cc1Cl ZINC000182643696 366926214 /nfs/dbraw/zinc/92/62/14/366926214.db2.gz LOWDGPBYXNXEDQ-MRVPVSSYSA-N 1 1 247.169 3.619 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1ncc(Cl)cc1Cl ZINC000182643713 366925922 /nfs/dbraw/zinc/92/59/22/366925922.db2.gz LOWDGPBYXNXEDQ-QMMMGPOBSA-N 1 1 247.169 3.619 20 0 BHADMO CC[C@H](C)[N@H+](C)Cc1ncc(Cl)cc1Cl ZINC000182643713 366925915 /nfs/dbraw/zinc/92/59/15/366925915.db2.gz LOWDGPBYXNXEDQ-QMMMGPOBSA-N 1 1 247.169 3.619 20 0 BHADMO CC(C)[N@@H+](CCC(=O)c1ccccc1)C1CCC1 ZINC000182671683 366929528 /nfs/dbraw/zinc/92/95/28/366929528.db2.gz WCXFADOBADXBMA-UHFFFAOYSA-N 1 1 245.366 3.522 20 0 BHADMO CC(C)CSCCCn1cc[nH+]c1C(C)C ZINC000182791502 134348177 /nfs/dbraw/zinc/34/81/77/134348177.db2.gz RHZTUPSALIAOQF-UHFFFAOYSA-N 1 1 240.416 3.786 20 0 BHADMO Cc1ccc(CCn2cc[nH+]c2C(C)C)cc1 ZINC000182792031 134348086 /nfs/dbraw/zinc/34/80/86/134348086.db2.gz RWHUNCKJIAKATH-UHFFFAOYSA-N 1 1 228.339 3.558 20 0 BHADMO CC(C)c1[nH+]ccn1C[C@@H](C)c1ccccc1 ZINC000182805383 388568007 /nfs/dbraw/zinc/56/80/07/388568007.db2.gz JJBBMCXJARUVGJ-CYBMUJFWSA-N 1 1 228.339 3.810 20 0 BHADMO CC(C)c1[nH+]ccn1C[C@H](C)c1ccccc1 ZINC000182805404 388568159 /nfs/dbraw/zinc/56/81/59/388568159.db2.gz JJBBMCXJARUVGJ-ZDUSSCGKSA-N 1 1 228.339 3.810 20 0 BHADMO CC(C)c1[nH+]ccn1CCCc1cccc(F)c1 ZINC000182832861 256839853 /nfs/dbraw/zinc/83/98/53/256839853.db2.gz WGTXMJVFFXVXGC-UHFFFAOYSA-N 1 1 246.329 3.778 20 0 BHADMO Cc1cc(Cn2cc[nH+]c2C(C)C)c(C)s1 ZINC000182855568 134349085 /nfs/dbraw/zinc/34/90/85/134349085.db2.gz BAPWMTSGNBEPMX-UHFFFAOYSA-N 1 1 234.368 3.733 20 0 BHADMO CC(C)c1cnc(C[N@H+]2CCCC[C@H]2C)s1 ZINC000182944393 366960788 /nfs/dbraw/zinc/96/07/88/366960788.db2.gz VLZCZJUQQVBYOE-LLVKDONJSA-N 1 1 238.400 3.641 20 0 BHADMO CC(C)c1cnc(C[N@H+]2CCCC[C@@H]2C)s1 ZINC000182944419 347112670 /nfs/dbraw/zinc/11/26/70/347112670.db2.gz VLZCZJUQQVBYOE-NSHDSACASA-N 1 1 238.400 3.641 20 0 BHADMO CCCC[N@@H+](CC)Cc1ncc(C(C)C)s1 ZINC000182944571 366960415 /nfs/dbraw/zinc/96/04/15/366960415.db2.gz VXKFKCVAWJDXPT-UHFFFAOYSA-N 1 1 240.416 3.889 20 0 BHADMO CCCC[N@@H+](CC)Cc1cccc2cnccc21 ZINC000182952270 538965063 /nfs/dbraw/zinc/96/50/63/538965063.db2.gz UGIOALBXQHEXBE-UHFFFAOYSA-N 1 1 242.366 3.857 20 0 BHADMO CCc1[nH+]ccn1CCCc1ccccc1Cl ZINC000182953529 366961127 /nfs/dbraw/zinc/96/11/27/366961127.db2.gz HXJJVOLBULWXIR-UHFFFAOYSA-N 1 1 248.757 3.732 20 0 BHADMO CC(C)c1cnc(C[N@@H+](C)C2CCCC2)s1 ZINC000182967664 366962968 /nfs/dbraw/zinc/96/29/68/366962968.db2.gz PWDVJJVPAMQPKQ-UHFFFAOYSA-N 1 1 238.400 3.641 20 0 BHADMO CC(C)CC[N@@H+](C)Cc1ncc(C(C)C)s1 ZINC000182986951 538965464 /nfs/dbraw/zinc/96/54/64/538965464.db2.gz MKLGBPAZTXMTSJ-UHFFFAOYSA-N 1 1 240.416 3.744 20 0 BHADMO CCC[N@@H+](Cc1ncc(C(C)C)s1)C1CC1 ZINC000182988099 347114192 /nfs/dbraw/zinc/11/41/92/347114192.db2.gz HLQZMGKFXUFXBL-UHFFFAOYSA-N 1 1 238.400 3.641 20 0 BHADMO CCC[N@H+](Cc1ncc(C(C)C)s1)C1CC1 ZINC000182988099 347114191 /nfs/dbraw/zinc/11/41/91/347114191.db2.gz HLQZMGKFXUFXBL-UHFFFAOYSA-N 1 1 238.400 3.641 20 0 BHADMO CC[N@H+](Cc1ncc(C(C)C)s1)CC(C)C ZINC000182990338 366963533 /nfs/dbraw/zinc/96/35/33/366963533.db2.gz BFMGUNBGHPAIGY-UHFFFAOYSA-N 1 1 240.416 3.744 20 0 BHADMO CC(C)c1cnc(C[N@H+](C(C)C)C2CC2)s1 ZINC000182997469 366965307 /nfs/dbraw/zinc/96/53/07/366965307.db2.gz BLXAJIBTUJZBEJ-UHFFFAOYSA-N 1 1 238.400 3.639 20 0 BHADMO CC(C)c1cnc(C[N@@H+](C(C)C)C2CC2)s1 ZINC000182997469 366965303 /nfs/dbraw/zinc/96/53/03/366965303.db2.gz BLXAJIBTUJZBEJ-UHFFFAOYSA-N 1 1 238.400 3.639 20 0 BHADMO CC[C@@H](C)C[N@@H+](C)Cc1ncc(C(C)C)s1 ZINC000183002004 366964925 /nfs/dbraw/zinc/96/49/25/366964925.db2.gz RXJBDCXWSADPNO-LLVKDONJSA-N 1 1 240.416 3.744 20 0 BHADMO CC[C@H](C)C[N@@H+](C)Cc1ncc(C(C)C)s1 ZINC000183002021 366964683 /nfs/dbraw/zinc/96/46/83/366964683.db2.gz RXJBDCXWSADPNO-NSHDSACASA-N 1 1 240.416 3.744 20 0 BHADMO C[N@@H+](Cc1cccc2cnccc21)C1CCCC1 ZINC000183004826 538965264 /nfs/dbraw/zinc/96/52/64/538965264.db2.gz NYGVPUUNHCSPJA-UHFFFAOYSA-N 1 1 240.350 3.609 20 0 BHADMO CC(C)CC[N@@H+](C)Cc1cccc2cnccc21 ZINC000183046734 538965180 /nfs/dbraw/zinc/96/51/80/538965180.db2.gz JCXPTTMTBPOQEP-UHFFFAOYSA-N 1 1 242.366 3.713 20 0 BHADMO CCC[N@@H+](Cc1cccc2cnccc21)C1CC1 ZINC000183055100 538965329 /nfs/dbraw/zinc/96/53/29/538965329.db2.gz NVBHEUAUIXCPIK-UHFFFAOYSA-N 1 1 240.350 3.609 20 0 BHADMO CC[N@@H+](Cc1ccco1)[C@@H](C)Cc1ccsc1 ZINC000183055453 366970580 /nfs/dbraw/zinc/97/05/80/366970580.db2.gz MLKDTXMSTBVXRK-LBPRGKRZSA-N 1 1 249.379 3.794 20 0 BHADMO CC[N@@H+](Cc1ccco1)[C@H](C)Cc1ccsc1 ZINC000183055475 366971101 /nfs/dbraw/zinc/97/11/01/366971101.db2.gz MLKDTXMSTBVXRK-GFCCVEGCSA-N 1 1 249.379 3.794 20 0 BHADMO CC[N@H+](Cc1cccc2cnccc21)CC(C)C ZINC000183061068 538965080 /nfs/dbraw/zinc/96/50/80/538965080.db2.gz VUZUVTNXZUNTPI-UHFFFAOYSA-N 1 1 242.366 3.713 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)[C@@H](C)Cc1ccsc1 ZINC000183064174 366972324 /nfs/dbraw/zinc/97/23/24/366972324.db2.gz KMLGQPNKIIFDSE-NEPJUHHUSA-N 1 1 225.401 3.800 20 0 BHADMO CCC[C@H](C)[N@@H+](C)[C@@H](C)Cc1ccsc1 ZINC000183064195 347118208 /nfs/dbraw/zinc/11/82/08/347118208.db2.gz KMLGQPNKIIFDSE-RYUDHWBXSA-N 1 1 225.401 3.800 20 0 BHADMO CC[C@@H](C)C[N@@H+](C)Cc1cccc2cnccc21 ZINC000183117451 538965960 /nfs/dbraw/zinc/96/59/60/538965960.db2.gz VBJBLDQXTBWPJU-CYBMUJFWSA-N 1 1 242.366 3.713 20 0 BHADMO CC[C@H](C)C[N@@H+](C)Cc1cccc2cnccc21 ZINC000183117465 538966052 /nfs/dbraw/zinc/96/60/52/538966052.db2.gz VBJBLDQXTBWPJU-ZDUSSCGKSA-N 1 1 242.366 3.713 20 0 BHADMO CC(C)c1cnc(C[N@@H+]2[C@H](C)CC[C@@H]2C)s1 ZINC000183124157 366978679 /nfs/dbraw/zinc/97/86/79/366978679.db2.gz UNFJHKNWLMGXAV-PHIMTYICSA-N 1 1 238.400 3.639 20 0 BHADMO CCC(CC)C[N@@H+](C)C[C@@H](C)c1nccs1 ZINC000183263071 367006058 /nfs/dbraw/zinc/00/60/58/367006058.db2.gz XTDCONWIRZUQDZ-LLVKDONJSA-N 1 1 240.416 3.615 20 0 BHADMO CCC(CC)C[N@@H+](C)C[C@H](C)c1nccs1 ZINC000183263088 367006989 /nfs/dbraw/zinc/00/69/89/367006989.db2.gz XTDCONWIRZUQDZ-NSHDSACASA-N 1 1 240.416 3.615 20 0 BHADMO CCC[C@@H](C)C[N@@H+](C)C[C@@H](C)c1nccs1 ZINC000183263215 347123054 /nfs/dbraw/zinc/12/30/54/347123054.db2.gz NOUSMHYHABZSGB-VXGBXAGGSA-N 1 1 240.416 3.615 20 0 BHADMO CCC[C@H](C)C[N@@H+](C)C[C@@H](C)c1nccs1 ZINC000183263240 367005977 /nfs/dbraw/zinc/00/59/77/367005977.db2.gz NOUSMHYHABZSGB-NWDGAFQWSA-N 1 1 240.416 3.615 20 0 BHADMO C[C@@H](CCc1cccc(F)c1)[N@@H+](C)C1CCC1 ZINC000183318891 345937137 /nfs/dbraw/zinc/93/71/37/345937137.db2.gz GDUDYGWAERCONA-LBPRGKRZSA-N 1 1 235.346 3.631 20 0 BHADMO C[C@H](CCc1cccc(F)c1)[N@@H+](C)C1CCC1 ZINC000183318911 345937451 /nfs/dbraw/zinc/93/74/51/345937451.db2.gz GDUDYGWAERCONA-GFCCVEGCSA-N 1 1 235.346 3.631 20 0 BHADMO COc1ccc([C@@H](C)C[N@@H+](C)CC2CCC2)cc1 ZINC000183391785 367019097 /nfs/dbraw/zinc/01/90/97/367019097.db2.gz SMPVRXHWBZSRER-ZDUSSCGKSA-N 1 1 247.382 3.531 20 0 BHADMO COc1ccc([C@H](C)C[N@@H+](C)CC2CCC2)cc1 ZINC000183391799 367019278 /nfs/dbraw/zinc/01/92/78/367019278.db2.gz SMPVRXHWBZSRER-CYBMUJFWSA-N 1 1 247.382 3.531 20 0 BHADMO CCCC[C@@H](CC)C[N@@H+](C)Cc1cc(C)on1 ZINC000183596452 347130875 /nfs/dbraw/zinc/13/08/75/347130875.db2.gz SNIXRBZXFONOBP-CYBMUJFWSA-N 1 1 238.375 3.631 20 0 BHADMO CCCC[C@H](CC)C[N@@H+](C)Cc1cc(C)on1 ZINC000183596470 367032319 /nfs/dbraw/zinc/03/23/19/367032319.db2.gz SNIXRBZXFONOBP-ZDUSSCGKSA-N 1 1 238.375 3.631 20 0 BHADMO CCCC[C@@H](CC)C[N@@H+](C)Cc1cscn1 ZINC000183604150 347130896 /nfs/dbraw/zinc/13/08/96/347130896.db2.gz FJBDLSFZRMTDMJ-GFCCVEGCSA-N 1 1 240.416 3.791 20 0 BHADMO CCCC[C@H](CC)C[N@@H+](C)Cc1cscn1 ZINC000183604166 367032183 /nfs/dbraw/zinc/03/21/83/367032183.db2.gz FJBDLSFZRMTDMJ-LBPRGKRZSA-N 1 1 240.416 3.791 20 0 BHADMO CCCC[C@@H](CC)C[N@@H+](C)C[C@@H]1CCCOC1 ZINC000183616859 367032687 /nfs/dbraw/zinc/03/26/87/367032687.db2.gz XCFMPLIAPCAIMS-CABCVRRESA-N 1 1 241.419 3.561 20 0 BHADMO CCCC[C@H](CC)C[N@@H+](C)C[C@@H]1CCCOC1 ZINC000183616881 367032018 /nfs/dbraw/zinc/03/20/18/367032018.db2.gz XCFMPLIAPCAIMS-GJZGRUSLSA-N 1 1 241.419 3.561 20 0 BHADMO CCCC[C@@H](CC)C[N@@H+](C)Cc1nccs1 ZINC000183628609 367033505 /nfs/dbraw/zinc/03/35/05/367033505.db2.gz LWBXFLWFCQJKKT-GFCCVEGCSA-N 1 1 240.416 3.791 20 0 BHADMO CCCC[C@H](CC)C[N@@H+](C)Cc1nccs1 ZINC000183628629 367034127 /nfs/dbraw/zinc/03/41/27/367034127.db2.gz LWBXFLWFCQJKKT-LBPRGKRZSA-N 1 1 240.416 3.791 20 0 BHADMO CCCC[C@@H](CC)C[N@@H+](C)CC1CCOCC1 ZINC000183647307 367034463 /nfs/dbraw/zinc/03/44/63/367034463.db2.gz FSMGBNTYNSQSFX-CQSZACIVSA-N 1 1 241.419 3.561 20 0 BHADMO CCCC[C@H](CC)C[N@@H+](C)CC1CCOCC1 ZINC000183647334 367033412 /nfs/dbraw/zinc/03/34/12/367033412.db2.gz FSMGBNTYNSQSFX-AWEZNQCLSA-N 1 1 241.419 3.561 20 0 BHADMO C[C@@H](c1ccccn1)[N@@H+](C)C[C@H]1CCCC[C@H]1C ZINC000183678778 367038000 /nfs/dbraw/zinc/03/80/00/367038000.db2.gz LBDOIVCFFHAEMR-QLFBSQMISA-N 1 1 246.398 3.901 20 0 BHADMO C[C@@H](c1ccccn1)[N@@H+](C)C[C@@H]1CCCC[C@H]1C ZINC000183678812 367038320 /nfs/dbraw/zinc/03/83/20/367038320.db2.gz LBDOIVCFFHAEMR-ILXRZTDVSA-N 1 1 246.398 3.901 20 0 BHADMO C[C@@H](c1ccncc1)[N@@H+](C)C[C@H]1CCCC[C@H]1C ZINC000183714639 367042715 /nfs/dbraw/zinc/04/27/15/367042715.db2.gz NXYATFXHAJUWEQ-IJEWVQPXSA-N 1 1 246.398 3.901 20 0 BHADMO C[C@@H](c1ccncc1)[N@@H+](C)C[C@@H]1CCCC[C@H]1C ZINC000183714675 367042008 /nfs/dbraw/zinc/04/20/08/367042008.db2.gz NXYATFXHAJUWEQ-YCPHGPKFSA-N 1 1 246.398 3.901 20 0 BHADMO CCC[C@@H](C)C[N@@H+](C)[C@@H](C)c1ccncc1 ZINC000183716753 169357498 /nfs/dbraw/zinc/35/74/98/169357498.db2.gz KLEGTGVJENHLEC-OLZOCXBDSA-N 1 1 220.360 3.511 20 0 BHADMO CCC[C@H](C)C[N@@H+](C)[C@@H](C)c1ccncc1 ZINC000183716772 169479135 /nfs/dbraw/zinc/47/91/35/169479135.db2.gz KLEGTGVJENHLEC-STQMWFEESA-N 1 1 220.360 3.511 20 0 BHADMO C[C@@H](c1cccnc1)[N@@H+](C)C[C@H]1CCCC[C@H]1C ZINC000183730090 367044210 /nfs/dbraw/zinc/04/42/10/367044210.db2.gz CXCKJNUKGNWHRS-IJEWVQPXSA-N 1 1 246.398 3.901 20 0 BHADMO C[C@@H](c1cccnc1)[N@@H+](C)C[C@@H]1CCCC[C@H]1C ZINC000183730127 367043889 /nfs/dbraw/zinc/04/38/89/367043889.db2.gz CXCKJNUKGNWHRS-YCPHGPKFSA-N 1 1 246.398 3.901 20 0 BHADMO CCC[C@@H](C)C[N@@H+](C)[C@@H](C)c1cccnc1 ZINC000183732179 169358049 /nfs/dbraw/zinc/35/80/49/169358049.db2.gz LWFBWSWGXQGPDL-OLZOCXBDSA-N 1 1 220.360 3.511 20 0 BHADMO CCC[C@H](C)C[N@@H+](C)[C@@H](C)c1cccnc1 ZINC000183732197 385793129 /nfs/dbraw/zinc/79/31/29/385793129.db2.gz LWFBWSWGXQGPDL-STQMWFEESA-N 1 1 220.360 3.511 20 0 BHADMO C[N@@H+](CCc1ccccn1)CC1CCCCCC1 ZINC000183733492 367043318 /nfs/dbraw/zinc/04/33/18/367043318.db2.gz OAKXSYORIXLJQN-UHFFFAOYSA-N 1 1 246.398 3.526 20 0 BHADMO C[N@@H+](CCc1ccncc1)CC1CCCCCC1 ZINC000183754250 367045177 /nfs/dbraw/zinc/04/51/77/367045177.db2.gz NUHACOVEVQLDGV-UHFFFAOYSA-N 1 1 246.398 3.526 20 0 BHADMO CCCC[N@@H+](C)Cc1ccc(C(F)F)cc1 ZINC000183919514 388572087 /nfs/dbraw/zinc/57/20/87/388572087.db2.gz QJHLJMQJQXKPOL-UHFFFAOYSA-N 1 1 227.298 3.856 20 0 BHADMO C[N@@H+](Cc1ccc(C(F)F)cc1)C1CCCC1 ZINC000183921569 388572064 /nfs/dbraw/zinc/57/20/64/388572064.db2.gz LNNZQCHQIDUOTG-UHFFFAOYSA-N 1 1 239.309 3.999 20 0 BHADMO C[C@@H](C1CC1)[N@@H+](C)Cc1ccc(C(F)F)cc1 ZINC000183921992 367058078 /nfs/dbraw/zinc/05/80/78/367058078.db2.gz PPVMTRSLBIARDR-JTQLQIEISA-N 1 1 239.309 3.855 20 0 BHADMO C[C@H](C1CC1)[N@@H+](C)Cc1ccc(C(F)F)cc1 ZINC000183922007 367057129 /nfs/dbraw/zinc/05/71/29/367057129.db2.gz PPVMTRSLBIARDR-SNVBAGLBSA-N 1 1 239.309 3.855 20 0 BHADMO C[C@@H]1CCC[N@@H+](Cc2ccc(C(F)F)cc2)C1 ZINC000183922516 134357792 /nfs/dbraw/zinc/35/77/92/134357792.db2.gz BLYCWVZKIDHXID-LLVKDONJSA-N 1 1 239.309 3.856 20 0 BHADMO C[C@H]1CCC[N@@H+](Cc2ccc(C(F)F)cc2)C1 ZINC000183922533 134357844 /nfs/dbraw/zinc/35/78/44/134357844.db2.gz BLYCWVZKIDHXID-NSHDSACASA-N 1 1 239.309 3.856 20 0 BHADMO C[C@@H]1CCCC[N@H+]1Cc1ccc(C(F)F)cc1 ZINC000183922764 388571961 /nfs/dbraw/zinc/57/19/61/388571961.db2.gz LZVVGKHDFVVZMK-LLVKDONJSA-N 1 1 239.309 3.999 20 0 BHADMO C[C@H]1CCCC[N@H+]1Cc1ccc(C(F)F)cc1 ZINC000183922781 388572939 /nfs/dbraw/zinc/57/29/39/388572939.db2.gz LZVVGKHDFVVZMK-NSHDSACASA-N 1 1 239.309 3.999 20 0 BHADMO CC[N@@H+](Cc1ccc(C(F)F)cc1)C1CC1 ZINC000183924732 347143326 /nfs/dbraw/zinc/14/33/26/347143326.db2.gz NREKPSWBQNDJEG-UHFFFAOYSA-N 1 1 225.282 3.609 20 0 BHADMO CC(C)[N@@H+](Cc1ccc(C(F)F)cc1)C1CC1 ZINC000183926224 535091117 /nfs/dbraw/zinc/09/11/17/535091117.db2.gz GCEDNZAKNZGBGB-UHFFFAOYSA-N 1 1 239.309 3.997 20 0 BHADMO CC[N@@H+](Cc1ccc(C(F)F)cc1)C(C)C ZINC000183927829 134357740 /nfs/dbraw/zinc/35/77/40/134357740.db2.gz MCZSRVOHZYEYKX-UHFFFAOYSA-N 1 1 227.298 3.855 20 0 BHADMO FC(F)c1ccc(C[N@H+]2C[C@H]3CC[C@@H]2C3)cc1 ZINC000183928183 187310327 /nfs/dbraw/zinc/31/03/27/187310327.db2.gz XKVROHKPDLHITG-WCQYABFASA-N 1 1 237.293 3.609 20 0 BHADMO CC1(C)CCC[N@H+]1Cc1ccc(C(F)F)cc1 ZINC000183936569 134357688 /nfs/dbraw/zinc/35/76/88/134357688.db2.gz PHXPBHWTQZOGJL-UHFFFAOYSA-N 1 1 239.309 3.999 20 0 BHADMO CCC[N@@H+](Cc1ccc(C(F)F)cc1)C1CC1 ZINC000183937315 388572123 /nfs/dbraw/zinc/57/21/23/388572123.db2.gz LKAHQOUNCHHQTA-UHFFFAOYSA-N 1 1 239.309 3.999 20 0 BHADMO C[N@H+](Cc1ccc(C(F)F)cc1)CC1CCC1 ZINC000183944632 536466549 /nfs/dbraw/zinc/46/65/49/536466549.db2.gz WYFISRDTEOIDLJ-UHFFFAOYSA-N 1 1 239.309 3.856 20 0 BHADMO CC[N@H+](Cc1ccc(C(F)F)cc1)CC1CC1 ZINC000183944984 388572726 /nfs/dbraw/zinc/57/27/26/388572726.db2.gz SNNOMRQZKPMIRT-UHFFFAOYSA-N 1 1 239.309 3.856 20 0 BHADMO C[N@@H+](Cc1ccc(C(F)F)cc1)C1CCC1 ZINC000183951789 536466576 /nfs/dbraw/zinc/46/65/76/536466576.db2.gz NTMICEXANJFIOE-UHFFFAOYSA-N 1 1 225.282 3.609 20 0 BHADMO CC1(C)CC[N@@H+](Cc2ccc(C(F)F)cc2)C1 ZINC000183952828 388572362 /nfs/dbraw/zinc/57/23/62/388572362.db2.gz SEDVPOOSFHFIFZ-UHFFFAOYSA-N 1 1 239.309 3.856 20 0 BHADMO C[C@@H]1CCC[N@H+]1Cc1ccc(C(F)F)cc1 ZINC000183953155 176108339 /nfs/dbraw/zinc/10/83/39/176108339.db2.gz FKTDOBFWCGYKSM-SNVBAGLBSA-N 1 1 225.282 3.609 20 0 BHADMO C[C@H]1CCC[N@H+]1Cc1ccc(C(F)F)cc1 ZINC000183953171 177110343 /nfs/dbraw/zinc/11/03/43/177110343.db2.gz FKTDOBFWCGYKSM-JTQLQIEISA-N 1 1 225.282 3.609 20 0 BHADMO C[C@@H]1CC[N@@H+](Cc2ccc(C(F)F)cc2)[C@@H]1C ZINC000183955274 134357584 /nfs/dbraw/zinc/35/75/84/134357584.db2.gz BZUAWHIWRWMNGC-GHMZBOCLSA-N 1 1 239.309 3.855 20 0 BHADMO C[C@@H]1[C@@H](C)CC[N@H+]1Cc1ccc(C(F)F)cc1 ZINC000183955288 134357743 /nfs/dbraw/zinc/35/77/43/134357743.db2.gz BZUAWHIWRWMNGC-WDEREUQCSA-N 1 1 239.309 3.855 20 0 BHADMO CC[C@@H]1CC[N@@H+](Cc2ccc(C(F)F)cc2)C1 ZINC000183958425 388572468 /nfs/dbraw/zinc/57/24/68/388572468.db2.gz CBSOOFICKHFOJA-LLVKDONJSA-N 1 1 239.309 3.856 20 0 BHADMO CC[C@H]1CC[N@@H+](Cc2ccc(C(F)F)cc2)C1 ZINC000183958443 388572521 /nfs/dbraw/zinc/57/25/21/388572521.db2.gz CBSOOFICKHFOJA-NSHDSACASA-N 1 1 239.309 3.856 20 0 BHADMO C[C@@H]1CC[C@H](C)[N@@H+]1Cc1ccc(C(F)F)cc1 ZINC000183959179 134357695 /nfs/dbraw/zinc/35/76/95/134357695.db2.gz PCQLKBYUTHBLFY-PHIMTYICSA-N 1 1 239.309 3.997 20 0 BHADMO CC[C@@H](C)[N@@H+](C)Cc1ccc(C(F)F)cc1 ZINC000183966368 134355886 /nfs/dbraw/zinc/35/58/86/134355886.db2.gz VDINCOATULSIJR-SNVBAGLBSA-N 1 1 227.298 3.855 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1ccc(C(F)F)cc1 ZINC000183966383 134355841 /nfs/dbraw/zinc/35/58/41/134355841.db2.gz VDINCOATULSIJR-JTQLQIEISA-N 1 1 227.298 3.855 20 0 BHADMO C[N@@H+](CCC1CC1)Cc1ccc(C(F)F)cc1 ZINC000183979239 134355908 /nfs/dbraw/zinc/35/59/08/134355908.db2.gz OKSUIMMENOUVPL-UHFFFAOYSA-N 1 1 239.309 3.856 20 0 BHADMO CCCCCC[N@@H+](C)C[C@@H](C)c1nccs1 ZINC000184000373 643189977 /nfs/dbraw/zinc/18/99/77/643189977.db2.gz GQWKMMCGOPQUFN-GFCCVEGCSA-N 1 1 240.416 3.759 20 0 BHADMO CCCCCC[N@@H+](C)C[C@H](C)c1nccs1 ZINC000184000394 643190098 /nfs/dbraw/zinc/19/00/98/643190098.db2.gz GQWKMMCGOPQUFN-LBPRGKRZSA-N 1 1 240.416 3.759 20 0 BHADMO CCC[C@@H]1CCCC[N@H+]1Cc1cccnc1C ZINC000184233807 535409391 /nfs/dbraw/zinc/40/93/91/535409391.db2.gz ZVMMVIXPLFIFKP-OAHLLOKOSA-N 1 1 232.371 3.545 20 0 BHADMO CCC[C@H]1CCCC[N@H+]1Cc1cccnc1C ZINC000184233823 134361154 /nfs/dbraw/zinc/36/11/54/134361154.db2.gz ZVMMVIXPLFIFKP-HNNXBMFYSA-N 1 1 232.371 3.545 20 0 BHADMO CCC[C@@H]1CCCC[N@H+]1Cc1cnn(C(C)C)c1 ZINC000184234198 535409933 /nfs/dbraw/zinc/40/99/33/535409933.db2.gz BXFCGBBJDSLYJI-OAHLLOKOSA-N 1 1 249.402 3.619 20 0 BHADMO CCC[C@H]1CCCC[N@H+]1Cc1cnn(C(C)C)c1 ZINC000184234218 134361131 /nfs/dbraw/zinc/36/11/31/134361131.db2.gz BXFCGBBJDSLYJI-HNNXBMFYSA-N 1 1 249.402 3.619 20 0 BHADMO CC/C=C/CC[N@@H+]1CCC[C@@H](OCCC)CC1 ZINC000184540817 134363301 /nfs/dbraw/zinc/36/33/01/134363301.db2.gz RZPGGFMUODBVSZ-LLYBFZRZSA-N 1 1 239.403 3.624 20 0 BHADMO CC/C=C/CC[N@@H+]1CCC[C@H](OCCC)CC1 ZINC000184540835 535232182 /nfs/dbraw/zinc/23/21/82/535232182.db2.gz RZPGGFMUODBVSZ-NFAHFFEMSA-N 1 1 239.403 3.624 20 0 BHADMO Cc1[nH]ncc1[C@@H](C)[NH2+]CCC1=CCCCCC1 ZINC000184573560 538969231 /nfs/dbraw/zinc/96/92/31/538969231.db2.gz QFKARUGKADGERB-GFCCVEGCSA-N 1 1 247.386 3.649 20 0 BHADMO Cc1[nH]ncc1[C@H](C)[NH2+]CCC1=CCCCCC1 ZINC000184573578 538969159 /nfs/dbraw/zinc/96/91/59/538969159.db2.gz QFKARUGKADGERB-LBPRGKRZSA-N 1 1 247.386 3.649 20 0 BHADMO CC/C=C/CC[N@@H+](C)CCc1cccs1 ZINC000184584881 388579043 /nfs/dbraw/zinc/57/90/43/388579043.db2.gz SEAAHBHGQARTTF-SNAWJCMRSA-N 1 1 223.385 3.579 20 0 BHADMO CC/C=C/CC[N@@H+](C)Cc1ccc(Cl)nc1 ZINC000184601023 188168981 /nfs/dbraw/zinc/16/89/81/188168981.db2.gz PEPPUMHUTOUVPG-SNAWJCMRSA-N 1 1 238.762 3.523 20 0 BHADMO CC/C=C/CC[N@H+]1CCC[C@@H]1c1cccc(C)n1 ZINC000184623885 367085779 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SCTJFTLLTBXZAM-UHFFFAOYSA-N 1 1 235.396 3.783 20 0 BHADMO COc1ccsc1[C@H](C)Nc1cc(C)cc[nH+]1 ZINC000186241120 175380778 /nfs/dbraw/zinc/38/07/78/175380778.db2.gz LCBPHOSNBRFXHF-JTQLQIEISA-N 1 1 248.351 3.633 20 0 BHADMO COc1ccsc1[C@@H](C)Nc1cc(C)cc[nH+]1 ZINC000186241141 175379400 /nfs/dbraw/zinc/37/94/00/175379400.db2.gz LCBPHOSNBRFXHF-SNVBAGLBSA-N 1 1 248.351 3.633 20 0 BHADMO CCC[C@H](Nc1cc(C)cc[nH+]1)c1cccnc1 ZINC000186242652 346498505 /nfs/dbraw/zinc/49/85/05/346498505.db2.gz TWTUSRNELANMBJ-AWEZNQCLSA-N 1 1 241.338 3.738 20 0 BHADMO CCC[C@@H](Nc1cc(C)cc[nH+]1)c1cccnc1 ZINC000186242670 346498530 /nfs/dbraw/zinc/49/85/30/346498530.db2.gz TWTUSRNELANMBJ-CQSZACIVSA-N 1 1 241.338 3.738 20 0 BHADMO Cc1cc([NH+](C)C)cc(C)c1NCc1ccco1 ZINC000186266712 178094685 /nfs/dbraw/zinc/09/46/85/178094685.db2.gz TUURXYMDMQYGHE-UHFFFAOYSA-N 1 1 244.338 3.575 20 0 BHADMO CSCCCCCNc1cc[nH+]cc1Cl ZINC000186363618 384839309 /nfs/dbraw/zinc/83/93/09/384839309.db2.gz VWVAFSVTNHVSDX-UHFFFAOYSA-N 1 1 244.791 3.680 20 0 BHADMO CCC(CC)C[N@H+]1C[C@H](C)C[C@@H]1c1cccnc1 ZINC000186411028 388599795 /nfs/dbraw/zinc/59/97/95/388599795.db2.gz MZJHMILDYCJCJO-CZUORRHYSA-N 1 1 246.398 3.901 20 0 BHADMO CCC(CC)C[N@H+]1C[C@@H](C)C[C@@H]1c1cccnc1 ZINC000186411045 388599849 /nfs/dbraw/zinc/59/98/49/388599849.db2.gz MZJHMILDYCJCJO-XJKSGUPXSA-N 1 1 246.398 3.901 20 0 BHADMO CC1=CCC[C@@H](C)[C@H]1C[N@@H+](C)Cc1cccnc1 ZINC000186423307 398053840 /nfs/dbraw/zinc/05/38/40/398053840.db2.gz FIUCMHPHPCFLNE-ZBFHGGJFSA-N 1 1 244.382 3.506 20 0 BHADMO CC1=CCC[C@H](C)[C@H]1C[N@@H+](C)Cc1cccnc1 ZINC000186423324 134416500 /nfs/dbraw/zinc/41/65/00/134416500.db2.gz FIUCMHPHPCFLNE-HOCLYGCPSA-N 1 1 244.382 3.506 20 0 BHADMO CC1=CCC[C@@H](C)[C@@H]1C[N@@H+](C)Cc1cccnc1 ZINC000186423344 398053684 /nfs/dbraw/zinc/05/36/84/398053684.db2.gz FIUCMHPHPCFLNE-GDBMZVCRSA-N 1 1 244.382 3.506 20 0 BHADMO CC1=CCC[C@H](C)[C@@H]1C[N@@H+](C)Cc1cccnc1 ZINC000186423361 398053831 /nfs/dbraw/zinc/05/38/31/398053831.db2.gz FIUCMHPHPCFLNE-GOEBONIOSA-N 1 1 244.382 3.506 20 0 BHADMO Cc1ccc(C[N@H+](C)C2CCC(C)CC2)c(C)n1 ZINC000186498624 387098980 /nfs/dbraw/zinc/09/89/80/387098980.db2.gz ABIOKVWOMBXINK-UHFFFAOYSA-N 1 1 246.398 3.709 20 0 BHADMO C(=C/c1ccccc1)\C[N@H+]1CCCC2(CC2)C1 ZINC000186607505 388601785 /nfs/dbraw/zinc/60/17/85/388601785.db2.gz FFPORNAPMMLUFK-XBXARRHUSA-N 1 1 227.351 3.576 20 0 BHADMO c1cc2c(cccc2C[N@H+]2CCCC3(CC3)C2)[nH]1 ZINC000186607590 183339477 /nfs/dbraw/zinc/33/94/77/183339477.db2.gz ZJUXYYAYRLRAPK-UHFFFAOYSA-N 1 1 240.350 3.544 20 0 BHADMO CC(C)(CC1CCCCCC1)[NH2+]Cc1c[nH]cn1 ZINC000186609837 388601233 /nfs/dbraw/zinc/60/12/33/388601233.db2.gz MUOXDERJSOBSOQ-UHFFFAOYSA-N 1 1 249.402 3.638 20 0 BHADMO CCC[C@@H](C)[N@@H+]1CC=C(c2ccc(O)cc2)CC1 ZINC000186613365 388601074 /nfs/dbraw/zinc/60/10/74/388601074.db2.gz SJQBISXNWAXZJR-CYBMUJFWSA-N 1 1 245.366 3.670 20 0 BHADMO CCC[C@H](C)[N@@H+]1CC=C(c2ccc(O)cc2)CC1 ZINC000186613383 388601519 /nfs/dbraw/zinc/60/15/19/388601519.db2.gz SJQBISXNWAXZJR-ZDUSSCGKSA-N 1 1 245.366 3.670 20 0 BHADMO Clc1ccc(C[N@H+]2CCCC3(CC3)C2)s1 ZINC000186624640 387117552 /nfs/dbraw/zinc/11/75/52/387117552.db2.gz RGUBIPBJTQHYKR-UHFFFAOYSA-N 1 1 241.787 3.778 20 0 BHADMO CC[N@@H+](Cc1ccc(C)nc1C)C1CCCCC1 ZINC000186663716 387119362 /nfs/dbraw/zinc/11/93/62/387119362.db2.gz LZDGNZLMFCFDOU-UHFFFAOYSA-N 1 1 246.398 3.853 20 0 BHADMO Cc1ccc(C[N@H+](CCC(C)C)C2CC2)c(C)n1 ZINC000186667818 538973909 /nfs/dbraw/zinc/97/39/09/538973909.db2.gz WDULHTQJKYCROG-UHFFFAOYSA-N 1 1 246.398 3.709 20 0 BHADMO Cc1ccc(C[N@H+](CC(C)C)C(C)C)c(C)n1 ZINC000186669282 387119855 /nfs/dbraw/zinc/11/98/55/387119855.db2.gz NBYTVMMQGGZLHM-UHFFFAOYSA-N 1 1 234.387 3.565 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@@H]2CCC[C@H](C)C2)c(C)n1 ZINC000186669959 387120136 /nfs/dbraw/zinc/12/01/36/387120136.db2.gz SIXDNLQVWOQCKM-BLLLJJGKSA-N 1 1 246.398 3.709 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@H]2CCC[C@H](C)C2)c(C)n1 ZINC000186669984 387119323 /nfs/dbraw/zinc/11/93/23/387119323.db2.gz SIXDNLQVWOQCKM-LRDDRELGSA-N 1 1 246.398 3.709 20 0 BHADMO CCC[C@@H](C)[N@H+]1CCc2[nH]c3ccccc3c2C1 ZINC000186767657 388603769 /nfs/dbraw/zinc/60/37/69/388603769.db2.gz QJWVPAOYLHMCHE-GFCCVEGCSA-N 1 1 242.366 3.715 20 0 BHADMO CCC[C@H](C)[N@H+]1CCc2[nH]c3ccccc3c2C1 ZINC000186767678 388603647 /nfs/dbraw/zinc/60/36/47/388603647.db2.gz QJWVPAOYLHMCHE-LBPRGKRZSA-N 1 1 242.366 3.715 20 0 BHADMO CC[N@@H+](Cc1ccc(C)nc1C)[C@@H](C)C(C)C ZINC000186780491 387134412 /nfs/dbraw/zinc/13/44/12/387134412.db2.gz GSSOYFIAJVCMHP-AWEZNQCLSA-N 1 1 234.387 3.565 20 0 BHADMO CC[N@@H+](Cc1ccc(C)nc1C)[C@H](C)C(C)C ZINC000186780510 387134273 /nfs/dbraw/zinc/13/42/73/387134273.db2.gz GSSOYFIAJVCMHP-CQSZACIVSA-N 1 1 234.387 3.565 20 0 BHADMO C[C@@H](c1ccccc1)[N@H+]1CCCC2(CC2)C1 ZINC000186955957 387157207 /nfs/dbraw/zinc/15/72/07/387157207.db2.gz RFUZMUGQSQWSIE-ZDUSSCGKSA-N 1 1 215.340 3.624 20 0 BHADMO C[C@H](c1ccccc1)[N@H+]1CCCC2(CC2)C1 ZINC000186955976 387156803 /nfs/dbraw/zinc/15/68/03/387156803.db2.gz RFUZMUGQSQWSIE-CYBMUJFWSA-N 1 1 215.340 3.624 20 0 BHADMO COc1cccc([C@H](C)[N@H+]2CCCC3(CC3)C2)c1 ZINC000186957550 387157225 /nfs/dbraw/zinc/15/72/25/387157225.db2.gz UUVYNOLTEHQUBS-ZDUSSCGKSA-N 1 1 245.366 3.632 20 0 BHADMO COc1cccc([C@@H](C)[N@H+]2CCCC3(CC3)C2)c1 ZINC000186957568 387156893 /nfs/dbraw/zinc/15/68/93/387156893.db2.gz UUVYNOLTEHQUBS-CYBMUJFWSA-N 1 1 245.366 3.632 20 0 BHADMO C[C@@H](c1ccccc1F)[N@H+]1CCCC2(CC2)C1 ZINC000186962554 387156781 /nfs/dbraw/zinc/15/67/81/387156781.db2.gz RPDRYBPKGDHTNU-LBPRGKRZSA-N 1 1 233.330 3.763 20 0 BHADMO C[C@H](c1ccccc1F)[N@H+]1CCCC2(CC2)C1 ZINC000186962573 387156649 /nfs/dbraw/zinc/15/66/49/387156649.db2.gz RPDRYBPKGDHTNU-GFCCVEGCSA-N 1 1 233.330 3.763 20 0 BHADMO C[C@@H](c1cccc(F)c1)[N@H+]1CCCC2(CC2)C1 ZINC000186975514 387155247 /nfs/dbraw/zinc/15/52/47/387155247.db2.gz DCYVUZAHQMIXQP-LBPRGKRZSA-N 1 1 233.330 3.763 20 0 BHADMO C[C@H](c1cccc(F)c1)[N@H+]1CCCC2(CC2)C1 ZINC000186975535 387157235 /nfs/dbraw/zinc/15/72/35/387157235.db2.gz DCYVUZAHQMIXQP-GFCCVEGCSA-N 1 1 233.330 3.763 20 0 BHADMO Fc1ccc2c(c1)[C@H]([N@H+]1CCCC3(CC3)C1)CC2 ZINC000186991348 387158153 /nfs/dbraw/zinc/15/81/53/387158153.db2.gz ZZGUHZIWAVEOEP-OAHLLOKOSA-N 1 1 245.341 3.689 20 0 BHADMO Fc1ccc2c(c1)[C@@H]([N@H+]1CCCC3(CC3)C1)CC2 ZINC000186991371 387159931 /nfs/dbraw/zinc/15/99/31/387159931.db2.gz ZZGUHZIWAVEOEP-HNNXBMFYSA-N 1 1 245.341 3.689 20 0 BHADMO Cc1ccc(C[N@@H+](C2CC2)C2CCCC2)c(C)n1 ZINC000187006247 346551588 /nfs/dbraw/zinc/55/15/88/346551588.db2.gz CBFNQYGYDOWXOP-UHFFFAOYSA-N 1 1 244.382 3.605 20 0 BHADMO CC[C@@H](C)C[N@@H+](CC)Cc1ccc(C)nc1C ZINC000187120515 387168711 /nfs/dbraw/zinc/16/87/11/387168711.db2.gz LDHGDGMKNUPXJV-GFCCVEGCSA-N 1 1 234.387 3.566 20 0 BHADMO CC[C@H](C)C[N@@H+](CC)Cc1ccc(C)nc1C ZINC000187120534 387167125 /nfs/dbraw/zinc/16/71/25/387167125.db2.gz LDHGDGMKNUPXJV-LBPRGKRZSA-N 1 1 234.387 3.566 20 0 BHADMO Cc1ccc(C[N@H+](C(C)C)C2CCCC2)c(C)n1 ZINC000187235776 134459444 /nfs/dbraw/zinc/45/94/44/134459444.db2.gz XLNMHYGCJVPIGE-UHFFFAOYSA-N 1 1 246.398 3.851 20 0 BHADMO Cc1ccc2cc(C[N@@H+]3CCC[C@@H]3C)ccc2n1 ZINC000187263902 386506404 /nfs/dbraw/zinc/50/64/04/386506404.db2.gz HVAGQANVCVKTEK-ZDUSSCGKSA-N 1 1 240.350 3.528 20 0 BHADMO Cc1ccc2cc(C[N@@H+]3CCC[C@H]3C)ccc2n1 ZINC000187263920 386507364 /nfs/dbraw/zinc/50/73/64/386507364.db2.gz HVAGQANVCVKTEK-CYBMUJFWSA-N 1 1 240.350 3.528 20 0 BHADMO C[N@@H+](CCCCCOc1ccccc1)C1CCC1 ZINC000187312826 386522149 /nfs/dbraw/zinc/52/21/49/386522149.db2.gz NIVWSJJSSQVQTP-UHFFFAOYSA-N 1 1 247.382 3.720 20 0 BHADMO Cc1ccc2cc(C[N@H+](C)C3CCC3)ccc2n1 ZINC000187312895 384933520 /nfs/dbraw/zinc/93/35/20/384933520.db2.gz KHPIWPIDGKQODT-UHFFFAOYSA-N 1 1 240.350 3.528 20 0 BHADMO CCC[C@@H](C)[N@H+]1CCC[C@H](c2nccs2)C1 ZINC000187669552 388610856 /nfs/dbraw/zinc/61/08/56/388610856.db2.gz XQGQJKWQXWSIJL-NEPJUHHUSA-N 1 1 238.400 3.511 20 0 BHADMO CCC[C@H](C)[N@H+]1CCC[C@H](c2nccs2)C1 ZINC000187669566 259312286 /nfs/dbraw/zinc/31/22/86/259312286.db2.gz XQGQJKWQXWSIJL-RYUDHWBXSA-N 1 1 238.400 3.511 20 0 BHADMO CCC[C@@H](C)[N@H+]1CCc2c3ccccc3[nH]c2C1 ZINC000187706355 259303880 /nfs/dbraw/zinc/30/38/80/259303880.db2.gz IJLYIKFQQHSKDF-GFCCVEGCSA-N 1 1 242.366 3.715 20 0 BHADMO CCC[C@H](C)[N@H+]1CCc2c3ccccc3[nH]c2C1 ZINC000187706374 259304032 /nfs/dbraw/zinc/30/40/32/259304032.db2.gz IJLYIKFQQHSKDF-LBPRGKRZSA-N 1 1 242.366 3.715 20 0 BHADMO CC[N@@H+](C/C=C/Cl)[C@@H](C)Cc1ccsc1 ZINC000187792260 640927934 /nfs/dbraw/zinc/92/79/34/640927934.db2.gz FLAWWPAAHGAPIJ-MALLOTDXSA-N 1 1 243.803 3.754 20 0 BHADMO CC[N@@H+](C/C=C/Cl)[C@H](C)Cc1ccsc1 ZINC000187792280 640927838 /nfs/dbraw/zinc/92/78/38/640927838.db2.gz FLAWWPAAHGAPIJ-DUMNWFOQSA-N 1 1 243.803 3.754 20 0 BHADMO CCc1ccccc1Cn1cc[nH+]c1C(C)C ZINC000188231835 386325850 /nfs/dbraw/zinc/32/58/50/386325850.db2.gz GIPLKOYMAQDQKO-UHFFFAOYSA-N 1 1 228.339 3.617 20 0 BHADMO Cc1ccc([C@@H](C)[N@@H+](C)CC[C@@H]2CCCO2)cc1 ZINC000188753233 358670570 /nfs/dbraw/zinc/67/05/70/358670570.db2.gz NJKHJDWBPRNJPW-ZBFHGGJFSA-N 1 1 247.382 3.557 20 0 BHADMO Cc1ccc([C@H](C)[N@@H+](C)CC[C@@H]2CCCO2)cc1 ZINC000188753253 358670702 /nfs/dbraw/zinc/67/07/02/358670702.db2.gz NJKHJDWBPRNJPW-HOCLYGCPSA-N 1 1 247.382 3.557 20 0 BHADMO Cc1[nH+]cn(C/C=C/c2ccc(Cl)cc2)c1C ZINC000189106829 388622388 /nfs/dbraw/zinc/62/23/88/388622388.db2.gz LQMZJEVYCNPNFR-ONEGZZNKSA-N 1 1 246.741 3.867 20 0 BHADMO Cc1[nH+]ccn1C/C=C/c1ccc(Cl)cc1 ZINC000189114264 259384102 /nfs/dbraw/zinc/38/41/02/259384102.db2.gz AGJVMUIHEWSZEM-NSCUHMNNSA-N 1 1 232.714 3.558 20 0 BHADMO CCc1[nH+]ccn1C/C=C/c1ccc(Cl)cc1 ZINC000189114831 398097660 /nfs/dbraw/zinc/09/76/60/398097660.db2.gz NTNCHCDKHZMVFX-ONEGZZNKSA-N 1 1 246.741 3.812 20 0 BHADMO CCc1cccc(Cn2cc[nH+]c2C(C)C)c1 ZINC000189115194 398097619 /nfs/dbraw/zinc/09/76/19/398097619.db2.gz JSANLDIORPDWFS-UHFFFAOYSA-N 1 1 228.339 3.617 20 0 BHADMO Cc1cc[nH+]c(N[C@@H]2CCC23CCCC3)c1 ZINC000189190075 385134608 /nfs/dbraw/zinc/13/46/08/385134608.db2.gz XJRRFCYYDIAMMD-GFCCVEGCSA-N 1 1 216.328 3.525 20 0 BHADMO Cc1cc[nH+]c(N[C@H]2CCC23CCCC3)c1 ZINC000189190098 385949302 /nfs/dbraw/zinc/94/93/02/385949302.db2.gz XJRRFCYYDIAMMD-LBPRGKRZSA-N 1 1 216.328 3.525 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@@H]2CCCC[C@@H]2C)c(C)n1 ZINC000189252813 205859393 /nfs/dbraw/zinc/85/93/93/205859393.db2.gz ANQANWWLHKQDHY-BLLLJJGKSA-N 1 1 246.398 3.709 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@H]2CCCC[C@@H]2C)c(C)n1 ZINC000189252837 385974742 /nfs/dbraw/zinc/97/47/42/385974742.db2.gz ANQANWWLHKQDHY-LRDDRELGSA-N 1 1 246.398 3.709 20 0 BHADMO CC[N@@H+](CCc1cccnc1)[C@@H]1CCCC[C@@H]1C ZINC000189255135 357626730 /nfs/dbraw/zinc/62/67/30/357626730.db2.gz MGAMUFUZUAMJII-GOEBONIOSA-N 1 1 246.398 3.525 20 0 BHADMO CC[N@@H+](CCc1cccnc1)[C@H]1CCCC[C@@H]1C ZINC000189255160 357626674 /nfs/dbraw/zinc/62/66/74/357626674.db2.gz MGAMUFUZUAMJII-HOCLYGCPSA-N 1 1 246.398 3.525 20 0 BHADMO CC[C@@H]1CCCC[C@@H]1[N@@H+](C)CCc1cccnc1 ZINC000189260558 324193013 /nfs/dbraw/zinc/19/30/13/324193013.db2.gz SXXBWXLETVARTC-CVEARBPZSA-N 1 1 246.398 3.525 20 0 BHADMO CC[C@H]1CCCC[C@@H]1[N@@H+](C)CCc1cccnc1 ZINC000189260574 324193249 /nfs/dbraw/zinc/19/32/49/324193249.db2.gz SXXBWXLETVARTC-HOTGVXAUSA-N 1 1 246.398 3.525 20 0 BHADMO CC[C@@H]1CCCC[C@H]1[N@@H+](C)CCc1cccnc1 ZINC000189260595 324193512 /nfs/dbraw/zinc/19/35/12/324193512.db2.gz SXXBWXLETVARTC-HZPDHXFCSA-N 1 1 246.398 3.525 20 0 BHADMO CC[C@H]1CCCC[C@H]1[N@@H+](C)CCc1cccnc1 ZINC000189260610 324193279 /nfs/dbraw/zinc/19/32/79/324193279.db2.gz SXXBWXLETVARTC-JKSUJKDBSA-N 1 1 246.398 3.525 20 0 BHADMO CCCCC[N@@H+](Cc1ccc(F)nc1)C(C)C ZINC000189298207 643157485 /nfs/dbraw/zinc/15/74/85/643157485.db2.gz ZBXMYLYCRZBLST-UHFFFAOYSA-N 1 1 238.350 3.621 20 0 BHADMO CCCC[N@@H+](C)Cc1ccc2nc(C)ccc2c1 ZINC000189528158 386022056 /nfs/dbraw/zinc/02/20/56/386022056.db2.gz WYJAVZRAHQCFLL-UHFFFAOYSA-N 1 1 242.366 3.775 20 0 BHADMO CC(C)[N@@H+](C)CCCCCOc1ccccc1 ZINC000189531211 386022409 /nfs/dbraw/zinc/02/24/09/386022409.db2.gz YKYILFSLEWEKTO-UHFFFAOYSA-N 1 1 235.371 3.576 20 0 BHADMO CC[N@@H+](Cc1ccc2nc(C)ccc2c1)C(C)C ZINC000189627128 386037319 /nfs/dbraw/zinc/03/73/19/386037319.db2.gz AEYCVQZMOANNPW-UHFFFAOYSA-N 1 1 242.366 3.774 20 0 BHADMO CC(C)[N@@H+](CC[C@@H]1CCCO1)C1CCCCC1 ZINC000189642527 388640506 /nfs/dbraw/zinc/64/05/06/388640506.db2.gz FZTMJGFREXHLFF-HNNXBMFYSA-N 1 1 239.403 3.599 20 0 BHADMO CC(C)[N@@H+](CC[C@H]1CCCO1)C1CCCCC1 ZINC000189642547 388640759 /nfs/dbraw/zinc/64/07/59/388640759.db2.gz FZTMJGFREXHLFF-OAHLLOKOSA-N 1 1 239.403 3.599 20 0 BHADMO CC[N@@H+](Cc1ccc2nc(C)ccc2c1)C1CC1 ZINC000189656378 347307127 /nfs/dbraw/zinc/30/71/27/347307127.db2.gz PJCRTTPRWGNUNE-UHFFFAOYSA-N 1 1 240.350 3.528 20 0 BHADMO C[C@@H](C[N@@H+](C)C1CC1)c1cccc(Cl)c1 ZINC000189664111 347253377 /nfs/dbraw/zinc/25/33/77/347253377.db2.gz UNBHKBLJSDNNKH-JTQLQIEISA-N 1 1 223.747 3.538 20 0 BHADMO C[C@H](C[N@@H+](C)C1CC1)c1cccc(Cl)c1 ZINC000189664134 347252930 /nfs/dbraw/zinc/25/29/30/347252930.db2.gz UNBHKBLJSDNNKH-SNVBAGLBSA-N 1 1 223.747 3.538 20 0 BHADMO CC[C@@H](C)[N@@H+](C)Cc1ccc2nc(C)ccc2c1 ZINC000189668336 386060755 /nfs/dbraw/zinc/06/07/55/386060755.db2.gz SGGWXTOMDJUWJM-CYBMUJFWSA-N 1 1 242.366 3.774 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1ccc2nc(C)ccc2c1 ZINC000189668350 205874040 /nfs/dbraw/zinc/87/40/40/205874040.db2.gz SGGWXTOMDJUWJM-ZDUSSCGKSA-N 1 1 242.366 3.774 20 0 BHADMO C[N@@H+](CCCCCOc1ccccc1)CC1CC1 ZINC000189753828 386071143 /nfs/dbraw/zinc/07/11/43/386071143.db2.gz GLVSRISNYKSRNA-UHFFFAOYSA-N 1 1 247.382 3.578 20 0 BHADMO Cc1cncc(C[N@H+](C)C2CCCCCC2)c1 ZINC000189756463 386069084 /nfs/dbraw/zinc/06/90/84/386069084.db2.gz JWAKEEGIPGMEGU-UHFFFAOYSA-N 1 1 232.371 3.545 20 0 BHADMO Cc1nc([C@@H]2CCC[N@H+]2[C@H]2C=CCCC2)cs1 ZINC000189759079 180044405 /nfs/dbraw/zinc/04/44/05/180044405.db2.gz PCDVUENTALUAMY-JSGCOSHPSA-N 1 1 248.395 3.697 20 0 BHADMO Cc1nc([C@H]2CCC[N@H+]2[C@H]2C=CCCC2)cs1 ZINC000189759094 180056957 /nfs/dbraw/zinc/05/69/57/180056957.db2.gz PCDVUENTALUAMY-GXTWGEPZSA-N 1 1 248.395 3.697 20 0 BHADMO Cc1cncc(C[N@H+](C)[C@@H](C)c2ccccc2)c1 ZINC000189761874 385184088 /nfs/dbraw/zinc/18/40/88/385184088.db2.gz ITLDVTABSMTJIM-AWEZNQCLSA-N 1 1 240.350 3.583 20 0 BHADMO Cc1cncc(C[N@H+](C)[C@H](C)c2ccccc2)c1 ZINC000189761893 385182864 /nfs/dbraw/zinc/18/28/64/385182864.db2.gz ITLDVTABSMTJIM-CQSZACIVSA-N 1 1 240.350 3.583 20 0 BHADMO Cc1cncc(C[N@H+]2CCC[C@H]3CCCC[C@@H]32)c1 ZINC000189763185 386104999 /nfs/dbraw/zinc/10/49/99/386104999.db2.gz FLECTBQCWRLSDO-CVEARBPZSA-N 1 1 244.382 3.545 20 0 BHADMO Cc1cncc(C[N@H+]2CCC[C@@H]3CCCC[C@@H]32)c1 ZINC000189763201 386104478 /nfs/dbraw/zinc/10/44/78/386104478.db2.gz FLECTBQCWRLSDO-HOTGVXAUSA-N 1 1 244.382 3.545 20 0 BHADMO Cc1nc([C@@H]2CCC[N@@H+]2CCC(C)C)cs1 ZINC000189764893 357668147 /nfs/dbraw/zinc/66/81/47/357668147.db2.gz PHAGNRKRRYOJSY-ZDUSSCGKSA-N 1 1 238.400 3.635 20 0 BHADMO Cc1nc([C@H]2CCC[N@@H+]2CCC(C)C)cs1 ZINC000189764909 357668139 /nfs/dbraw/zinc/66/81/39/357668139.db2.gz PHAGNRKRRYOJSY-CYBMUJFWSA-N 1 1 238.400 3.635 20 0 BHADMO CCCCC[N@@H+](Cc1cncc(C)c1)C(C)C ZINC000189782409 386087522 /nfs/dbraw/zinc/08/75/22/386087522.db2.gz VJAGZUUKYVKKOP-UHFFFAOYSA-N 1 1 234.387 3.791 20 0 BHADMO CC[N@@H+](Cc1cncc(C)c1)C1CCCCC1 ZINC000189786556 386086944 /nfs/dbraw/zinc/08/69/44/386086944.db2.gz VBDNYNOHGJSRTI-UHFFFAOYSA-N 1 1 232.371 3.545 20 0 BHADMO Cc1cncc(C[N@H+](C)[C@@H](C)c2cccs2)c1 ZINC000189791015 386087680 /nfs/dbraw/zinc/08/76/80/386087680.db2.gz NGJZZHNFHKCXJC-LBPRGKRZSA-N 1 1 246.379 3.645 20 0 BHADMO Cc1cncc(C[N@H+](C)[C@H](C)c2cccs2)c1 ZINC000189791034 386088877 /nfs/dbraw/zinc/08/88/77/386088877.db2.gz NGJZZHNFHKCXJC-GFCCVEGCSA-N 1 1 246.379 3.645 20 0 BHADMO CC(C)=CC[N@H+]1CCC[C@H]1c1csc(C)n1 ZINC000189802835 188349554 /nfs/dbraw/zinc/34/95/54/188349554.db2.gz ARXLJEXMNPMZFT-ZDUSSCGKSA-N 1 1 236.384 3.555 20 0 BHADMO CC(C)=CC[N@@H+]1CCC[C@H]1c1csc(C)n1 ZINC000189802835 188349551 /nfs/dbraw/zinc/34/95/51/188349551.db2.gz ARXLJEXMNPMZFT-ZDUSSCGKSA-N 1 1 236.384 3.555 20 0 BHADMO CC(C)=CC[N@H+]1CCC[C@@H]1c1csc(C)n1 ZINC000189802859 385188492 /nfs/dbraw/zinc/18/84/92/385188492.db2.gz ARXLJEXMNPMZFT-CYBMUJFWSA-N 1 1 236.384 3.555 20 0 BHADMO CC(C)=CC[N@@H+]1CCC[C@@H]1c1csc(C)n1 ZINC000189802859 385188488 /nfs/dbraw/zinc/18/84/88/385188488.db2.gz ARXLJEXMNPMZFT-CYBMUJFWSA-N 1 1 236.384 3.555 20 0 BHADMO Cc1cncc(C[N@H+]2CCC[C@@H]2C2CCCC2)c1 ZINC000189803153 386091554 /nfs/dbraw/zinc/09/15/54/386091554.db2.gz KRYXJIVAEWZCLV-MRXNPFEDSA-N 1 1 244.382 3.545 20 0 BHADMO Cc1cncc(C[N@H+]2CCC[C@H]2C2CCCC2)c1 ZINC000189803173 386091389 /nfs/dbraw/zinc/09/13/89/386091389.db2.gz KRYXJIVAEWZCLV-INIZCTEOSA-N 1 1 244.382 3.545 20 0 BHADMO CC[C@@H](C)C[N@H+]1CCC[C@@H]1c1csc(C)n1 ZINC000189808329 357672220 /nfs/dbraw/zinc/67/22/20/357672220.db2.gz GBYYECZWNGSNND-ZWNOBZJWSA-N 1 1 238.400 3.635 20 0 BHADMO CC[C@H](C)C[N@H+]1CCC[C@@H]1c1csc(C)n1 ZINC000189808348 357672155 /nfs/dbraw/zinc/67/21/55/357672155.db2.gz GBYYECZWNGSNND-GXFFZTMASA-N 1 1 238.400 3.635 20 0 BHADMO Cc1nc([C@@H]2CCC[N@H+]2C2CCCC2)cs1 ZINC000189837687 357673546 /nfs/dbraw/zinc/67/35/46/357673546.db2.gz UYPWMCUFBFGYTP-ZDUSSCGKSA-N 1 1 236.384 3.531 20 0 BHADMO Cc1nc([C@H]2CCC[N@H+]2C2CCCC2)cs1 ZINC000189837704 347311880 /nfs/dbraw/zinc/31/18/80/347311880.db2.gz UYPWMCUFBFGYTP-CYBMUJFWSA-N 1 1 236.384 3.531 20 0 BHADMO CC[C@@H](C)[C@@H](C)[N@@H+](Cc1cncc(C)c1)C1CC1 ZINC000189870560 386109728 /nfs/dbraw/zinc/10/97/28/386109728.db2.gz ZLFWUIPFLYFGBJ-ZIAGYGMSSA-N 1 1 246.398 3.789 20 0 BHADMO CC[C@H](C)[C@@H](C)[N@@H+](Cc1cncc(C)c1)C1CC1 ZINC000189870577 386110179 /nfs/dbraw/zinc/11/01/79/386110179.db2.gz ZLFWUIPFLYFGBJ-UONOGXRCSA-N 1 1 246.398 3.789 20 0 BHADMO CC[C@@H](C)[C@H](C)[N@@H+](Cc1cncc(C)c1)C1CC1 ZINC000189870598 386109429 /nfs/dbraw/zinc/10/94/29/386109429.db2.gz ZLFWUIPFLYFGBJ-KGLIPLIRSA-N 1 1 246.398 3.789 20 0 BHADMO CC[C@H](C)[C@H](C)[N@@H+](Cc1cncc(C)c1)C1CC1 ZINC000189870615 386109950 /nfs/dbraw/zinc/10/99/50/386109950.db2.gz ZLFWUIPFLYFGBJ-KBPBESRZSA-N 1 1 246.398 3.789 20 0 BHADMO CC[C@@H]1CCCCC[N@H+]1Cc1cncc(C)c1 ZINC000189897604 386115213 /nfs/dbraw/zinc/11/52/13/386115213.db2.gz RWUIEJZSWCKZNU-OAHLLOKOSA-N 1 1 232.371 3.545 20 0 BHADMO CC[C@H]1CCCCC[N@H+]1Cc1cncc(C)c1 ZINC000189897624 386115878 /nfs/dbraw/zinc/11/58/78/386115878.db2.gz RWUIEJZSWCKZNU-HNNXBMFYSA-N 1 1 232.371 3.545 20 0 BHADMO Cc1cncc(C[N@H+]2CCC3(C2)CCCCC3)c1 ZINC000189900756 386114402 /nfs/dbraw/zinc/11/44/02/386114402.db2.gz UZOHGCGGPHLQOF-UHFFFAOYSA-N 1 1 244.382 3.546 20 0 BHADMO Cc1cncc(C[N@H+]2[C@H](C)C[C@H]3CCCC[C@@H]32)c1 ZINC000189901408 386115871 /nfs/dbraw/zinc/11/58/71/386115871.db2.gz MFSCSJNAEHTPGJ-BMFZPTHFSA-N 1 1 244.382 3.543 20 0 BHADMO Cc1nc([C@@H]2CCC[N@H+]2CC(C)(C)C)cs1 ZINC000189919973 357676670 /nfs/dbraw/zinc/67/66/70/357676670.db2.gz LPGGNWXJWMJCCE-LBPRGKRZSA-N 1 1 238.400 3.635 20 0 BHADMO Cc1nc([C@H]2CCC[N@H+]2CC(C)(C)C)cs1 ZINC000189919991 357676716 /nfs/dbraw/zinc/67/67/16/357676716.db2.gz LPGGNWXJWMJCCE-GFCCVEGCSA-N 1 1 238.400 3.635 20 0 BHADMO CCc1cccc(C[NH2+][C@@H](C)c2nccs2)c1 ZINC000189944325 386125694 /nfs/dbraw/zinc/12/56/94/386125694.db2.gz BEEGSMNHARIIHM-NSHDSACASA-N 1 1 246.379 3.556 20 0 BHADMO CCc1cccc(C[NH2+][C@H](C)c2nccs2)c1 ZINC000189944345 538986457 /nfs/dbraw/zinc/98/64/57/538986457.db2.gz BEEGSMNHARIIHM-LLVKDONJSA-N 1 1 246.379 3.556 20 0 BHADMO Cc1cncc(C[N@H+](C(C)C)C2CCCCC2)c1 ZINC000189947883 386125003 /nfs/dbraw/zinc/12/50/03/386125003.db2.gz TVXOOJIEZXLDHJ-UHFFFAOYSA-N 1 1 246.398 3.933 20 0 BHADMO Cc1cncc(C[N@H+](C(C)C)C2CCCC2)c1 ZINC000189949154 385199601 /nfs/dbraw/zinc/19/96/01/385199601.db2.gz WBCYHVOOEDKNIW-UHFFFAOYSA-N 1 1 232.371 3.543 20 0 BHADMO CCC(C)(C)[C@@H]1CCC[N@H+]1Cc1cncc(C)c1 ZINC000189968873 205884650 /nfs/dbraw/zinc/88/46/50/205884650.db2.gz JZOKKQUKGYZJEV-HNNXBMFYSA-N 1 1 246.398 3.791 20 0 BHADMO CCC(C)(C)[C@H]1CCC[N@H+]1Cc1cncc(C)c1 ZINC000189968888 386128091 /nfs/dbraw/zinc/12/80/91/386128091.db2.gz JZOKKQUKGYZJEV-OAHLLOKOSA-N 1 1 246.398 3.791 20 0 BHADMO CCC[C@@H]1CCCC[N@H+]1Cc1cncc(C)c1 ZINC000190027361 386143470 /nfs/dbraw/zinc/14/34/70/386143470.db2.gz QQCDMQVNYLYVQW-OAHLLOKOSA-N 1 1 232.371 3.545 20 0 BHADMO CCC[C@H]1CCCC[N@H+]1Cc1cncc(C)c1 ZINC000190027381 386144199 /nfs/dbraw/zinc/14/41/99/386144199.db2.gz QQCDMQVNYLYVQW-HNNXBMFYSA-N 1 1 232.371 3.545 20 0 BHADMO CC1(C)C[N@H+](C2CCCC2)CC[C@@H]1C(F)(F)F ZINC000190161751 538987681 /nfs/dbraw/zinc/98/76/81/538987681.db2.gz LWQGCXOBEFWEJS-NSHDSACASA-N 1 1 249.320 3.839 20 0 BHADMO CC1(C)C[N@H+](C2CCCC2)CC[C@H]1C(F)(F)F ZINC000190161774 538987482 /nfs/dbraw/zinc/98/74/82/538987482.db2.gz LWQGCXOBEFWEJS-LLVKDONJSA-N 1 1 249.320 3.839 20 0 BHADMO CCC(=O)CC[N@@H+](Cc1ccccc1)[C@@H](C)CC ZINC000190179625 641846734 /nfs/dbraw/zinc/84/67/34/641846734.db2.gz VXAQXXMUILXSFF-AWEZNQCLSA-N 1 1 247.382 3.656 20 0 BHADMO CC1(C)C[N@@H+](CC2CCC2)CC[C@@H]1C(F)(F)F ZINC000190188486 388648163 /nfs/dbraw/zinc/64/81/63/388648163.db2.gz WZWVJGDPHIQPNJ-NSHDSACASA-N 1 1 249.320 3.697 20 0 BHADMO CC1(C)C[N@@H+](CC2CCC2)CC[C@H]1C(F)(F)F ZINC000190188504 259563308 /nfs/dbraw/zinc/56/33/08/259563308.db2.gz WZWVJGDPHIQPNJ-LLVKDONJSA-N 1 1 249.320 3.697 20 0 BHADMO CCC(=O)CC[N@H+]1CCC[C@@H]1c1ccccc1C ZINC000190193690 168202614 /nfs/dbraw/zinc/20/26/14/168202614.db2.gz NTDFMNFTZKCPNS-MRXNPFEDSA-N 1 1 245.366 3.501 20 0 BHADMO CCC(=O)CC[N@H+]1CCC[C@H]1c1ccccc1C ZINC000190193710 168203503 /nfs/dbraw/zinc/20/35/03/168203503.db2.gz NTDFMNFTZKCPNS-INIZCTEOSA-N 1 1 245.366 3.501 20 0 BHADMO CCC(=O)CC[N@H+]1CCC[C@@H]1c1cccc(C)c1 ZINC000190196263 168203117 /nfs/dbraw/zinc/20/31/17/168203117.db2.gz JQUPLVBIECVETF-MRXNPFEDSA-N 1 1 245.366 3.501 20 0 BHADMO CCC(=O)CC[N@H+]1CCC[C@H]1c1cccc(C)c1 ZINC000190196283 168203350 /nfs/dbraw/zinc/20/33/50/168203350.db2.gz JQUPLVBIECVETF-INIZCTEOSA-N 1 1 245.366 3.501 20 0 BHADMO CCC(=O)CC[N@@H+](C)[C@H](c1ccccc1)C(C)C ZINC000190231215 641852945 /nfs/dbraw/zinc/85/29/45/641852945.db2.gz NUWPHISTRKEHBA-INIZCTEOSA-N 1 1 247.382 3.685 20 0 BHADMO CCC(=O)CC[N@H+]1CCCCC[C@@H]1c1ccco1 ZINC000190240962 168202045 /nfs/dbraw/zinc/20/20/45/168202045.db2.gz PEIMWWOETVJWBK-CQSZACIVSA-N 1 1 249.354 3.566 20 0 BHADMO CCC(=O)CC[N@H+]1CCCCC[C@H]1c1ccco1 ZINC000190240986 168203875 /nfs/dbraw/zinc/20/38/75/168203875.db2.gz PEIMWWOETVJWBK-AWEZNQCLSA-N 1 1 249.354 3.566 20 0 BHADMO CCCCCCC(=O)Cn1cc[nH+]c1C(C)C ZINC000190244553 188172419 /nfs/dbraw/zinc/17/24/19/188172419.db2.gz NSJLUNAEKVCJQC-UHFFFAOYSA-N 1 1 236.359 3.546 20 0 BHADMO c1cc(C[N@H+]2CCCC3(CCCCC3)CC2)no1 ZINC000190322813 357700190 /nfs/dbraw/zinc/70/01/90/357700190.db2.gz NPOVIQHRNOHMQL-UHFFFAOYSA-N 1 1 248.370 3.611 20 0 BHADMO Cc1ccc([C@@H](C)[N@@H+](C)C[C@@H]2CC[C@H](C)O2)cc1 ZINC000190390030 357705212 /nfs/dbraw/zinc/70/52/12/357705212.db2.gz CXZRXRJNOUXPTP-LZWOXQAQSA-N 1 1 247.382 3.555 20 0 BHADMO Cc1ccc([C@H](C)[N@@H+](C)C[C@@H]2CC[C@H](C)O2)cc1 ZINC000190390043 357705199 /nfs/dbraw/zinc/70/51/99/357705199.db2.gz CXZRXRJNOUXPTP-DZKIICNBSA-N 1 1 247.382 3.555 20 0 BHADMO CC[N@H+](Cc1c[nH]c2ccccc12)CC(C)C ZINC000190470145 386181719 /nfs/dbraw/zinc/18/17/19/386181719.db2.gz OARNSRPVELUVAX-UHFFFAOYSA-N 1 1 230.355 3.646 20 0 BHADMO CC[N@@H+](Cc1c[nH]c2ccccc12)C1CCCC1 ZINC000190497460 356445946 /nfs/dbraw/zinc/44/59/46/356445946.db2.gz RBBISXZEAGSKQV-UHFFFAOYSA-N 1 1 242.366 3.932 20 0 BHADMO C[C@@H]1CC[N@@H+](C/C=C/c2ccccc2)CCS1 ZINC000190685873 386546525 /nfs/dbraw/zinc/54/65/25/386546525.db2.gz AEMLITQYVWGIEZ-LHRNQBEKSA-N 1 1 247.407 3.527 20 0 BHADMO C[C@H]1CC[N@@H+](C/C=C/c2ccccc2)CCS1 ZINC000190685893 386547156 /nfs/dbraw/zinc/54/71/56/386547156.db2.gz AEMLITQYVWGIEZ-GPAKFWEMSA-N 1 1 247.407 3.527 20 0 BHADMO Cc1cc(C(F)(F)F)ccc1C[N@H+](C)C1CC1 ZINC000191049035 323184723 /nfs/dbraw/zinc/18/47/23/323184723.db2.gz NPZJZPFMSKZQHC-UHFFFAOYSA-N 1 1 243.272 3.608 20 0 BHADMO C[C@H]([NH2+]Cc1ccco1)c1csc(Cl)c1 ZINC000191108189 176879763 /nfs/dbraw/zinc/87/97/63/176879763.db2.gz XMJFQWRPGWVCJQ-QMMMGPOBSA-N 1 1 241.743 3.845 20 0 BHADMO C[C@@H]([NH2+]Cc1ccco1)c1csc(Cl)c1 ZINC000191108207 386754270 /nfs/dbraw/zinc/75/42/70/386754270.db2.gz XMJFQWRPGWVCJQ-MRVPVSSYSA-N 1 1 241.743 3.845 20 0 BHADMO CCCC(CCC)SC[C@@H]1CC[N@@H+](C)C1 ZINC000191112227 388660529 /nfs/dbraw/zinc/66/05/29/388660529.db2.gz JZDVFJHIYIOJHC-GFCCVEGCSA-N 1 1 229.433 3.640 20 0 BHADMO CCCC(CCC)SC[C@H]1CC[N@@H+](C)C1 ZINC000191112239 388660607 /nfs/dbraw/zinc/66/06/07/388660607.db2.gz JZDVFJHIYIOJHC-LBPRGKRZSA-N 1 1 229.433 3.640 20 0 BHADMO CC1=CCC[C@@H](C)[C@H]1C[N@@H+](C)Cc1ccncc1 ZINC000191114237 386752949 /nfs/dbraw/zinc/75/29/49/386752949.db2.gz WXRDMJJILQOYHP-ZBFHGGJFSA-N 1 1 244.382 3.506 20 0 BHADMO CC1=CCC[C@H](C)[C@H]1C[N@@H+](C)Cc1ccncc1 ZINC000191114253 386752455 /nfs/dbraw/zinc/75/24/55/386752455.db2.gz WXRDMJJILQOYHP-HOCLYGCPSA-N 1 1 244.382 3.506 20 0 BHADMO CC1=CCC[C@@H](C)[C@@H]1C[N@@H+](C)Cc1ccncc1 ZINC000191114270 386753592 /nfs/dbraw/zinc/75/35/92/386753592.db2.gz WXRDMJJILQOYHP-GDBMZVCRSA-N 1 1 244.382 3.506 20 0 BHADMO CC1=CCC[C@H](C)[C@@H]1C[N@@H+](C)Cc1ccncc1 ZINC000191114282 386753488 /nfs/dbraw/zinc/75/34/88/386753488.db2.gz WXRDMJJILQOYHP-GOEBONIOSA-N 1 1 244.382 3.506 20 0 BHADMO CC[C@H](SC[C@@H]1CC[N@@H+](C)C1)c1ccccc1 ZINC000191190344 398102071 /nfs/dbraw/zinc/10/20/71/398102071.db2.gz VHWMYMVQFIYHIR-HIFRSBDPSA-N 1 1 249.423 3.823 20 0 BHADMO CC[C@@H](SC[C@@H]1CC[N@@H+](C)C1)c1ccccc1 ZINC000191190362 398101629 /nfs/dbraw/zinc/10/16/29/398101629.db2.gz VHWMYMVQFIYHIR-UKRRQHHQSA-N 1 1 249.423 3.823 20 0 BHADMO CC[C@H](SC[C@H]1CC[N@@H+](C)C1)c1ccccc1 ZINC000191190379 398101859 /nfs/dbraw/zinc/10/18/59/398101859.db2.gz VHWMYMVQFIYHIR-ZFWWWQNUSA-N 1 1 249.423 3.823 20 0 BHADMO CC[C@@H](SC[C@H]1CC[N@@H+](C)C1)c1ccccc1 ZINC000191190396 398102188 /nfs/dbraw/zinc/10/21/88/398102188.db2.gz VHWMYMVQFIYHIR-DZGCQCFKSA-N 1 1 249.423 3.823 20 0 BHADMO C[C@H]([NH2+]Cc1ccoc1)c1csc(Cl)c1 ZINC000191198788 355344502 /nfs/dbraw/zinc/34/45/02/355344502.db2.gz HRLLBUUCRZZNNM-QMMMGPOBSA-N 1 1 241.743 3.845 20 0 BHADMO C[C@@H]([NH2+]Cc1ccoc1)c1csc(Cl)c1 ZINC000191198804 355344407 /nfs/dbraw/zinc/34/44/07/355344407.db2.gz HRLLBUUCRZZNNM-MRVPVSSYSA-N 1 1 241.743 3.845 20 0 BHADMO CCCC1CCC([N@@H+](C)CCCCOC)CC1 ZINC000191421386 388663041 /nfs/dbraw/zinc/66/30/41/388663041.db2.gz AIDLGGGCPPSEJJ-UHFFFAOYSA-N 1 1 241.419 3.704 20 0 BHADMO CC(C)C[N@H+]1CC[C@H](C(F)(F)F)C(C)(C)C1 ZINC000191663915 388667418 /nfs/dbraw/zinc/66/74/18/388667418.db2.gz SRSVPHIRZZNOTD-JTQLQIEISA-N 1 1 237.309 3.553 20 0 BHADMO CC(C)C[N@H+]1CC[C@@H](C(F)(F)F)C(C)(C)C1 ZINC000191663931 388666522 /nfs/dbraw/zinc/66/65/22/388666522.db2.gz SRSVPHIRZZNOTD-SNVBAGLBSA-N 1 1 237.309 3.553 20 0 BHADMO CCCC1CCC([N@H+](C)Cc2cn[nH]c2C)CC1 ZINC000191808079 357798134 /nfs/dbraw/zinc/79/81/34/357798134.db2.gz ZVXTWADPWYLSKN-UHFFFAOYSA-N 1 1 249.402 3.509 20 0 BHADMO CCCC1CCC([N@@H+](C)Cc2c[nH]nc2C)CC1 ZINC000191808079 357798131 /nfs/dbraw/zinc/79/81/31/357798131.db2.gz ZVXTWADPWYLSKN-UHFFFAOYSA-N 1 1 249.402 3.509 20 0 BHADMO C[C@@H]1CCSCC[N@H+]1C/C=C/c1ccccc1 ZINC000191819434 259579287 /nfs/dbraw/zinc/57/92/87/259579287.db2.gz QIBTXOXDZDEYSX-LHRNQBEKSA-N 1 1 247.407 3.527 20 0 BHADMO CC(C)c1cccc2c1CC[N@@H+](CCCF)C2 ZINC000191892121 357802093 /nfs/dbraw/zinc/80/20/93/357802093.db2.gz UDTBKOMHGUSZCQ-UHFFFAOYSA-N 1 1 235.346 3.528 20 0 BHADMO CCC1CCC([N@@H+](Cc2cocn2)C2CC2)CC1 ZINC000191926341 386717949 /nfs/dbraw/zinc/71/79/49/386717949.db2.gz VKLFSBUOIRLMPI-UHFFFAOYSA-N 1 1 248.370 3.608 20 0 BHADMO CCC(CC)(CC)SC[C@@H]1CC[N@@H+](C)C1 ZINC000191931938 641950586 /nfs/dbraw/zinc/95/05/86/641950586.db2.gz WKJMILFELPSJKM-GFCCVEGCSA-N 1 1 229.433 3.640 20 0 BHADMO CCC(CC)(CC)SC[C@H]1CC[N@@H+](C)C1 ZINC000191931944 641951686 /nfs/dbraw/zinc/95/16/86/641951686.db2.gz WKJMILFELPSJKM-LBPRGKRZSA-N 1 1 229.433 3.640 20 0 BHADMO CCCCC[N@@H+](Cc1cocn1)[C@@H](C)CCC ZINC000191937185 386723751 /nfs/dbraw/zinc/72/37/51/386723751.db2.gz JGZQHCYYLFEXJK-ZDUSSCGKSA-N 1 1 238.375 3.855 20 0 BHADMO CCCCC[N@@H+](Cc1cocn1)[C@H](C)CCC ZINC000191937195 386724012 /nfs/dbraw/zinc/72/40/12/386724012.db2.gz JGZQHCYYLFEXJK-CYBMUJFWSA-N 1 1 238.375 3.855 20 0 BHADMO c1nc(C[N@@H+]2CCC[C@@H]2CC2CCCCC2)co1 ZINC000191937666 386724522 /nfs/dbraw/zinc/72/45/22/386724522.db2.gz BVMUQPVUZSKASS-OAHLLOKOSA-N 1 1 248.370 3.609 20 0 BHADMO c1nc(C[N@@H+]2CCC[C@H]2CC2CCCCC2)co1 ZINC000191937675 386722350 /nfs/dbraw/zinc/72/23/50/386722350.db2.gz BVMUQPVUZSKASS-HNNXBMFYSA-N 1 1 248.370 3.609 20 0 BHADMO CC(C)[C@@H](c1ccccc1)[N@@H+](C)Cc1cocn1 ZINC000191942567 385334788 /nfs/dbraw/zinc/33/47/88/385334788.db2.gz YHXXBUGGBKWSDX-HNNXBMFYSA-N 1 1 244.338 3.504 20 0 BHADMO CC(C)[C@@H](c1ccccc1)[N@H+](C)Cc1cocn1 ZINC000191942567 385334780 /nfs/dbraw/zinc/33/47/80/385334780.db2.gz YHXXBUGGBKWSDX-HNNXBMFYSA-N 1 1 244.338 3.504 20 0 BHADMO CC(C)[C@H](c1ccccc1)[N@@H+](C)Cc1cocn1 ZINC000191942576 188350405 /nfs/dbraw/zinc/35/04/05/188350405.db2.gz YHXXBUGGBKWSDX-OAHLLOKOSA-N 1 1 244.338 3.504 20 0 BHADMO CC(C)[C@H](c1ccccc1)[N@H+](C)Cc1cocn1 ZINC000191942576 188350403 /nfs/dbraw/zinc/35/04/03/188350403.db2.gz YHXXBUGGBKWSDX-OAHLLOKOSA-N 1 1 244.338 3.504 20 0 BHADMO c1nc(C[N@H+]2CCCC3(C2)CCCCCC3)co1 ZINC000191947081 398310277 /nfs/dbraw/zinc/31/02/77/398310277.db2.gz DJLDWDRLBPGMMG-UHFFFAOYSA-N 1 1 248.370 3.611 20 0 BHADMO CCCCC[N@@H+](Cc1ncccn1)[C@@H](C)CCC ZINC000191981247 357818874 /nfs/dbraw/zinc/81/88/74/357818874.db2.gz KSCUIUSBIDPVOS-AWEZNQCLSA-N 1 1 249.402 3.657 20 0 BHADMO CCCCC[N@@H+](Cc1ncccn1)[C@H](C)CCC ZINC000191981254 357818786 /nfs/dbraw/zinc/81/87/86/357818786.db2.gz KSCUIUSBIDPVOS-CQSZACIVSA-N 1 1 249.402 3.657 20 0 BHADMO c1nc(C[N@H+]2CCCC3(CCCCC3)CC2)co1 ZINC000191994890 386729671 /nfs/dbraw/zinc/72/96/71/386729671.db2.gz GZMOGRHAXOWFAA-UHFFFAOYSA-N 1 1 248.370 3.611 20 0 BHADMO C[C@@H](c1ccccc1)[N@H+]1CCS[C@H](C)CC1 ZINC000192185925 259391021 /nfs/dbraw/zinc/39/10/21/259391021.db2.gz IZHVPENILFDEGT-OLZOCXBDSA-N 1 1 235.396 3.575 20 0 BHADMO C[C@@H](c1ccccc1)[N@H+]1CCS[C@@H](C)CC1 ZINC000192185929 388676184 /nfs/dbraw/zinc/67/61/84/388676184.db2.gz IZHVPENILFDEGT-STQMWFEESA-N 1 1 235.396 3.575 20 0 BHADMO C[C@H](C[N@H+]1CCS[C@H](C)CC1)c1ccccc1 ZINC000192190051 388677032 /nfs/dbraw/zinc/67/70/32/388677032.db2.gz WHEOKPDVQDACCB-ZIAGYGMSSA-N 1 1 249.423 3.618 20 0 BHADMO C[C@H](C[N@H+]1CCS[C@@H](C)CC1)c1ccccc1 ZINC000192190055 259583735 /nfs/dbraw/zinc/58/37/35/259583735.db2.gz WHEOKPDVQDACCB-KGLIPLIRSA-N 1 1 249.423 3.618 20 0 BHADMO CC(C)(C)[C@H]([NH2+]Cc1cocn1)c1ccccc1 ZINC000192285094 386753327 /nfs/dbraw/zinc/75/33/27/386753327.db2.gz GDEXIVHSFJYJMB-CQSZACIVSA-N 1 1 244.338 3.552 20 0 BHADMO CC(C)(C)[C@@H]([NH2+]Cc1cocn1)c1ccccc1 ZINC000192285097 386752989 /nfs/dbraw/zinc/75/29/89/386752989.db2.gz GDEXIVHSFJYJMB-AWEZNQCLSA-N 1 1 244.338 3.552 20 0 BHADMO C[N@@H+](Cc1cccs1)[C@@H]1CCc2ccccc21 ZINC000192609690 388680410 /nfs/dbraw/zinc/68/04/10/388680410.db2.gz KJHVHCJHEXDWQF-OAHLLOKOSA-N 1 1 243.375 3.867 20 0 BHADMO C[N@@H+](Cc1cccs1)[C@H]1CCc2ccccc21 ZINC000192609710 388680477 /nfs/dbraw/zinc/68/04/77/388680477.db2.gz KJHVHCJHEXDWQF-HNNXBMFYSA-N 1 1 243.375 3.867 20 0 BHADMO CC(C)[C@@H](C)[N@@H+](Cc1cccs1)C1CC1 ZINC000192659940 388681138 /nfs/dbraw/zinc/68/11/38/388681138.db2.gz OTZRVJSWEAMILH-LLVKDONJSA-N 1 1 223.385 3.757 20 0 BHADMO CC(C)[C@H](C)[N@@H+](Cc1cccs1)C1CC1 ZINC000192659952 259587945 /nfs/dbraw/zinc/58/79/45/259587945.db2.gz OTZRVJSWEAMILH-NSHDSACASA-N 1 1 223.385 3.757 20 0 BHADMO CSCC[N@@H+](C)[C@@H](C)c1cc2ccccc2o1 ZINC000192672030 365787720 /nfs/dbraw/zinc/78/77/20/365787720.db2.gz MDPSJSFJMOPATA-NSHDSACASA-N 1 1 249.379 3.789 20 0 BHADMO CSCC[N@@H+](C)[C@H](C)c1cc2ccccc2o1 ZINC000192672045 365787822 /nfs/dbraw/zinc/78/78/22/365787822.db2.gz MDPSJSFJMOPATA-LLVKDONJSA-N 1 1 249.379 3.789 20 0 BHADMO CSCC[N@@H+](C)[C@@H](C)c1ccc(Cl)cc1 ZINC000192676669 365789207 /nfs/dbraw/zinc/78/92/07/365789207.db2.gz STNQLAUVDXJAKN-JTQLQIEISA-N 1 1 243.803 3.696 20 0 BHADMO CSCC[N@@H+](C)[C@H](C)c1ccc(Cl)cc1 ZINC000192676679 365789697 /nfs/dbraw/zinc/78/96/97/365789697.db2.gz STNQLAUVDXJAKN-SNVBAGLBSA-N 1 1 243.803 3.696 20 0 BHADMO Cc1cc[nH+]c(NCc2cc(Cl)cs2)c1 ZINC000192746818 387530948 /nfs/dbraw/zinc/53/09/48/387530948.db2.gz NZWGDEGIOXOUKI-UHFFFAOYSA-N 1 1 238.743 3.717 20 0 BHADMO Cc1cc[nH+]c(NCc2sccc2Cl)c1 ZINC000192746838 387529579 /nfs/dbraw/zinc/52/95/79/387529579.db2.gz WCKLZHWAHVZJLK-UHFFFAOYSA-N 1 1 238.743 3.717 20 0 BHADMO Cc1ccc[nH+]c1NCc1cc(Cl)cs1 ZINC000192746894 387530823 /nfs/dbraw/zinc/53/08/23/387530823.db2.gz BXTJYUIFZMPLIO-UHFFFAOYSA-N 1 1 238.743 3.717 20 0 BHADMO Cc1ccc[nH+]c1NCc1sccc1Cl ZINC000192746913 387530942 /nfs/dbraw/zinc/53/09/42/387530942.db2.gz IRIVBOHHHHCMGK-UHFFFAOYSA-N 1 1 238.743 3.717 20 0 BHADMO Cc1cccc(NCc2cc(Cl)cs2)[nH+]1 ZINC000192747135 387529621 /nfs/dbraw/zinc/52/96/21/387529621.db2.gz VUOYFIXPIBCYPA-UHFFFAOYSA-N 1 1 238.743 3.717 20 0 BHADMO Cc1cccc(NCc2sccc2Cl)[nH+]1 ZINC000192747155 387530779 /nfs/dbraw/zinc/53/07/79/387530779.db2.gz QCNJOKFHNSBJJN-UHFFFAOYSA-N 1 1 238.743 3.717 20 0 BHADMO Cc1ccc(NCc2cc(Cl)cs2)[nH+]c1 ZINC000192747228 387530704 /nfs/dbraw/zinc/53/07/04/387530704.db2.gz NJLFRFBAMQLGEW-UHFFFAOYSA-N 1 1 238.743 3.717 20 0 BHADMO Cc1ccc(NCc2sccc2Cl)[nH+]c1 ZINC000192747249 387530046 /nfs/dbraw/zinc/53/00/46/387530046.db2.gz JWDAZFBRWXYLNI-UHFFFAOYSA-N 1 1 238.743 3.717 20 0 BHADMO c1coc(C[N@@H+](Cc2cccs2)C2CC2)c1 ZINC000192787669 324200081 /nfs/dbraw/zinc/20/00/81/324200081.db2.gz VPFYONABIGLTIW-UHFFFAOYSA-N 1 1 233.336 3.506 20 0 BHADMO CSc1ccc(C[N@@H+](C(C)C)C2CC2)cc1 ZINC000192794277 385372300 /nfs/dbraw/zinc/37/23/00/385372300.db2.gz ZEUZIHNHIAVPOB-UHFFFAOYSA-N 1 1 235.396 3.781 20 0 BHADMO CSc1ccc(C[N@@H+](C)[C@@H](C)C2CC2)cc1 ZINC000192834215 388686179 /nfs/dbraw/zinc/68/61/79/388686179.db2.gz WYLWNNLSVONBEL-NSHDSACASA-N 1 1 235.396 3.639 20 0 BHADMO CSc1ccc(C[N@@H+](C)[C@H](C)C2CC2)cc1 ZINC000192834228 347385316 /nfs/dbraw/zinc/38/53/16/347385316.db2.gz WYLWNNLSVONBEL-LLVKDONJSA-N 1 1 235.396 3.639 20 0 BHADMO CC[C@@H](C)[N@H+]1CC[C@H](C(F)(F)F)C(C)(C)C1 ZINC000192845797 388686977 /nfs/dbraw/zinc/68/69/77/388686977.db2.gz GEZOCPIBFQJYKG-ZJUUUORDSA-N 1 1 237.309 3.695 20 0 BHADMO CC[C@H](C)[N@H+]1CC[C@H](C(F)(F)F)C(C)(C)C1 ZINC000192845808 388687059 /nfs/dbraw/zinc/68/70/59/388687059.db2.gz GEZOCPIBFQJYKG-UWVGGRQHSA-N 1 1 237.309 3.695 20 0 BHADMO CCc1nc(C[N@@H+](CC(C)C)C(C)C)cs1 ZINC000192850691 347385600 /nfs/dbraw/zinc/38/56/00/347385600.db2.gz GMWILXLGXVKDBP-UHFFFAOYSA-N 1 1 240.416 3.572 20 0 BHADMO CC(C)C[N@@H+](Cc1cccs1)C(C)C ZINC000192850808 386680395 /nfs/dbraw/zinc/68/03/95/386680395.db2.gz GVXAVJTUELVUSA-UHFFFAOYSA-N 1 1 211.374 3.615 20 0 BHADMO C[N@@H+](Cc1ccc2ccccc2n1)C1CCCC1 ZINC000193120420 385384902 /nfs/dbraw/zinc/38/49/02/385384902.db2.gz NKUXGSTZEBKYGG-UHFFFAOYSA-N 1 1 240.350 3.609 20 0 BHADMO Cc1ccc(C[N@@H+](Cc2cccs2)C2CC2)o1 ZINC000193343631 367169016 /nfs/dbraw/zinc/16/90/16/367169016.db2.gz OCEDYGGNPRNNBA-UHFFFAOYSA-N 1 1 247.363 3.814 20 0 BHADMO C[N@H+](Cc1csc2ccccc12)CC1CC1 ZINC000193489163 388706544 /nfs/dbraw/zinc/70/65/44/388706544.db2.gz FLOJSVJKMDGIJO-UHFFFAOYSA-N 1 1 231.364 3.743 20 0 BHADMO CC(C)[N@H+](Cc1ccccc1)C[C@@H]1CCC=CO1 ZINC000193576441 644254400 /nfs/dbraw/zinc/25/44/00/644254400.db2.gz LYKNNDGLNBKCMK-INIZCTEOSA-N 1 1 245.366 3.590 20 0 BHADMO CC(C)[N@H+](Cc1ccccc1)C[C@H]1CCC=CO1 ZINC000193576456 644255218 /nfs/dbraw/zinc/25/52/18/644255218.db2.gz LYKNNDGLNBKCMK-MRXNPFEDSA-N 1 1 245.366 3.590 20 0 BHADMO CC(C)[N@@H+](C)CC[C@@H](C)c1ccccc1 ZINC000193596096 387797472 /nfs/dbraw/zinc/79/74/72/387797472.db2.gz BJQMYWPZCKXDAI-CYBMUJFWSA-N 1 1 205.345 3.520 20 0 BHADMO CC(C)[N@@H+](C)CC[C@H](C)c1ccccc1 ZINC000193596118 387797526 /nfs/dbraw/zinc/79/75/26/387797526.db2.gz BJQMYWPZCKXDAI-ZDUSSCGKSA-N 1 1 205.345 3.520 20 0 BHADMO C=Cn1cc(C[N@H+](C(C)C)C2CCCCC2)cn1 ZINC000193603479 387797245 /nfs/dbraw/zinc/79/72/45/387797245.db2.gz BLYQIVMYFHNRRM-UHFFFAOYSA-N 1 1 247.386 3.527 20 0 BHADMO c1csc([C@@H]2CCC[N@@H+]2C[C@@H]2CCC=CO2)c1 ZINC000193623724 385403830 /nfs/dbraw/zinc/40/38/30/385403830.db2.gz OMBJUYLPIYEDHE-STQMWFEESA-N 1 1 249.379 3.578 20 0 BHADMO c1csc([C@H]2CCC[N@@H+]2C[C@@H]2CCC=CO2)c1 ZINC000193623737 205700082 /nfs/dbraw/zinc/70/00/82/205700082.db2.gz OMBJUYLPIYEDHE-QWHCGFSZSA-N 1 1 249.379 3.578 20 0 BHADMO C[C@@H](c1ccc(F)cc1)[N@@H+](C)C[C@@H]1CCC=CO1 ZINC000193646900 176015193 /nfs/dbraw/zinc/01/51/93/176015193.db2.gz IHGFEFWLJRRSBX-WFASDCNBSA-N 1 1 249.329 3.511 20 0 BHADMO C[C@H](c1ccc(F)cc1)[N@@H+](C)C[C@@H]1CCC=CO1 ZINC000193646919 177034557 /nfs/dbraw/zinc/03/45/57/177034557.db2.gz IHGFEFWLJRRSBX-DOMZBBRYSA-N 1 1 249.329 3.511 20 0 BHADMO c1ccc([C@@H]2CCC[N@@H+]2C[C@@H]2CCC=CO2)cc1 ZINC000193654069 188004274 /nfs/dbraw/zinc/00/42/74/188004274.db2.gz SQMFKAKIGQOTHB-HOTGVXAUSA-N 1 1 243.350 3.516 20 0 BHADMO c1ccc([C@H]2CCC[N@@H+]2C[C@@H]2CCC=CO2)cc1 ZINC000193654087 385406564 /nfs/dbraw/zinc/40/65/64/385406564.db2.gz SQMFKAKIGQOTHB-JKSUJKDBSA-N 1 1 243.350 3.516 20 0 BHADMO CCC[N@@H+](C)CC[C@@H](C)c1ccccc1 ZINC000193673124 387801710 /nfs/dbraw/zinc/80/17/10/387801710.db2.gz UTJXTFUSVLINDV-CYBMUJFWSA-N 1 1 205.345 3.522 20 0 BHADMO CCC[N@@H+](C)CC[C@H](C)c1ccccc1 ZINC000193673145 387803138 /nfs/dbraw/zinc/80/31/38/387803138.db2.gz UTJXTFUSVLINDV-ZDUSSCGKSA-N 1 1 205.345 3.522 20 0 BHADMO C[C@@H](c1ccccc1F)[N@@H+](C)C[C@@H]1CCC=CO1 ZINC000193680784 176024533 /nfs/dbraw/zinc/02/45/33/176024533.db2.gz SFAACMPBRBNPQP-STQMWFEESA-N 1 1 249.329 3.511 20 0 BHADMO C[C@H](c1ccccc1F)[N@@H+](C)C[C@@H]1CCC=CO1 ZINC000193680796 177041982 /nfs/dbraw/zinc/04/19/82/177041982.db2.gz SFAACMPBRBNPQP-OLZOCXBDSA-N 1 1 249.329 3.511 20 0 BHADMO C[C@@H](CC[N@@H+](C)[C@@H]1CCSC1)c1ccccc1 ZINC000193686704 323366812 /nfs/dbraw/zinc/36/68/12/323366812.db2.gz CKCMQEPXTJLJHI-DZGCQCFKSA-N 1 1 249.423 3.618 20 0 BHADMO C[C@H](CC[N@@H+](C)[C@@H]1CCSC1)c1ccccc1 ZINC000193686726 323366797 /nfs/dbraw/zinc/36/67/97/323366797.db2.gz CKCMQEPXTJLJHI-UKRRQHHQSA-N 1 1 249.423 3.618 20 0 BHADMO Cc1ccc([C@@H](C)[N@@H+](C)C[C@@H]2CCC=CO2)cc1 ZINC000193687646 644273096 /nfs/dbraw/zinc/27/30/96/644273096.db2.gz PBOASEVTAFPFSG-ZBFHGGJFSA-N 1 1 245.366 3.681 20 0 BHADMO Cc1ccc([C@H](C)[N@@H+](C)C[C@@H]2CCC=CO2)cc1 ZINC000193687661 644273659 /nfs/dbraw/zinc/27/36/59/644273659.db2.gz PBOASEVTAFPFSG-HOCLYGCPSA-N 1 1 245.366 3.681 20 0 BHADMO C[C@@H](CC[N@@H+](C)CC1CC1)c1ccccc1 ZINC000193780397 385411768 /nfs/dbraw/zinc/41/17/68/385411768.db2.gz HEKWWVBXCSXJKA-ZDUSSCGKSA-N 1 1 217.356 3.522 20 0 BHADMO C[C@H](CC[N@@H+](C)CC1CC1)c1ccccc1 ZINC000193780414 323367523 /nfs/dbraw/zinc/36/75/23/323367523.db2.gz HEKWWVBXCSXJKA-CYBMUJFWSA-N 1 1 217.356 3.522 20 0 BHADMO C=Cn1cc(C[N@H+](C)C2CCCCCCC2)cn1 ZINC000193830669 644284146 /nfs/dbraw/zinc/28/41/46/644284146.db2.gz PUIPBNZTHVKQHX-UHFFFAOYSA-N 1 1 247.386 3.528 20 0 BHADMO CC(C)C[N@@H+](C)[C@@H](C)c1nc2ccccc2s1 ZINC000193843781 387806676 /nfs/dbraw/zinc/80/66/76/387806676.db2.gz IUHOFFVZPBPCOJ-NSHDSACASA-N 1 1 248.395 3.945 20 0 BHADMO CC(C)C[N@@H+](C)[C@H](C)c1nc2ccccc2s1 ZINC000193843798 387807520 /nfs/dbraw/zinc/80/75/20/387807520.db2.gz IUHOFFVZPBPCOJ-LLVKDONJSA-N 1 1 248.395 3.945 20 0 BHADMO CSCC[N@@H+](Cc1ccc(C)s1)C(C)C ZINC000193847766 367220702 /nfs/dbraw/zinc/22/07/02/367220702.db2.gz OZAWHZCIVLLGCF-UHFFFAOYSA-N 1 1 243.441 3.630 20 0 BHADMO C1=CC[C@@]2(CC1)CCC[N@H+](C[C@@H]1CCC=CO1)C2 ZINC000193966384 634298864 /nfs/dbraw/zinc/29/88/64/634298864.db2.gz UOUCQHYXPXMKFX-JKSUJKDBSA-N 1 1 247.382 3.501 20 0 BHADMO C1=CC[C@]2(CC1)CCC[N@H+](C[C@@H]1CCC=CO1)C2 ZINC000193966399 644289702 /nfs/dbraw/zinc/28/97/02/644289702.db2.gz UOUCQHYXPXMKFX-HOTGVXAUSA-N 1 1 247.382 3.501 20 0 BHADMO C[C@@H](CC[N@@H+](C)C1CCC1)c1ccccc1 ZINC000193974131 206000153 /nfs/dbraw/zinc/00/01/53/206000153.db2.gz PELQJLSEHLACLQ-ZDUSSCGKSA-N 1 1 217.356 3.665 20 0 BHADMO C[C@H](CC[N@@H+](C)C1CCC1)c1ccccc1 ZINC000193974150 206000497 /nfs/dbraw/zinc/00/04/97/206000497.db2.gz 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CCCC[N@@H+](C)Cc1sccc1Cl ZINC000194299846 206087060 /nfs/dbraw/zinc/08/70/60/206087060.db2.gz ISFSWHPXXDQFGD-UHFFFAOYSA-N 1 1 217.765 3.633 20 0 BHADMO CCCC[N@@H+](C)Cc1cc(Cl)cs1 ZINC000194299866 206088308 /nfs/dbraw/zinc/08/83/08/206088308.db2.gz ODQNPHDVKIDRPJ-UHFFFAOYSA-N 1 1 217.765 3.633 20 0 BHADMO C[N@@H+](Cc1ccco1)Cc1cc(Cl)cs1 ZINC000194309031 385429837 /nfs/dbraw/zinc/42/98/37/385429837.db2.gz NBGILHGNYHLVOW-UHFFFAOYSA-N 1 1 241.743 3.627 20 0 BHADMO C[N@H+](Cc1ccco1)Cc1cc(Cl)cs1 ZINC000194309031 385429835 /nfs/dbraw/zinc/42/98/35/385429835.db2.gz NBGILHGNYHLVOW-UHFFFAOYSA-N 1 1 241.743 3.627 20 0 BHADMO Cc1cccc(C[N@H+](C)[C@@H](C)c2cccnc2)c1 ZINC000194315932 367278859 /nfs/dbraw/zinc/27/88/59/367278859.db2.gz KBUPJYKCJFOPLI-AWEZNQCLSA-N 1 1 240.350 3.583 20 0 BHADMO Cc1cccc(C[N@H+](C)[C@H](C)c2cccnc2)c1 ZINC000194315949 367278262 /nfs/dbraw/zinc/27/82/62/367278262.db2.gz KBUPJYKCJFOPLI-CQSZACIVSA-N 1 1 240.350 3.583 20 0 BHADMO C[N@@H+](Cc1sccc1Cl)C1CCCC1 ZINC000194316960 367278072 /nfs/dbraw/zinc/27/80/72/367278072.db2.gz UOPDNONWTQJCTR-UHFFFAOYSA-N 1 1 229.776 3.776 20 0 BHADMO C[N@@H+](Cc1cc(Cl)cs1)C1CCCC1 ZINC000194316981 388728760 /nfs/dbraw/zinc/72/87/60/388728760.db2.gz VRNVFWRMGLNHBY-UHFFFAOYSA-N 1 1 229.776 3.776 20 0 BHADMO CC[N@@H+](Cc1sccc1Cl)C(C)C ZINC000194323010 206089190 /nfs/dbraw/zinc/08/91/90/206089190.db2.gz UVVQFNNQEADLMV-UHFFFAOYSA-N 1 1 217.765 3.632 20 0 BHADMO CC[N@@H+](Cc1cc(Cl)cs1)C(C)C ZINC000194323028 386583512 /nfs/dbraw/zinc/58/35/12/386583512.db2.gz MEXGMKTUEAQCTE-UHFFFAOYSA-N 1 1 217.765 3.632 20 0 BHADMO CC[C@@H](C)[N@@H+](C)Cc1sccc1Cl ZINC000194331999 206087401 /nfs/dbraw/zinc/08/74/01/206087401.db2.gz CWLYMSZDFPVIPB-MRVPVSSYSA-N 1 1 217.765 3.632 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1sccc1Cl ZINC000194332014 206087632 /nfs/dbraw/zinc/08/76/32/206087632.db2.gz CWLYMSZDFPVIPB-QMMMGPOBSA-N 1 1 217.765 3.632 20 0 BHADMO CC[C@@H](C)[N@@H+](C)Cc1cc(Cl)cs1 ZINC000194332035 206088344 /nfs/dbraw/zinc/08/83/44/206088344.db2.gz 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229.776 3.774 20 0 BHADMO CC(C)[N@@H+](Cc1cc(Cl)cs1)C1CC1 ZINC000194336721 388729824 /nfs/dbraw/zinc/72/98/24/388729824.db2.gz GNEFTAWUIGTVRL-UHFFFAOYSA-N 1 1 229.776 3.774 20 0 BHADMO Cc1cc(C[N@H+](C(C)C)C2CC2)c(C)s1 ZINC000194373985 387403027 /nfs/dbraw/zinc/40/30/27/387403027.db2.gz BWNGPCZIJQJHSV-UHFFFAOYSA-N 1 1 223.385 3.738 20 0 BHADMO Cc1cc(C[N@@H+](C)Cc2ccoc2C)c(C)s1 ZINC000194394989 387878742 /nfs/dbraw/zinc/87/87/42/387878742.db2.gz KEGNTDXNXKGJDF-UHFFFAOYSA-N 1 1 249.379 3.898 20 0 BHADMO CC[N@H+](Cc1cc(Cl)cs1)CC1CC1 ZINC000194396495 388732133 /nfs/dbraw/zinc/73/21/33/388732133.db2.gz QGSUKKYRTXUNRD-UHFFFAOYSA-N 1 1 229.776 3.633 20 0 BHADMO Clc1ccsc1C[N@H+]1C[C@@H]2CCC[C@@H]2C1 ZINC000194400613 388732321 /nfs/dbraw/zinc/73/23/21/388732321.db2.gz SRSKCKLUMNCDNM-AOOOYVTPSA-N 1 1 241.787 3.633 20 0 BHADMO Clc1csc(C[N@H+]2C[C@@H]3CCC[C@@H]3C2)c1 ZINC000194400677 388731764 /nfs/dbraw/zinc/73/17/64/388731764.db2.gz GHROKBNUBSJKDD-AOOOYVTPSA-N 1 1 241.787 3.633 20 0 BHADMO 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ZINC000194490613 206092596 /nfs/dbraw/zinc/09/25/96/206092596.db2.gz OQIBRGITHCOTTO-UHFFFAOYSA-N 1 1 241.787 3.778 20 0 BHADMO C[N@@H+](Cc1cccc(Cl)c1Cl)C1CC1 ZINC000194722941 385447544 /nfs/dbraw/zinc/44/75/44/385447544.db2.gz ZVNHPEWMAHMSHC-UHFFFAOYSA-N 1 1 230.138 3.588 20 0 BHADMO C[N@H+](Cc1cccc(Cl)c1Cl)C1CC1 ZINC000194722941 385447543 /nfs/dbraw/zinc/44/75/43/385447543.db2.gz ZVNHPEWMAHMSHC-UHFFFAOYSA-N 1 1 230.138 3.588 20 0 BHADMO C[C@H](C[N@H+]1CCSCC[C@H]1C)c1ccccc1 ZINC000194887744 206113536 /nfs/dbraw/zinc/11/35/36/206113536.db2.gz AHFMWLODTDHYNN-ZIAGYGMSSA-N 1 1 249.423 3.618 20 0 BHADMO C[C@H](C[N@H+]1CCSCC[C@@H]1C)c1ccccc1 ZINC000194887763 206113493 /nfs/dbraw/zinc/11/34/93/206113493.db2.gz AHFMWLODTDHYNN-KGLIPLIRSA-N 1 1 249.423 3.618 20 0 BHADMO CC(C)[N@@H+](C)Cc1ccc(SC(F)F)cc1 ZINC000194924825 644351528 /nfs/dbraw/zinc/35/15/28/644351528.db2.gz HMRXUJUGQBVDQD-UHFFFAOYSA-N 1 1 245.338 3.842 20 0 BHADMO C[C@@H](c1ccco1)[N@@H+](C)CCc1ccccc1F ZINC000195007205 367331941 /nfs/dbraw/zinc/33/19/41/367331941.db2.gz ALKKHBJGCUJGCH-LBPRGKRZSA-N 1 1 247.313 3.654 20 0 BHADMO C[C@H](c1ccco1)[N@@H+](C)CCc1ccccc1F ZINC000195007216 367331206 /nfs/dbraw/zinc/33/12/06/367331206.db2.gz ALKKHBJGCUJGCH-GFCCVEGCSA-N 1 1 247.313 3.654 20 0 BHADMO CCC[N@@H+](CCc1cccs1)Cc1ccco1 ZINC000195007904 367331655 /nfs/dbraw/zinc/33/16/55/367331655.db2.gz LDZXOXRHAQCUHW-UHFFFAOYSA-N 1 1 249.379 3.796 20 0 BHADMO CCC[N@@H+](C)Cc1cc(Cl)cc2cccnc21 ZINC000195013515 388692937 /nfs/dbraw/zinc/69/29/37/388692937.db2.gz WVWCCRZJAFRUHO-UHFFFAOYSA-N 1 1 248.757 3.730 20 0 BHADMO CCC[N@@H+](C)Cc1cnc(-c2ccccc2)s1 ZINC000195016192 388694338 /nfs/dbraw/zinc/69/43/38/388694338.db2.gz TVAFYUCXDIDLGB-UHFFFAOYSA-N 1 1 246.379 3.652 20 0 BHADMO CC[N@@H+](Cc1cc(C)sc1C)C(C)C ZINC000195028236 388693850 /nfs/dbraw/zinc/69/38/50/388693850.db2.gz CTLVIWKMNSEFCT-UHFFFAOYSA-N 1 1 211.374 3.595 20 0 BHADMO CC(C)[N@H+](Cc1ccsc1)CC1CCC1 ZINC000195080780 388097292 /nfs/dbraw/zinc/09/72/92/388097292.db2.gz AXNHYAKAHHWNQN-UHFFFAOYSA-N 1 1 223.385 3.759 20 0 BHADMO Cc1ccsc1C[N@H+](C)[C@@H](C)c1ccncc1 ZINC000195132417 367342759 /nfs/dbraw/zinc/34/27/59/367342759.db2.gz AHDKBNRBXROTTB-LBPRGKRZSA-N 1 1 246.379 3.645 20 0 BHADMO Cc1ccsc1C[N@H+](C)[C@H](C)c1ccncc1 ZINC000195132429 367342130 /nfs/dbraw/zinc/34/21/30/367342130.db2.gz AHDKBNRBXROTTB-GFCCVEGCSA-N 1 1 246.379 3.645 20 0 BHADMO CCC[N@@H+](C)Cc1csc(C2CCCC2)n1 ZINC000195251525 388701949 /nfs/dbraw/zinc/70/19/49/388701949.db2.gz PZWKMYSJCVKPJO-UHFFFAOYSA-N 1 1 238.400 3.643 20 0 BHADMO CCC[N@H+](C)Cc1csc(C2CCCC2)n1 ZINC000195251525 388701945 /nfs/dbraw/zinc/70/19/45/388701945.db2.gz PZWKMYSJCVKPJO-UHFFFAOYSA-N 1 1 238.400 3.643 20 0 BHADMO CC[C@H](c1ccccc1)[N@@H+](C)Cc1cscn1 ZINC000195308234 388704214 /nfs/dbraw/zinc/70/42/14/388704214.db2.gz PXSUQFPTCDNRBY-CQSZACIVSA-N 1 1 246.379 3.726 20 0 BHADMO CC[C@H](c1ccccc1)[N@H+](C)Cc1cscn1 ZINC000195308234 388704212 /nfs/dbraw/zinc/70/42/12/388704212.db2.gz PXSUQFPTCDNRBY-CQSZACIVSA-N 1 1 246.379 3.726 20 0 BHADMO CC[N@@H+](Cc1cccc(OC(F)F)c1)C(C)C ZINC000195310272 367353754 /nfs/dbraw/zinc/35/37/54/367353754.db2.gz IUUMZRHSNVASKL-UHFFFAOYSA-N 1 1 243.297 3.518 20 0 BHADMO C(C1CCCC1)[N@H+]1CCC[C@@H]1C1CCCC1 ZINC000195542712 388712463 /nfs/dbraw/zinc/71/24/63/388712463.db2.gz NFOIJWPNMQNSGS-OAHLLOKOSA-N 1 1 221.388 3.831 20 0 BHADMO C(C1CCCC1)[N@H+]1CCC[C@H]1C1CCCC1 ZINC000195542713 388712833 /nfs/dbraw/zinc/71/28/33/388712833.db2.gz NFOIJWPNMQNSGS-HNNXBMFYSA-N 1 1 221.388 3.831 20 0 BHADMO COc1ccc(C[N@@H+]([C@@H](C)C(C)C)C2CC2)cc1 ZINC000195542855 388712805 /nfs/dbraw/zinc/71/28/05/388712805.db2.gz YHWMGNQPFRPYMQ-ZDUSSCGKSA-N 1 1 247.382 3.704 20 0 BHADMO COc1ccc(C[N@@H+]([C@H](C)C(C)C)C2CC2)cc1 ZINC000195542857 388712792 /nfs/dbraw/zinc/71/27/92/388712792.db2.gz YHWMGNQPFRPYMQ-CYBMUJFWSA-N 1 1 247.382 3.704 20 0 BHADMO CC[N@@H+](CCSC)Cc1ccccc1Cl ZINC000195569980 387322477 /nfs/dbraw/zinc/32/24/77/387322477.db2.gz CTKAKAHISFTNIF-UHFFFAOYSA-N 1 1 243.803 3.525 20 0 BHADMO C[C@@H](c1ccc(F)c(Cl)c1)[N@@H+](C)CC1CC1 ZINC000195594401 388714894 /nfs/dbraw/zinc/71/48/94/388714894.db2.gz UGIWWXFYJCJSEM-VIFPVBQESA-N 1 1 241.737 3.882 20 0 BHADMO C[C@H](c1ccc(F)c(Cl)c1)[N@@H+](C)CC1CC1 ZINC000195594402 388714441 /nfs/dbraw/zinc/71/44/41/388714441.db2.gz UGIWWXFYJCJSEM-SECBINFHSA-N 1 1 241.737 3.882 20 0 BHADMO Fc1ccc(C[N@@H+](CC2CCCC2)C2CC2)cc1 ZINC000195599236 388714577 /nfs/dbraw/zinc/71/45/77/388714577.db2.gz ARQQJFRXTNRQPB-UHFFFAOYSA-N 1 1 247.357 3.980 20 0 BHADMO COc1ccc([C@@H](C)[N@@H+](C)CC2CCCC2)cc1 ZINC000195599288 388714954 /nfs/dbraw/zinc/71/49/54/388714954.db2.gz SMSHJBOSVJAOET-CYBMUJFWSA-N 1 1 247.382 3.878 20 0 BHADMO COc1ccc([C@H](C)[N@@H+](C)CC2CCCC2)cc1 ZINC000195599289 388714944 /nfs/dbraw/zinc/71/49/44/388714944.db2.gz SMSHJBOSVJAOET-ZDUSSCGKSA-N 1 1 247.382 3.878 20 0 BHADMO Fc1ccccc1C[N@@H+](CC1CCCC1)C1CC1 ZINC000195599332 388508227 /nfs/dbraw/zinc/50/82/27/388508227.db2.gz CCBLSTUNVXCTGL-UHFFFAOYSA-N 1 1 247.357 3.980 20 0 BHADMO CC1CCC([N@@H+](C)CC2CCCC2)CC1 ZINC000195599495 388714728 /nfs/dbraw/zinc/71/47/28/388714728.db2.gz OVHIZKUUYLKJLU-UHFFFAOYSA-N 1 1 209.377 3.687 20 0 BHADMO CC[N@@H+](CC1CCCC1)C1CCCCC1 ZINC000195600344 388716298 /nfs/dbraw/zinc/71/62/98/388716298.db2.gz GNKKLXULDZIXPY-UHFFFAOYSA-N 1 1 209.377 3.831 20 0 BHADMO CC[N@@H+](CCSC)Cc1cccc(Cl)c1 ZINC000195601324 387323359 /nfs/dbraw/zinc/32/33/59/387323359.db2.gz XXFPSIZQLRVGOV-UHFFFAOYSA-N 1 1 243.803 3.525 20 0 BHADMO CSCC[N@H+](Cc1ccccc1)CC1CCC1 ZINC000195653890 175494742 /nfs/dbraw/zinc/49/47/42/175494742.db2.gz KTMAMQJYMDYSBP-UHFFFAOYSA-N 1 1 249.423 3.652 20 0 BHADMO CCC[N@H+](Cc1cc(F)ccc1F)CC1CC1 ZINC000195661815 367373255 /nfs/dbraw/zinc/37/32/55/367373255.db2.gz NRFWONGIQAPPJC-UHFFFAOYSA-N 1 1 239.309 3.587 20 0 BHADMO CCc1ccc(C[N@@H+](CCSC)C2CC2)cc1 ZINC000195664551 367373860 /nfs/dbraw/zinc/37/38/60/367373860.db2.gz SSOJLAMYTJFURN-UHFFFAOYSA-N 1 1 249.423 3.576 20 0 BHADMO Fc1cccc(C[N@@H+](CC2CCCC2)C2CC2)c1 ZINC000195667024 388544883 /nfs/dbraw/zinc/54/48/83/388544883.db2.gz JBCKBIMHQQSIJV-UHFFFAOYSA-N 1 1 247.357 3.980 20 0 BHADMO CCOc1ccccc1C[N@@H+](C)CC1CCCC1 ZINC000195667144 388544924 /nfs/dbraw/zinc/54/49/24/388544924.db2.gz QHQKDHHTJYBPCQ-UHFFFAOYSA-N 1 1 247.382 3.707 20 0 BHADMO Cc1cc(C[N@H+](C)Cc2ccccc2)c(C)s1 ZINC000195673624 387924996 /nfs/dbraw/zinc/92/49/96/387924996.db2.gz RBWMDNNLQJTQJN-UHFFFAOYSA-N 1 1 245.391 3.997 20 0 BHADMO Cc1cc(C[N@@H+]2CCC[C@@H](C)C2)c(C)s1 ZINC000195673641 388718099 /nfs/dbraw/zinc/71/80/99/388718099.db2.gz GZJSYCHUZGVQHM-SNVBAGLBSA-N 1 1 223.385 3.597 20 0 BHADMO Cc1cc(C[N@@H+]2CCC[C@H](C)C2)c(C)s1 ZINC000195673642 388718217 /nfs/dbraw/zinc/71/82/17/388718217.db2.gz GZJSYCHUZGVQHM-JTQLQIEISA-N 1 1 223.385 3.597 20 0 BHADMO Cc1cc(C[N@@H+]2C[C@H](C)C[C@H](C)C2)c(C)s1 ZINC000195673649 134845208 /nfs/dbraw/zinc/84/52/08/134845208.db2.gz QLQHACPTJNDFOQ-PHIMTYICSA-N 1 1 237.412 3.843 20 0 BHADMO CCCC[N@@H+](C)Cc1cc(C)sc1C ZINC000195673652 388718638 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RVVHSXFRXCOKPP-UHFFFAOYSA-N 1 1 227.351 3.928 20 0 BHADMO CC(C)C[N@H+]1CCCC2(CCCCC2)C1 ZINC000200870253 347852948 /nfs/dbraw/zinc/85/29/48/347852948.db2.gz AWPIBSOHMGXFLK-UHFFFAOYSA-N 1 1 209.377 3.689 20 0 BHADMO CC(C)(C)[C@@H]1CCC[N@@H+](Cc2cccnc2)CC1 ZINC000200985972 345729163 /nfs/dbraw/zinc/72/91/63/345729163.db2.gz QMDMJMWOYAJKRN-OAHLLOKOSA-N 1 1 246.398 3.730 20 0 BHADMO CC(C)(C)[C@H]1CCC[N@@H+](Cc2cccnc2)CC1 ZINC000200985998 347864358 /nfs/dbraw/zinc/86/43/58/347864358.db2.gz QMDMJMWOYAJKRN-HNNXBMFYSA-N 1 1 246.398 3.730 20 0 BHADMO CC[C@H]1CCC[N@@H+](Cc2ccc(C)cc2)C1 ZINC000201186232 342799788 /nfs/dbraw/zinc/79/97/88/342799788.db2.gz UYVZOXCMXNZTPP-AWEZNQCLSA-N 1 1 217.356 3.617 20 0 BHADMO CC(C)CC[N@@H+](C)Cc1cnc2ccccc2c1 ZINC000201485296 541501353 /nfs/dbraw/zinc/50/13/53/541501353.db2.gz ZKQHOZAGNGYDOV-UHFFFAOYSA-N 1 1 242.366 3.713 20 0 BHADMO Cc1ccc(C(C)(C)C[N@H+](C)C(C)C)cc1 ZINC000201945933 356453394 /nfs/dbraw/zinc/45/33/94/356453394.db2.gz KXTGCIYPFAUHPF-UHFFFAOYSA-N 1 1 219.372 3.613 20 0 BHADMO Cc1ccc(C(C)(C)C[N@H+](C)C2CCC2)cc1 ZINC000201954309 349300088 /nfs/dbraw/zinc/30/00/88/349300088.db2.gz BCWYBQIRMDGWML-UHFFFAOYSA-N 1 1 231.383 3.757 20 0 BHADMO CC(C)c1cccc2c1CC[N@H+](C(C)C)C2 ZINC000202302608 346003298 /nfs/dbraw/zinc/00/32/98/346003298.db2.gz MOKQNCGUOMJTEY-UHFFFAOYSA-N 1 1 217.356 3.577 20 0 BHADMO CCCC[N@@H+](CC)Cc1ccc(C)cc1 ZINC000202474472 541501714 /nfs/dbraw/zinc/50/17/14/541501714.db2.gz NEMKMMQHAFASAB-UHFFFAOYSA-N 1 1 205.345 3.617 20 0 BHADMO C[C@@H]1CCC[N@H+]1Cc1ccccc1C(F)(F)F ZINC000202497472 346107999 /nfs/dbraw/zinc/10/79/99/346107999.db2.gz UDWCOCVFZUIKGW-SNVBAGLBSA-N 1 1 243.272 3.690 20 0 BHADMO C[C@H]1CCC[N@H+]1Cc1ccccc1C(F)(F)F ZINC000202497495 346107608 /nfs/dbraw/zinc/10/76/08/346107608.db2.gz UDWCOCVFZUIKGW-JTQLQIEISA-N 1 1 243.272 3.690 20 0 BHADMO CC(C)(C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000202660130 345730687 /nfs/dbraw/zinc/73/06/87/345730687.db2.gz ZGTVUQGFDBWDTO-AWEZNQCLSA-N 1 1 217.356 3.555 20 0 BHADMO 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CCC[C@H]1CCCC[N@H+]1CCC(=O)C(C)(C)C ZINC000214137881 591536754 /nfs/dbraw/zinc/53/67/54/591536754.db2.gz XEBTYBZRDZBPIY-ZDUSSCGKSA-N 1 1 239.403 3.646 20 0 BHADMO C[C@H]([NH2+]C/C=C\c1ccccc1)c1nccs1 ZINC000215276014 384286333 /nfs/dbraw/zinc/28/63/33/384286333.db2.gz RRXLIHYXMKIVPL-JECSTDCCSA-N 1 1 244.363 3.507 20 0 BHADMO C[C@@H]([NH2+]C/C=C\c1ccccc1)c1nccs1 ZINC000215276063 384285548 /nfs/dbraw/zinc/28/55/48/384285548.db2.gz RRXLIHYXMKIVPL-VVEJJEBESA-N 1 1 244.363 3.507 20 0 BHADMO CC(C)OCCC[N@@H+](Cc1ccccc1)C(C)C ZINC000215665265 353525951 /nfs/dbraw/zinc/52/59/51/353525951.db2.gz WXICEAODDMNBGN-UHFFFAOYSA-N 1 1 249.398 3.712 20 0 BHADMO CCc1ccc(C[N@@H+](C/C=C\Cl)C2CC2)cc1 ZINC000215878590 641701461 /nfs/dbraw/zinc/70/14/61/641701461.db2.gz KIJOILGVOGKSGV-KMKOMSMNSA-N 1 1 249.785 3.966 20 0 BHADMO CCOc1ccccc1C[N@@H+](C)C1CCCCC1 ZINC000215892493 384623863 /nfs/dbraw/zinc/62/38/63/384623863.db2.gz FWYTURCPYMNTEM-UHFFFAOYSA-N 1 1 247.382 3.850 20 0 BHADMO CCCC[N@@H+](C)CCSc1ccc(F)cc1 ZINC000215893103 371651990 /nfs/dbraw/zinc/65/19/90/371651990.db2.gz VWMHNOWZWRWFRS-UHFFFAOYSA-N 1 1 241.375 3.650 20 0 BHADMO Cc1cc(C[N@H+](C)C(C2CC2)C2CC2)c(C)s1 ZINC000215895910 256600768 /nfs/dbraw/zinc/60/07/68/256600768.db2.gz VGIRMVDJUFEFCT-UHFFFAOYSA-N 1 1 249.423 3.985 20 0 BHADMO CC(C)[N@@H+](C)Cc1cccc(Cl)c1Cl ZINC000215905121 384760100 /nfs/dbraw/zinc/76/01/00/384760100.db2.gz GTVUPMOGNNUJJT-UHFFFAOYSA-N 1 1 232.154 3.834 20 0 BHADMO CC[N@@H+](Cc1ccccc1OC)C1CCCCC1 ZINC000216436552 386189626 /nfs/dbraw/zinc/18/96/26/386189626.db2.gz CMUVVZIDDYXWCR-UHFFFAOYSA-N 1 1 247.382 3.850 20 0 BHADMO CCCC[N@@H+](CC)[C@@H](C)c1ccccc1 ZINC000216452613 323106073 /nfs/dbraw/zinc/10/60/73/323106073.db2.gz SDIYIPROOMETJC-ZDUSSCGKSA-N 1 1 205.345 3.870 20 0 BHADMO CCCC[N@@H+](CC)[C@H](C)c1ccccc1 ZINC000216452656 323106075 /nfs/dbraw/zinc/10/60/75/323106075.db2.gz SDIYIPROOMETJC-CYBMUJFWSA-N 1 1 205.345 3.870 20 0 BHADMO CCC[N@H+](Cc1ccccc1OCC)CC1CC1 ZINC000216462135 490396194 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/nfs/dbraw/zinc/11/87/02/350118702.db2.gz OENCTLISHMPMKM-NSHDSACASA-N 1 1 246.379 3.556 20 0 BHADMO CCc1cnc(C[NH2+][C@H](C)c2ccccc2)s1 ZINC000219248243 350118447 /nfs/dbraw/zinc/11/84/47/350118447.db2.gz OENCTLISHMPMKM-LLVKDONJSA-N 1 1 246.379 3.556 20 0 BHADMO CC(C)[C@@H]1CCCC[N@H+]1Cc1ccccc1 ZINC000219267590 345745498 /nfs/dbraw/zinc/74/54/98/345745498.db2.gz SRVZRLSCYJFDAW-HNNXBMFYSA-N 1 1 217.356 3.697 20 0 BHADMO CC(C)[C@H]1CCCC[N@H+]1Cc1ccccc1 ZINC000219267641 342853207 /nfs/dbraw/zinc/85/32/07/342853207.db2.gz SRVZRLSCYJFDAW-OAHLLOKOSA-N 1 1 217.356 3.697 20 0 BHADMO CC(C)=CC[NH2+][C@@H](c1ccco1)c1ccccc1 ZINC000219381718 350125456 /nfs/dbraw/zinc/12/54/56/350125456.db2.gz XHMCIMJTAQHXOD-MRXNPFEDSA-N 1 1 241.334 3.925 20 0 BHADMO CC(C)=CC[NH2+][C@H](c1ccco1)c1ccccc1 ZINC000219381789 350124932 /nfs/dbraw/zinc/12/49/32/350124932.db2.gz XHMCIMJTAQHXOD-INIZCTEOSA-N 1 1 241.334 3.925 20 0 BHADMO C[N@@H+](CCc1ccccc1)C1CCCCCC1 ZINC000219465952 345745702 /nfs/dbraw/zinc/74/57/02/345745702.db2.gz IMHAKUJUMMFJCK-UHFFFAOYSA-N 1 1 231.383 3.884 20 0 BHADMO CC[N@@H+](Cc1ccc(OC)cc1)C1CCCCC1 ZINC000220328524 388604038 /nfs/dbraw/zinc/60/40/38/388604038.db2.gz LJZWOROKHUUZKQ-UHFFFAOYSA-N 1 1 247.382 3.850 20 0 BHADMO Cc1cnc([C@@H](C)[NH2+][C@H](C)c2ccccc2C)o1 ZINC000220887771 134313065 /nfs/dbraw/zinc/31/30/65/134313065.db2.gz DDASHROJQASRSX-CHWSQXEVSA-N 1 1 244.338 3.703 20 0 BHADMO Cc1cnc([C@H](C)[NH2+][C@H](C)c2ccccc2C)o1 ZINC000220887824 134313320 /nfs/dbraw/zinc/31/33/20/134313320.db2.gz DDASHROJQASRSX-OLZOCXBDSA-N 1 1 244.338 3.703 20 0 BHADMO CC[C@@H]([NH2+][C@@H](C)c1ncc(C)o1)c1ccccc1 ZINC000220924788 134315048 /nfs/dbraw/zinc/31/50/48/134315048.db2.gz JCLUASHZCFCFJB-GXTWGEPZSA-N 1 1 244.338 3.785 20 0 BHADMO CC[C@H]([NH2+][C@@H](C)c1ncc(C)o1)c1ccccc1 ZINC000220924843 134314983 /nfs/dbraw/zinc/31/49/83/134314983.db2.gz JCLUASHZCFCFJB-JSGCOSHPSA-N 1 1 244.338 3.785 20 0 BHADMO CC[C@@H]([NH2+][C@H](C)c1ncc(C)o1)c1ccccc1 ZINC000220924898 535808816 /nfs/dbraw/zinc/80/88/16/535808816.db2.gz JCLUASHZCFCFJB-TZMCWYRMSA-N 1 1 244.338 3.785 20 0 BHADMO CC[C@H]([NH2+][C@H](C)c1ncc(C)o1)c1ccccc1 ZINC000220924959 134315229 /nfs/dbraw/zinc/31/52/29/134315229.db2.gz JCLUASHZCFCFJB-OCCSQVGLSA-N 1 1 244.338 3.785 20 0 BHADMO Cc1ccc(C[N@@H+](C)C/C=C\c2ccccc2)o1 ZINC000222029485 349990033 /nfs/dbraw/zinc/99/00/33/349990033.db2.gz OELREUBMKINUFG-TWGQIWQCSA-N 1 1 241.334 3.733 20 0 BHADMO Cc1ccc(C[N@@H+](C)C/C=C/c2ccccc2)o1 ZINC000222029545 349990211 /nfs/dbraw/zinc/99/02/11/349990211.db2.gz OELREUBMKINUFG-RMKNXTFCSA-N 1 1 241.334 3.733 20 0 BHADMO C[C@@H](c1ccccc1)[N@H+]1CCc2ccccc2C1 ZINC000222952345 345748074 /nfs/dbraw/zinc/74/80/74/345748074.db2.gz PWLQUEOPKUBKCQ-AWEZNQCLSA-N 1 1 237.346 3.806 20 0 BHADMO C[C@H](c1ccccc1)[N@H+]1CCc2ccccc2C1 ZINC000222952408 345748107 /nfs/dbraw/zinc/74/81/07/345748107.db2.gz PWLQUEOPKUBKCQ-CQSZACIVSA-N 1 1 237.346 3.806 20 0 BHADMO Cc1ccc(C)c(OCC[C@@H]2CCCC[N@@H+]2C)c1 ZINC000223005303 640525279 /nfs/dbraw/zinc/52/52/79/640525279.db2.gz NETCCYGDPYBOLV-HNNXBMFYSA-N 1 1 247.382 3.557 20 0 BHADMO Cc1ccc(C)c(OCC[C@H]2CCCC[N@@H+]2C)c1 ZINC000223005347 640526135 /nfs/dbraw/zinc/52/61/35/640526135.db2.gz NETCCYGDPYBOLV-OAHLLOKOSA-N 1 1 247.382 3.557 20 0 BHADMO Cc1cc(C)cc(OCC[C@@H]2CCCC[N@@H+]2C)c1 ZINC000223005846 640525493 /nfs/dbraw/zinc/52/54/93/640525493.db2.gz RAKPVKDMBGQXJW-HNNXBMFYSA-N 1 1 247.382 3.557 20 0 BHADMO Cc1cc(C)cc(OCC[C@H]2CCCC[N@@H+]2C)c1 ZINC000223005913 640525006 /nfs/dbraw/zinc/52/50/06/640525006.db2.gz RAKPVKDMBGQXJW-OAHLLOKOSA-N 1 1 247.382 3.557 20 0 BHADMO CCc1cccc(OCC[C@@H]2CCCC[N@H+]2C)c1 ZINC000223007213 640525091 /nfs/dbraw/zinc/52/50/91/640525091.db2.gz WPCHMLFQTXDOPD-HNNXBMFYSA-N 1 1 247.382 3.502 20 0 BHADMO CCc1cccc(OCC[C@H]2CCCC[N@H+]2C)c1 ZINC000223007270 640525162 /nfs/dbraw/zinc/52/51/62/640525162.db2.gz WPCHMLFQTXDOPD-OAHLLOKOSA-N 1 1 247.382 3.502 20 0 BHADMO Cc1cccc(OCC[C@@H]2CCCC[N@@H+]2C)c1C ZINC000223009494 640525045 /nfs/dbraw/zinc/52/50/45/640525045.db2.gz LSSLXOOUALOUPR-HNNXBMFYSA-N 1 1 247.382 3.557 20 0 BHADMO Cc1cccc(OCC[C@H]2CCCC[N@@H+]2C)c1C ZINC000223009557 640525809 /nfs/dbraw/zinc/52/58/09/640525809.db2.gz LSSLXOOUALOUPR-OAHLLOKOSA-N 1 1 247.382 3.557 20 0 BHADMO Cc1ccc(OCC[C@@H]2CCCC[N@@H+]2C)c(C)c1 ZINC000223013350 640525605 /nfs/dbraw/zinc/52/56/05/640525605.db2.gz FMTHZLRIDAWIAN-HNNXBMFYSA-N 1 1 247.382 3.557 20 0 BHADMO Cc1ccc(OCC[C@H]2CCCC[N@@H+]2C)c(C)c1 ZINC000223013417 640525892 /nfs/dbraw/zinc/52/58/92/640525892.db2.gz FMTHZLRIDAWIAN-OAHLLOKOSA-N 1 1 247.382 3.557 20 0 BHADMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCCc1ccccc1 ZINC000223352998 345749213 /nfs/dbraw/zinc/74/92/13/345749213.db2.gz YDTLGMICWHLKJV-GASCZTMLSA-N 1 1 231.383 3.882 20 0 BHADMO C[C@@H]1C[N@H+](C/C=C\c2ccccc2)C[C@H](C)S1 ZINC000225308830 345750325 /nfs/dbraw/zinc/75/03/25/345750325.db2.gz GTHJHVJECLNTPI-JDPNTUOHSA-N 1 1 247.407 3.526 20 0 BHADMO C[C@@H]1C[N@H+](C/C=C/c2ccccc2)C[C@H](C)S1 ZINC000225308863 350358879 /nfs/dbraw/zinc/35/88/79/350358879.db2.gz GTHJHVJECLNTPI-YLXGSJGQSA-N 1 1 247.407 3.526 20 0 BHADMO Clc1cc(Cl)cc(C[NH+]2CCCC2)c1 ZINC000225641254 350368998 /nfs/dbraw/zinc/36/89/98/350368998.db2.gz NZEIZQRJGGJSQC-UHFFFAOYSA-N 1 1 230.138 3.589 20 0 BHADMO CCc1ccc(CNc2[nH+]cccc2C)s1 ZINC000225878356 384668228 /nfs/dbraw/zinc/66/82/28/384668228.db2.gz GDBKNWMYDHZFEL-UHFFFAOYSA-N 1 1 232.352 3.626 20 0 BHADMO CC(C)[C@@H]1CCC[N@H+]1Cc1ccc(F)c(F)c1 ZINC000225892880 363210264 /nfs/dbraw/zinc/21/02/64/363210264.db2.gz QMDGIIQLCWRXFV-AWEZNQCLSA-N 1 1 239.309 3.585 20 0 BHADMO CC(C)[C@H]1CCC[N@H+]1Cc1ccc(F)c(F)c1 ZINC000225892894 345751134 /nfs/dbraw/zinc/75/11/34/345751134.db2.gz QMDGIIQLCWRXFV-CQSZACIVSA-N 1 1 239.309 3.585 20 0 BHADMO CCCc1ccc(N[C@@H]2CC[N@@H+](C)[C@@H](C)C2)cc1 ZINC000226822339 640796848 /nfs/dbraw/zinc/79/68/48/640796848.db2.gz QNZTWKGIZQKXEV-XJKSGUPXSA-N 1 1 246.398 3.534 20 0 BHADMO CCCc1ccc(N[C@H]2CC[N@@H+](C)[C@@H](C)C2)cc1 ZINC000226822348 640796132 /nfs/dbraw/zinc/79/61/32/640796132.db2.gz QNZTWKGIZQKXEV-BBRMVZONSA-N 1 1 246.398 3.534 20 0 BHADMO CCCc1ccccc1N[C@@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000226824971 491051752 /nfs/dbraw/zinc/05/17/52/491051752.db2.gz JPRBRKDVNAMFDI-DZGCQCFKSA-N 1 1 246.398 3.534 20 0 BHADMO CCCc1ccccc1N[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000226824975 491051744 /nfs/dbraw/zinc/05/17/44/491051744.db2.gz JPRBRKDVNAMFDI-ZFWWWQNUSA-N 1 1 246.398 3.534 20 0 BHADMO CCC(CC)(CNc1cccc(C)[nH+]1)SC ZINC000227000227 635444881 /nfs/dbraw/zinc/44/48/81/635444881.db2.gz YRDAAKHPCOLOSG-UHFFFAOYSA-N 1 1 238.400 3.724 20 0 BHADMO CC(C)CC[C@H](C)[NH2+][C@@H]1C[C@@H](N)c2ccccc21 ZINC000227535210 134382901 /nfs/dbraw/zinc/38/29/01/134382901.db2.gz KSCDJGWRTKJQPK-APHBMKBZSA-N 1 1 246.398 3.546 20 0 BHADMO CC(C)CC[C@H](C)[NH2+][C@H]1C[C@@H](N)c2ccccc21 ZINC000227535217 134382708 /nfs/dbraw/zinc/38/27/08/134382708.db2.gz KSCDJGWRTKJQPK-MAZHCROVSA-N 1 1 246.398 3.546 20 0 BHADMO CCCCC[C@H](C)[NH2+][C@@H]1C[C@@H](N)c2ccccc21 ZINC000227536388 635451628 /nfs/dbraw/zinc/45/16/28/635451628.db2.gz KYFAMNFHXROHIB-APHBMKBZSA-N 1 1 246.398 3.690 20 0 BHADMO CCCCC[C@H](C)[NH2+][C@H]1C[C@@H](N)c2ccccc21 ZINC000227536401 640838461 /nfs/dbraw/zinc/83/84/61/640838461.db2.gz KYFAMNFHXROHIB-MAZHCROVSA-N 1 1 246.398 3.690 20 0 BHADMO CC[C@H](C)C[C@H](C)[NH2+][C@@H]1C[C@@H](N)c2ccccc21 ZINC000227541643 134382964 /nfs/dbraw/zinc/38/29/64/134382964.db2.gz AKTJXKXHGSVWQO-YXAMBPQSSA-N 1 1 246.398 3.546 20 0 BHADMO CCSCC[N@@H+](CC(C)C)C1CCCC1 ZINC000227564466 388754072 /nfs/dbraw/zinc/75/40/72/388754072.db2.gz CTLVBFQOXOTRHS-UHFFFAOYSA-N 1 1 229.433 3.640 20 0 BHADMO CC(C)C1(CNc2cc[nH+]cc2Cl)CC1 ZINC000227823608 134389626 /nfs/dbraw/zinc/38/96/26/134389626.db2.gz XIRBXQUTIPDPSX-UHFFFAOYSA-N 1 1 224.735 3.583 20 0 BHADMO FC(F)(C[NH2+]C1CCCCC1)c1ccccc1 ZINC000227897963 388761149 /nfs/dbraw/zinc/76/11/49/388761149.db2.gz IZQWPQUPDOEBBA-UHFFFAOYSA-N 1 1 239.309 3.701 20 0 BHADMO CC(C)C[C@@H](C)[NH2+]CC(F)(F)c1ccccc1 ZINC000227899166 388761033 /nfs/dbraw/zinc/76/10/33/388761033.db2.gz QRBHJXYIQGSUDY-GFCCVEGCSA-N 1 1 241.325 3.803 20 0 BHADMO CC(C)C[C@H](C)[NH2+]CC(F)(F)c1ccccc1 ZINC000227899172 259634743 /nfs/dbraw/zinc/63/47/43/259634743.db2.gz QRBHJXYIQGSUDY-LBPRGKRZSA-N 1 1 241.325 3.803 20 0 BHADMO CC[C@@H](C)[C@@H](C)[NH2+]CC(F)(F)c1ccccc1 ZINC000227899953 259634808 /nfs/dbraw/zinc/63/48/08/259634808.db2.gz XKCSQFFWHCLAMN-VXGBXAGGSA-N 1 1 241.325 3.803 20 0 BHADMO CC[C@H](C)[C@@H](C)[NH2+]CC(F)(F)c1ccccc1 ZINC000227899959 259422139 /nfs/dbraw/zinc/42/21/39/259422139.db2.gz XKCSQFFWHCLAMN-NWDGAFQWSA-N 1 1 241.325 3.803 20 0 BHADMO CC[C@@H](C)[C@H](C)[NH2+]CC(F)(F)c1ccccc1 ZINC000227899964 388761571 /nfs/dbraw/zinc/76/15/71/388761571.db2.gz XKCSQFFWHCLAMN-NEPJUHHUSA-N 1 1 241.325 3.803 20 0 BHADMO CC[C@H](C)[C@H](C)[NH2+]CC(F)(F)c1ccccc1 ZINC000227899968 388761862 /nfs/dbraw/zinc/76/18/62/388761862.db2.gz XKCSQFFWHCLAMN-RYUDHWBXSA-N 1 1 241.325 3.803 20 0 BHADMO C[C@@H]1CCC[C@@H]1[NH2+]CC(F)(F)c1ccccc1 ZINC000227901753 388761987 /nfs/dbraw/zinc/76/19/87/388761987.db2.gz BMMSABSCWJRALW-YPMHNXCESA-N 1 1 239.309 3.557 20 0 BHADMO C[C@H]1CCC[C@@H]1[NH2+]CC(F)(F)c1ccccc1 ZINC000227901757 322819242 /nfs/dbraw/zinc/81/92/42/322819242.db2.gz BMMSABSCWJRALW-AAEUAGOBSA-N 1 1 239.309 3.557 20 0 BHADMO C[C@@H]1CCC[C@H]1[NH2+]CC(F)(F)c1ccccc1 ZINC000227901763 388761740 /nfs/dbraw/zinc/76/17/40/388761740.db2.gz BMMSABSCWJRALW-DGCLKSJQSA-N 1 1 239.309 3.557 20 0 BHADMO C[C@H]1CCC[C@H]1[NH2+]CC(F)(F)c1ccccc1 ZINC000227901766 388761828 /nfs/dbraw/zinc/76/18/28/388761828.db2.gz BMMSABSCWJRALW-WCQYABFASA-N 1 1 239.309 3.557 20 0 BHADMO C[C@@H](CC1CC1)[NH2+]CC(F)(F)c1ccccc1 ZINC000227901993 388761014 /nfs/dbraw/zinc/76/10/14/388761014.db2.gz DMVSSIFAEDXIGB-NSHDSACASA-N 1 1 239.309 3.557 20 0 BHADMO C[C@H](CC1CC1)[NH2+]CC(F)(F)c1ccccc1 ZINC000227901997 388761843 /nfs/dbraw/zinc/76/18/43/388761843.db2.gz DMVSSIFAEDXIGB-LLVKDONJSA-N 1 1 239.309 3.557 20 0 BHADMO C[C@@H]([NH2+]CC(F)(F)c1ccccc1)C(C)(C)C ZINC000227904088 259634735 /nfs/dbraw/zinc/63/47/35/259634735.db2.gz SLBUKCALQFJWCL-LLVKDONJSA-N 1 1 241.325 3.803 20 0 BHADMO C[C@H]([NH2+]CC(F)(F)c1ccccc1)C(C)(C)C ZINC000227904092 388761755 /nfs/dbraw/zinc/76/17/55/388761755.db2.gz SLBUKCALQFJWCL-NSHDSACASA-N 1 1 241.325 3.803 20 0 BHADMO C[C@@H]([NH2+]CC(F)(F)c1ccccc1)C1CCC1 ZINC000227904434 388761157 /nfs/dbraw/zinc/76/11/57/388761157.db2.gz UCDSZYUSUJWVEW-LLVKDONJSA-N 1 1 239.309 3.557 20 0 BHADMO C[C@H]([NH2+]CC(F)(F)c1ccccc1)C1CCC1 ZINC000227904437 259634804 /nfs/dbraw/zinc/63/48/04/259634804.db2.gz UCDSZYUSUJWVEW-NSHDSACASA-N 1 1 239.309 3.557 20 0 BHADMO Oc1cccc(C[N@H+]2CCC[C@@H]3CCCC[C@H]32)c1 ZINC000228137315 387078253 /nfs/dbraw/zinc/07/82/53/387078253.db2.gz HNLOUPFYNSKSQU-GOEBONIOSA-N 1 1 245.366 3.547 20 0 BHADMO Cc1cc(C[N@@H+]2CCC[C@@H](C)[C@H]2C)cc(C)c1O ZINC000228160074 388770675 /nfs/dbraw/zinc/77/06/75/388770675.db2.gz HRJOCBXQZLELND-BXUZGUMPSA-N 1 1 247.382 3.629 20 0 BHADMO Cc1cc(C[N@@H+]2CCC[C@H](C)[C@H]2C)cc(C)c1O ZINC000228160083 388771427 /nfs/dbraw/zinc/77/14/27/388771427.db2.gz HRJOCBXQZLELND-SMDDNHRTSA-N 1 1 247.382 3.629 20 0 BHADMO Cc1cc(C[N@H+]2C[C@H](C)CC[C@H]2C)cc(C)c1O ZINC000228177123 259374590 /nfs/dbraw/zinc/37/45/90/259374590.db2.gz UZBXELNIKLXUKI-BXUZGUMPSA-N 1 1 247.382 3.629 20 0 BHADMO Cc1cc(C[N@H+]2C[C@@H](C)CC[C@H]2C)cc(C)c1O ZINC000228177132 259374554 /nfs/dbraw/zinc/37/45/54/259374554.db2.gz UZBXELNIKLXUKI-SMDDNHRTSA-N 1 1 247.382 3.629 20 0 BHADMO C[C@@H]([NH2+][C@@H](C)c1cscn1)c1ccsc1 ZINC000229128230 388780572 /nfs/dbraw/zinc/78/05/72/388780572.db2.gz JXLHWAPRSFDORK-BDAKNGLRSA-N 1 1 238.381 3.616 20 0 BHADMO C[C@H]([NH2+][C@@H](C)c1cscn1)c1ccsc1 ZINC000229128238 388780391 /nfs/dbraw/zinc/78/03/91/388780391.db2.gz JXLHWAPRSFDORK-IUCAKERBSA-N 1 1 238.381 3.616 20 0 BHADMO C[C@@H]([NH2+][C@H](C)c1cscn1)c1ccsc1 ZINC000229128248 388780318 /nfs/dbraw/zinc/78/03/18/388780318.db2.gz JXLHWAPRSFDORK-RKDXNWHRSA-N 1 1 238.381 3.616 20 0 BHADMO C[C@@H]([NH2+][C@@H](C)c1ccsc1)c1cscn1 ZINC000229128259 388779539 /nfs/dbraw/zinc/77/95/39/388779539.db2.gz JXLHWAPRSFDORK-DTWKUNHWSA-N 1 1 238.381 3.616 20 0 BHADMO Cc1cccc([C@@H](C)[NH2+][C@H](C)c2cscn2)c1 ZINC000229131808 358345664 /nfs/dbraw/zinc/34/56/64/358345664.db2.gz PXAISMYNQFGQHL-VXGBXAGGSA-N 1 1 246.379 3.863 20 0 BHADMO Cc1cccc([C@@H](C)[NH2+][C@@H](C)c2cscn2)c1 ZINC000229131816 358345883 /nfs/dbraw/zinc/34/58/83/358345883.db2.gz PXAISMYNQFGQHL-NEPJUHHUSA-N 1 1 246.379 3.863 20 0 BHADMO Clc1c[nH+]ccc1NCCC1=CCCC1 ZINC000229174305 388781862 /nfs/dbraw/zinc/78/18/62/388781862.db2.gz VCOFFYWNYFXJAQ-UHFFFAOYSA-N 1 1 222.719 3.647 20 0 BHADMO CSCCCCNc1[nH+]ccc2ccccc21 ZINC000229299915 352933947 /nfs/dbraw/zinc/93/39/47/352933947.db2.gz REIOLWSUBMPEOX-UHFFFAOYSA-N 1 1 246.379 3.790 20 0 BHADMO C[C@@H](c1ccc(F)cc1)[N@@H+](C)[C@@H]1C=CCCC1 ZINC000229497313 388791928 /nfs/dbraw/zinc/79/19/28/388791928.db2.gz LRHCAMNHZDYNDA-SWLSCSKDSA-N 1 1 233.330 3.927 20 0 BHADMO C[C@H](c1ccc(F)cc1)[N@@H+](C)[C@@H]1C=CCCC1 ZINC000229497330 388792237 /nfs/dbraw/zinc/79/22/37/388792237.db2.gz LRHCAMNHZDYNDA-IUODEOHRSA-N 1 1 233.330 3.927 20 0 BHADMO CSCCCCCNc1[nH]c2ccccc2[nH+]1 ZINC000229570751 384377222 /nfs/dbraw/zinc/37/72/22/384377222.db2.gz ISSADSLZMSKNIE-UHFFFAOYSA-N 1 1 249.383 3.508 20 0 BHADMO c1ccc([C@@H]2CCC[N@H+]2[C@@H]2C=CCCC2)cc1 ZINC000229714859 372184603 /nfs/dbraw/zinc/18/46/03/372184603.db2.gz AHUWYSKSRZTDSF-CVEARBPZSA-N 1 1 227.351 3.932 20 0 BHADMO c1ccc([C@H]2CCC[N@H+]2[C@@H]2C=CCCC2)cc1 ZINC000229714873 372184097 /nfs/dbraw/zinc/18/40/97/372184097.db2.gz AHUWYSKSRZTDSF-HZPDHXFCSA-N 1 1 227.351 3.932 20 0 BHADMO C[N@@H+]([C@H]1CCc2ccccc21)[C@@H]1C=CCCC1 ZINC000229715170 372184454 /nfs/dbraw/zinc/18/44/54/372184454.db2.gz JGHAETURACUPES-ZBFHGGJFSA-N 1 1 227.351 3.714 20 0 BHADMO CCc1ccc(CNc2cc(C)cc[nH+]2)s1 ZINC000230146629 136227982 /nfs/dbraw/zinc/22/79/82/136227982.db2.gz FPJJZTBHLBAMAY-UHFFFAOYSA-N 1 1 232.352 3.626 20 0 BHADMO CCc1ccc(CNc2ccc(C)c[nH+]2)s1 ZINC000230899723 398182290 /nfs/dbraw/zinc/18/22/90/398182290.db2.gz WNOPESAWXQYZBO-UHFFFAOYSA-N 1 1 232.352 3.626 20 0 BHADMO Cc1ccc(NC[C@@H]2CCC[C@@H](C)C2)[nH+]c1 ZINC000230900835 641115936 /nfs/dbraw/zinc/11/59/36/641115936.db2.gz ZEECZFHJXQSRFZ-DGCLKSJQSA-N 1 1 218.344 3.628 20 0 BHADMO Cc1ccc(NC[C@H]2CCC[C@@H](C)C2)[nH+]c1 ZINC000230900839 635493978 /nfs/dbraw/zinc/49/39/78/635493978.db2.gz ZEECZFHJXQSRFZ-YPMHNXCESA-N 1 1 218.344 3.628 20 0 BHADMO Cc1ccc(NC[C@@H]2CCC[C@H](C)C2)[nH+]c1 ZINC000230900842 641115925 /nfs/dbraw/zinc/11/59/25/641115925.db2.gz ZEECZFHJXQSRFZ-WCQYABFASA-N 1 1 218.344 3.628 20 0 BHADMO Cc1ccc(NC[C@H]2CCC[C@H](C)C2)[nH+]c1 ZINC000230900846 641114919 /nfs/dbraw/zinc/11/49/19/641114919.db2.gz ZEECZFHJXQSRFZ-AAEUAGOBSA-N 1 1 218.344 3.628 20 0 BHADMO CCC(=O)CCC[N@@H+](C)[C@@H](C)c1cccs1 ZINC000232843145 168197743 /nfs/dbraw/zinc/19/77/43/168197743.db2.gz LRSZMQZBWRPGLO-NSHDSACASA-N 1 1 239.384 3.500 20 0 BHADMO CCC(=O)CCC[N@@H+](C)[C@H](C)c1cccs1 ZINC000232844091 168198170 /nfs/dbraw/zinc/19/81/70/168198170.db2.gz LRSZMQZBWRPGLO-LLVKDONJSA-N 1 1 239.384 3.500 20 0 BHADMO CCC(=O)CCC[N@@H+](CC(C)C)C1CCCC1 ZINC000232845408 357685024 /nfs/dbraw/zinc/68/50/24/357685024.db2.gz WKZZLLBBYDJZBO-UHFFFAOYSA-N 1 1 239.403 3.646 20 0 BHADMO CCC(=O)CCC[N@@H+](Cc1ccccc1)C(C)C ZINC000232847938 363386268 /nfs/dbraw/zinc/38/62/68/363386268.db2.gz ZNWHXQWFRRLEJA-UHFFFAOYSA-N 1 1 247.382 3.656 20 0 BHADMO CC1(C[NH2+]CC(F)(F)c2ccccc2)CCC1 ZINC000232854678 634391364 /nfs/dbraw/zinc/39/13/64/634391364.db2.gz RHAGUCHRBHRBMS-UHFFFAOYSA-N 1 1 239.309 3.558 20 0 BHADMO CCCC[N@@H+](C)Cc1ccc(Cl)nc1Cl ZINC000232970921 642637168 /nfs/dbraw/zinc/63/71/68/642637168.db2.gz XPEUIRWOJYUCIA-UHFFFAOYSA-N 1 1 247.169 3.620 20 0 BHADMO CCCC[N@H+](C)Cc1ccc(Cl)nc1Cl ZINC000232970921 642637163 /nfs/dbraw/zinc/63/71/63/642637163.db2.gz XPEUIRWOJYUCIA-UHFFFAOYSA-N 1 1 247.169 3.620 20 0 BHADMO CCCCC[N@@H+](CCCC(=O)CC)C(C)C ZINC000232972348 388860604 /nfs/dbraw/zinc/86/06/04/388860604.db2.gz QIDJVEPEFXNQNF-UHFFFAOYSA-N 1 1 227.392 3.646 20 0 BHADMO CCC[N@@H+](CC)Cc1ccc(Cl)nc1Cl ZINC000233018579 642642170 /nfs/dbraw/zinc/64/21/70/642642170.db2.gz TXRHLHMJLWOQFI-UHFFFAOYSA-N 1 1 247.169 3.620 20 0 BHADMO CCC(C)(C)CNc1cc[nH+]cc1Cl ZINC000233034561 535354294 /nfs/dbraw/zinc/35/42/94/535354294.db2.gz KZRCNELSEVRBRC-UHFFFAOYSA-N 1 1 212.724 3.583 20 0 BHADMO CCCc1[nH+]ccn1Cc1ccc(C)cc1Cl ZINC000233395826 388346215 /nfs/dbraw/zinc/34/62/15/388346215.db2.gz NHKLRWMQADEIEA-UHFFFAOYSA-N 1 1 248.757 3.846 20 0 BHADMO CC[N@@H+](Cc1ccc(Cl)nc1Cl)C(C)C ZINC000233470454 363404035 /nfs/dbraw/zinc/40/40/35/363404035.db2.gz NLJXUUPFCQIZCU-UHFFFAOYSA-N 1 1 247.169 3.619 20 0 BHADMO CC[C@@H](C)[N@@H+](C)Cc1ccc(Cl)nc1Cl ZINC000233851526 642701791 /nfs/dbraw/zinc/70/17/91/642701791.db2.gz SIYWCIZCWHDXTA-MRVPVSSYSA-N 1 1 247.169 3.619 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1ccc(Cl)nc1Cl ZINC000233978540 643142383 /nfs/dbraw/zinc/14/23/83/643142383.db2.gz SIYWCIZCWHDXTA-QMMMGPOBSA-N 1 1 247.169 3.619 20 0 BHADMO CSC1(CNc2[nH+]ccc3ccccc32)CC1 ZINC000235176941 344835426 /nfs/dbraw/zinc/83/54/26/344835426.db2.gz YLTJDRUUKIKGOK-UHFFFAOYSA-N 1 1 244.363 3.542 20 0 BHADMO Cc1[nH+]cn(Cc2ccc(C)cc2Cl)c1C ZINC000235882214 387863997 /nfs/dbraw/zinc/86/39/97/387863997.db2.gz SFGWNDXCSXQCMB-UHFFFAOYSA-N 1 1 234.730 3.510 20 0 BHADMO CC(C)(C)CC[N@H+]1CC[C@@H](Nc2ccccc2)C1 ZINC000236607633 325321086 /nfs/dbraw/zinc/32/10/86/325321086.db2.gz UEFKHNFIFGOQGG-OAHLLOKOSA-N 1 1 246.398 3.609 20 0 BHADMO CC(C)(C)CC[N@H+]1CC[C@H](Nc2ccccc2)C1 ZINC000236607662 325321014 /nfs/dbraw/zinc/32/10/14/325321014.db2.gz UEFKHNFIFGOQGG-HNNXBMFYSA-N 1 1 246.398 3.609 20 0 BHADMO CC(C)C[C@@H]([NH2+]Cc1cocn1)c1ccccc1 ZINC000236625892 192089252 /nfs/dbraw/zinc/08/92/52/192089252.db2.gz YPYFPQTXGVDIPR-OAHLLOKOSA-N 1 1 244.338 3.552 20 0 BHADMO CC(C)C[C@H]([NH2+]Cc1cocn1)c1ccccc1 ZINC000236651916 188259141 /nfs/dbraw/zinc/25/91/41/188259141.db2.gz YPYFPQTXGVDIPR-HNNXBMFYSA-N 1 1 244.338 3.552 20 0 BHADMO Cc1cc[nH+]c(NCc2ccc([C@H]3C[C@H]3C)o2)c1 ZINC000237364796 387925086 /nfs/dbraw/zinc/92/50/86/387925086.db2.gz WNXXPNJWPADHRR-YPMHNXCESA-N 1 1 242.322 3.719 20 0 BHADMO Cc1cccc(NCc2ccc([C@H]3C[C@H]3C)o2)[nH+]1 ZINC000237365147 179149692 /nfs/dbraw/zinc/14/96/92/179149692.db2.gz BGLRWSNCQPXXFH-MFKMUULPSA-N 1 1 242.322 3.719 20 0 BHADMO Cc1ccc[nH+]c1NCc1ccc([C@H]2C[C@H]2C)o1 ZINC000237365441 358941695 /nfs/dbraw/zinc/94/16/95/358941695.db2.gz GAARXTOCBYOWEH-YPMHNXCESA-N 1 1 242.322 3.719 20 0 BHADMO Cc1ccc(N[C@@H](C)Cc2ccccc2F)[nH+]c1 ZINC000237375906 388394318 /nfs/dbraw/zinc/39/43/18/388394318.db2.gz BGWCXVRRJUOKCV-LBPRGKRZSA-N 1 1 244.313 3.572 20 0 BHADMO Cc1ccc(NC[C@H](C)c2ccc(F)cc2)[nH+]c1 ZINC000237445671 343139921 /nfs/dbraw/zinc/13/99/21/343139921.db2.gz UDLYDEJPNAQSOZ-LBPRGKRZSA-N 1 1 244.313 3.745 20 0 BHADMO Cc1cc[nH+]c(NCc2ccc([C@@H]3C[C@H]3C)o2)c1 ZINC000237462744 136272181 /nfs/dbraw/zinc/27/21/81/136272181.db2.gz WNXXPNJWPADHRR-DGCLKSJQSA-N 1 1 242.322 3.719 20 0 BHADMO Cc1cccc(NCc2ccc([C@@H]3C[C@H]3C)o2)[nH+]1 ZINC000237463016 136272340 /nfs/dbraw/zinc/27/23/40/136272340.db2.gz BGLRWSNCQPXXFH-ZWNOBZJWSA-N 1 1 242.322 3.719 20 0 BHADMO Cc1ccc[nH+]c1NCc1ccc([C@@H]2C[C@H]2C)o1 ZINC000237463252 135071182 /nfs/dbraw/zinc/07/11/82/135071182.db2.gz GAARXTOCBYOWEH-DGCLKSJQSA-N 1 1 242.322 3.719 20 0 BHADMO Cc1cc[nH+]c(NCc2ccc([C@H]3C[C@@H]3C)o2)c1 ZINC000237567923 387926724 /nfs/dbraw/zinc/92/67/24/387926724.db2.gz WNXXPNJWPADHRR-AAEUAGOBSA-N 1 1 242.322 3.719 20 0 BHADMO Cc1cccc(NCc2ccc([C@H]3C[C@@H]3C)o2)[nH+]1 ZINC000237568226 387926441 /nfs/dbraw/zinc/92/64/41/387926441.db2.gz BGLRWSNCQPXXFH-GWCFXTLKSA-N 1 1 242.322 3.719 20 0 BHADMO Cc1ccc[nH+]c1NCc1ccc([C@H]2C[C@@H]2C)o1 ZINC000237568470 134845867 /nfs/dbraw/zinc/84/58/67/134845867.db2.gz GAARXTOCBYOWEH-AAEUAGOBSA-N 1 1 242.322 3.719 20 0 BHADMO Cc1ccc(N[C@H](C)Cc2ccccc2F)[nH+]c1 ZINC000237570940 388397202 /nfs/dbraw/zinc/39/72/02/388397202.db2.gz BGWCXVRRJUOKCV-GFCCVEGCSA-N 1 1 244.313 3.572 20 0 BHADMO Cc1ccc(NC[C@@H](C)c2ccc(F)cc2)[nH+]c1 ZINC000237609988 343157625 /nfs/dbraw/zinc/15/76/25/343157625.db2.gz UDLYDEJPNAQSOZ-GFCCVEGCSA-N 1 1 244.313 3.745 20 0 BHADMO Cc1cc[nH+]c(NCc2ccc([C@@H]3C[C@@H]3C)o2)c1 ZINC000237663219 398112706 /nfs/dbraw/zinc/11/27/06/398112706.db2.gz WNXXPNJWPADHRR-WCQYABFASA-N 1 1 242.322 3.719 20 0 BHADMO Cc1cccc(NCc2ccc([C@@H]3C[C@@H]3C)o2)[nH+]1 ZINC000237663463 398112995 /nfs/dbraw/zinc/11/29/95/398112995.db2.gz BGLRWSNCQPXXFH-GXFFZTMASA-N 1 1 242.322 3.719 20 0 BHADMO Cc1ccc[nH+]c1NCc1ccc([C@@H]2C[C@@H]2C)o1 ZINC000237663666 398112484 /nfs/dbraw/zinc/11/24/84/398112484.db2.gz GAARXTOCBYOWEH-WCQYABFASA-N 1 1 242.322 3.719 20 0 BHADMO Cc1ccc(NCc2c(C)cc(C)cc2C)[nH+]c1 ZINC000237669106 642731629 /nfs/dbraw/zinc/73/16/29/642731629.db2.gz JXTGBDWSROJXIF-UHFFFAOYSA-N 1 1 240.350 3.927 20 0 BHADMO Cc1ccc(NCc2cc(C)c(C)cc2C)[nH+]c1 ZINC000237670032 635616674 /nfs/dbraw/zinc/61/66/74/635616674.db2.gz XYYDPRDTJGEQQE-UHFFFAOYSA-N 1 1 240.350 3.927 20 0 BHADMO Cc1ccc(NCc2ccc(C)cc2C)[nH+]c1 ZINC000237672623 635616880 /nfs/dbraw/zinc/61/68/80/635616880.db2.gz SQBCFDYPEJSZEH-UHFFFAOYSA-N 1 1 226.323 3.619 20 0 BHADMO Cc1ccc(CNc2[nH+]cccc2C)c(C)c1 ZINC000237754969 388398287 /nfs/dbraw/zinc/39/82/87/388398287.db2.gz LGGVDSZVDNTPFM-UHFFFAOYSA-N 1 1 226.323 3.619 20 0 BHADMO Cc1ccc[nH+]c1NCc1cc(C)c(C)cc1C ZINC000237820629 343213684 /nfs/dbraw/zinc/21/36/84/343213684.db2.gz CWKMVRCFJMFKON-UHFFFAOYSA-N 1 1 240.350 3.927 20 0 BHADMO Cn1cccc1[C@H]1CCCC[N@H+]1[C@@H]1C=CCCC1 ZINC000245411390 388576793 /nfs/dbraw/zinc/57/67/93/388576793.db2.gz WRBGKXKZIYVDSW-GDBMZVCRSA-N 1 1 244.382 3.661 20 0 BHADMO Cn1cccc1[C@@H]1CCCC[N@H+]1[C@@H]1C=CCCC1 ZINC000245411391 388576318 /nfs/dbraw/zinc/57/63/18/388576318.db2.gz WRBGKXKZIYVDSW-ZBFHGGJFSA-N 1 1 244.382 3.661 20 0 BHADMO CCSCC[C@@H](C)[N@@H+](C)[C@@H]1C=CCCC1 ZINC000245454777 387945476 /nfs/dbraw/zinc/94/54/76/387945476.db2.gz SFNLVKBYNVALBT-CHWSQXEVSA-N 1 1 227.417 3.559 20 0 BHADMO CCSCC[C@H](C)[N@@H+](C)[C@@H]1C=CCCC1 ZINC000245454778 387944757 /nfs/dbraw/zinc/94/47/57/387944757.db2.gz SFNLVKBYNVALBT-QWHCGFSZSA-N 1 1 227.417 3.559 20 0 BHADMO C[C@H](c1ncc(C(C)(C)C)o1)[N@H+]1CCC[C@H]1C ZINC000245468862 387950177 /nfs/dbraw/zinc/95/01/77/387950177.db2.gz LEQYUFKOXBNUHD-GHMZBOCLSA-N 1 1 236.359 3.517 20 0 BHADMO C[C@H](c1ncc(C(C)(C)C)o1)[N@H+]1CCC[C@@H]1C ZINC000245468863 387950096 /nfs/dbraw/zinc/95/00/96/387950096.db2.gz LEQYUFKOXBNUHD-WDEREUQCSA-N 1 1 236.359 3.517 20 0 BHADMO Cn1cccc1[C@H]1CCC[N@H+]1C[C@@H]1CC=CCC1 ZINC000245503011 411277279 /nfs/dbraw/zinc/27/72/79/411277279.db2.gz HLUHXLWIGTXUOC-GDBMZVCRSA-N 1 1 244.382 3.518 20 0 BHADMO Cn1cccc1[C@@H]1CCC[N@H+]1C[C@@H]1CC=CCC1 ZINC000245503013 411277347 /nfs/dbraw/zinc/27/73/47/411277347.db2.gz HLUHXLWIGTXUOC-ZBFHGGJFSA-N 1 1 244.382 3.518 20 0 BHADMO CC[N@@H+](Cc1ccc([C@@H]2C[C@H]2C)o1)C(C)C ZINC000245504370 398139762 /nfs/dbraw/zinc/13/97/62/398139762.db2.gz KBTFPAGFLPPCAK-DGCLKSJQSA-N 1 1 221.344 3.633 20 0 BHADMO CC[N@@H+](Cc1ccc([C@H]2C[C@H]2C)o1)C(C)C ZINC000245504371 398139789 /nfs/dbraw/zinc/13/97/89/398139789.db2.gz KBTFPAGFLPPCAK-YPMHNXCESA-N 1 1 221.344 3.633 20 0 BHADMO C[C@H](c1ccco1)[N@@H+](C)C[C@@H]1CC=CCC1 ZINC000245511546 388585616 /nfs/dbraw/zinc/58/56/16/388585616.db2.gz YMAHCTKFIAKMQR-CHWSQXEVSA-N 1 1 219.328 3.629 20 0 BHADMO C[C@@H](c1ccco1)[N@@H+](C)C[C@@H]1CC=CCC1 ZINC000245511547 388585680 /nfs/dbraw/zinc/58/56/80/388585680.db2.gz YMAHCTKFIAKMQR-QWHCGFSZSA-N 1 1 219.328 3.629 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1ccc([C@H]2C[C@@H]2C)o1 ZINC000245513151 388585782 /nfs/dbraw/zinc/58/57/82/388585782.db2.gz CAUPHKOMHCUNGN-GVXVVHGQSA-N 1 1 221.344 3.633 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1ccc([C@H]2C[C@H]2C)o1 ZINC000245513152 388585317 /nfs/dbraw/zinc/58/53/17/388585317.db2.gz CAUPHKOMHCUNGN-MDZLAQPJSA-N 1 1 221.344 3.633 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1ccc([C@@H]2C[C@H]2C)o1 ZINC000245513153 388585346 /nfs/dbraw/zinc/58/53/46/388585346.db2.gz CAUPHKOMHCUNGN-NTZNESFSSA-N 1 1 221.344 3.633 20 0 BHADMO C[C@H](C1CC1)[N@@H+](C)Cc1ccc([C@H]2C[C@H]2C)o1 ZINC000245514858 388585685 /nfs/dbraw/zinc/58/56/85/388585685.db2.gz GNQRDEPGPXIACL-GYSYKLTISA-N 1 1 233.355 3.633 20 0 BHADMO C[C@H](C1CC1)[N@@H+](C)Cc1ccc([C@@H]2C[C@H]2C)o1 ZINC000245514859 388585398 /nfs/dbraw/zinc/58/53/98/388585398.db2.gz GNQRDEPGPXIACL-JTNHKYCSSA-N 1 1 233.355 3.633 20 0 BHADMO C[C@H](c1ccccn1)[N@@H+](C)C[C@H]1CCC[C@@H](C)C1 ZINC000245529591 387955202 /nfs/dbraw/zinc/95/52/02/387955202.db2.gz FWCJWYMTCCTXNV-KFWWJZLASA-N 1 1 246.398 3.901 20 0 BHADMO C[C@H](c1ccccn1)[N@@H+](C)C[C@@H]1CCC[C@@H](C)C1 ZINC000245529596 387955900 /nfs/dbraw/zinc/95/59/00/387955900.db2.gz FWCJWYMTCCTXNV-RBSFLKMASA-N 1 1 246.398 3.901 20 0 BHADMO C[C@H](c1ccncc1)[N@@H+](C)C[C@H]1CCC[C@@H](C)C1 ZINC000245532885 387955394 /nfs/dbraw/zinc/95/53/94/387955394.db2.gz IMYGBSANIKSWFB-KFWWJZLASA-N 1 1 246.398 3.901 20 0 BHADMO C[C@H](c1ccncc1)[N@@H+](C)C[C@@H]1CCC[C@@H](C)C1 ZINC000245532888 387956045 /nfs/dbraw/zinc/95/60/45/387956045.db2.gz IMYGBSANIKSWFB-RBSFLKMASA-N 1 1 246.398 3.901 20 0 BHADMO C[C@H](c1nc2ccccc2o1)[N@H+]1CCC[C@H](C)C1 ZINC000245533721 387955480 /nfs/dbraw/zinc/95/54/80/387955480.db2.gz DOQVCEGFXVGXKH-NWDGAFQWSA-N 1 1 244.338 3.621 20 0 BHADMO C[C@H](c1nc2ccccc2o1)[N@H+]1CCC[C@@H](C)C1 ZINC000245533724 387956187 /nfs/dbraw/zinc/95/61/87/387956187.db2.gz DOQVCEGFXVGXKH-VXGBXAGGSA-N 1 1 244.338 3.621 20 0 BHADMO C[C@H](c1cccnc1)[N@@H+](C)C[C@H]1CCC[C@@H](C)C1 ZINC000245543658 387957715 /nfs/dbraw/zinc/95/77/15/387957715.db2.gz SVWHSYQSHHIPHN-KFWWJZLASA-N 1 1 246.398 3.901 20 0 BHADMO C[C@H](c1cccnc1)[N@@H+](C)C[C@@H]1CCC[C@@H](C)C1 ZINC000245543660 387957255 /nfs/dbraw/zinc/95/72/55/387957255.db2.gz SVWHSYQSHHIPHN-RBSFLKMASA-N 1 1 246.398 3.901 20 0 BHADMO Cc1cccnc1C[N@H+]1[C@H](C)C[C@H]2CCCC[C@H]21 ZINC000245544022 388588421 /nfs/dbraw/zinc/58/84/21/388588421.db2.gz TXNLKTGLFFGFQU-IIAWOOMASA-N 1 1 244.382 3.543 20 0 BHADMO Cc1cccnc1C[N@H+]1[C@H](C)C[C@@H]2CCCC[C@H]21 ZINC000245544024 388588733 /nfs/dbraw/zinc/58/87/33/388588733.db2.gz TXNLKTGLFFGFQU-IJEWVQPXSA-N 1 1 244.382 3.543 20 0 BHADMO Cc1cccnc1C[N@H+]1[C@H](C)C[C@@H]2CCCC[C@@H]21 ZINC000245544026 388588547 /nfs/dbraw/zinc/58/85/47/388588547.db2.gz TXNLKTGLFFGFQU-YCPHGPKFSA-N 1 1 244.382 3.543 20 0 BHADMO C[C@H](c1nc2ccccc2o1)[N@H+]1CC[C@@H](C)[C@@H]1C ZINC000245544633 388588095 /nfs/dbraw/zinc/58/80/95/388588095.db2.gz LHLVNMCHWQRGND-GRYCIOLGSA-N 1 1 244.338 3.619 20 0 BHADMO C[C@H](c1nc2ccccc2o1)[N@H+]1CC[C@@H](C)[C@H]1C ZINC000245544636 388588222 /nfs/dbraw/zinc/58/82/22/388588222.db2.gz LHLVNMCHWQRGND-IJLUTSLNSA-N 1 1 244.338 3.619 20 0 BHADMO C[C@@H](c1nc2ccccc2o1)[N@H+]1CC[C@@H](C)[C@@H]1C ZINC000245544638 388588431 /nfs/dbraw/zinc/58/84/31/388588431.db2.gz LHLVNMCHWQRGND-WOPDTQHZSA-N 1 1 244.338 3.619 20 0 BHADMO CC[C@H]1CC[N@H+]([C@H](C)c2nc3ccccc3o2)C1 ZINC000245551672 388589217 /nfs/dbraw/zinc/58/92/17/388589217.db2.gz PUBFRLUWMIGDBN-NEPJUHHUSA-N 1 1 244.338 3.621 20 0 BHADMO CC[C@@H]1CC[N@H+]([C@H](C)c2nc3ccccc3o2)C1 ZINC000245551676 388589107 /nfs/dbraw/zinc/58/91/07/388589107.db2.gz PUBFRLUWMIGDBN-VXGBXAGGSA-N 1 1 244.338 3.621 20 0 BHADMO CC[C@H](C)C[N@@H+](C)[C@H](C)c1nc2ccccc2o1 ZINC000245553111 388589901 /nfs/dbraw/zinc/58/99/01/388589901.db2.gz RBEBQXBCGNZBGS-NWDGAFQWSA-N 1 1 246.354 3.867 20 0 BHADMO CC[C@@H](C)C[N@@H+](C)[C@H](C)c1nc2ccccc2o1 ZINC000245553112 388589144 /nfs/dbraw/zinc/58/91/44/388589144.db2.gz RBEBQXBCGNZBGS-VXGBXAGGSA-N 1 1 246.354 3.867 20 0 BHADMO c1csc(C[N@H+]2CCC[C@H]3CCC[C@H]32)c1 ZINC000245553178 387960132 /nfs/dbraw/zinc/96/01/32/387960132.db2.gz FBBZXIDYSIAOGN-DGCLKSJQSA-N 1 1 221.369 3.513 20 0 BHADMO c1csc(C[N@H+]2CCC[C@@H]3CCC[C@H]32)c1 ZINC000245553179 134858320 /nfs/dbraw/zinc/85/83/20/134858320.db2.gz FBBZXIDYSIAOGN-WCQYABFASA-N 1 1 221.369 3.513 20 0 BHADMO c1cc(C[N@H+]2CCC[C@H]3CCC[C@H]32)cs1 ZINC000245564849 387961279 /nfs/dbraw/zinc/96/12/79/387961279.db2.gz RDVJSYLMUJBOLU-CHWSQXEVSA-N 1 1 221.369 3.513 20 0 BHADMO c1cc(C[N@H+]2CCC[C@@H]3CCC[C@H]32)cs1 ZINC000245564850 387962590 /nfs/dbraw/zinc/96/25/90/387962590.db2.gz RDVJSYLMUJBOLU-QWHCGFSZSA-N 1 1 221.369 3.513 20 0 BHADMO C[C@@H]1C[N@H+](C2CCC2)CC[C@H]1c1ccccc1 ZINC000245602340 349083570 /nfs/dbraw/zinc/08/35/70/349083570.db2.gz KYXUCPFUUIGEKZ-CZUORRHYSA-N 1 1 229.367 3.665 20 0 BHADMO C[C@H]1C[N@H+](C2CCC2)CC[C@H]1c1ccccc1 ZINC000245602343 349084059 /nfs/dbraw/zinc/08/40/59/349084059.db2.gz KYXUCPFUUIGEKZ-XJKSGUPXSA-N 1 1 229.367 3.665 20 0 BHADMO C[C@@H]1C[C@@H]2CCCC[C@H]2[N@H+]1Cc1cccc(O)c1 ZINC000245693285 388598585 /nfs/dbraw/zinc/59/85/85/388598585.db2.gz BTHUJJHDCHCHMD-IVMMDQJWSA-N 1 1 245.366 3.545 20 0 BHADMO C[C@@H]1C[C@H]2CCCC[C@H]2[N@H+]1Cc1cccc(O)c1 ZINC000245693288 388599076 /nfs/dbraw/zinc/59/90/76/388599076.db2.gz BTHUJJHDCHCHMD-XNRPHZJLSA-N 1 1 245.366 3.545 20 0 BHADMO C[C@H]1CC[N@@H+](Cc2ccco2)[C@@H](c2ccco2)C1 ZINC000245696476 387973049 /nfs/dbraw/zinc/97/30/49/387973049.db2.gz CJIBMCYQXPVGLF-GXTWGEPZSA-N 1 1 245.322 3.846 20 0 BHADMO C[C@@H]1CC[N@@H+](Cc2ccco2)[C@@H](c2ccco2)C1 ZINC000245696481 387973529 /nfs/dbraw/zinc/97/35/29/387973529.db2.gz CJIBMCYQXPVGLF-TZMCWYRMSA-N 1 1 245.322 3.846 20 0 BHADMO C[C@@H]1C[N@H+](C2CCCC2)[C@H]1c1ccccc1 ZINC000245713844 388600586 /nfs/dbraw/zinc/60/05/86/388600586.db2.gz ZYUQZPIGHGTGMU-IUODEOHRSA-N 1 1 215.340 3.622 20 0 BHADMO C[C@H]1C[N@H+](C2CCCC2)[C@H]1c1ccccc1 ZINC000245713848 388600715 /nfs/dbraw/zinc/60/07/15/388600715.db2.gz ZYUQZPIGHGTGMU-SWLSCSKDSA-N 1 1 215.340 3.622 20 0 BHADMO CC[C@@H](c1ccncc1)[N@@H+](C)[C@@H]1C=CCCC1 ZINC000245741634 387981272 /nfs/dbraw/zinc/98/12/72/387981272.db2.gz GFLFXDCBAHZVLJ-CABCVRRESA-N 1 1 230.355 3.573 20 0 BHADMO CC[C@H](c1ccncc1)[N@@H+](C)[C@@H]1C=CCCC1 ZINC000245741636 387980815 /nfs/dbraw/zinc/98/08/15/387980815.db2.gz GFLFXDCBAHZVLJ-HUUCEWRRSA-N 1 1 230.355 3.573 20 0 BHADMO CC[C@H](c1ccncc1)[N@H+](C)C[C@@H](C)CC ZINC000245741672 387980377 /nfs/dbraw/zinc/98/03/77/387980377.db2.gz GFWJZGGFOVMGBS-GXTWGEPZSA-N 1 1 220.360 3.511 20 0 BHADMO CC[C@@H](C)C[N@@H+](C)[C@H](CC)c1ccncc1 ZINC000245741674 387980335 /nfs/dbraw/zinc/98/03/35/387980335.db2.gz GFWJZGGFOVMGBS-TZMCWYRMSA-N 1 1 220.360 3.511 20 0 BHADMO C[C@@H]1C[N@@H+](Cc2ccsc2)[C@H]1c1ccccc1 ZINC000245757973 388603584 /nfs/dbraw/zinc/60/35/84/388603584.db2.gz PBZPKTQEQDRRJH-IUODEOHRSA-N 1 1 243.375 3.941 20 0 BHADMO C[C@H]1C[N@@H+](Cc2ccsc2)[C@H]1c1ccccc1 ZINC000245757975 388602812 /nfs/dbraw/zinc/60/28/12/388602812.db2.gz PBZPKTQEQDRRJH-SWLSCSKDSA-N 1 1 243.375 3.941 20 0 BHADMO C[C@@H]1C[N@@H+](Cc2cccs2)[C@H]1c1ccccc1 ZINC000245788141 388605351 /nfs/dbraw/zinc/60/53/51/388605351.db2.gz VOXLONFTKXLGFZ-IUODEOHRSA-N 1 1 243.375 3.941 20 0 BHADMO C[C@H]1C[N@@H+](Cc2cccs2)[C@H]1c1ccccc1 ZINC000245788148 388605346 /nfs/dbraw/zinc/60/53/46/388605346.db2.gz VOXLONFTKXLGFZ-SWLSCSKDSA-N 1 1 243.375 3.941 20 0 BHADMO Cc1ncccc1C[N@H+]1[C@H](C)C[C@@H]2CCCC[C@@H]21 ZINC000245790194 388605789 /nfs/dbraw/zinc/60/57/89/388605789.db2.gz VYNXLSDZHJKLNX-INWMFGNUSA-N 1 1 244.382 3.543 20 0 BHADMO Cc1ncccc1C[N@H+]1[C@H](C)C[C@@H]2CCCC[C@H]21 ZINC000245790197 388605368 /nfs/dbraw/zinc/60/53/68/388605368.db2.gz VYNXLSDZHJKLNX-IVMMDQJWSA-N 1 1 244.382 3.543 20 0 BHADMO Cc1ncccc1C[N@H+]1[C@H](C)C[C@H]2CCCC[C@H]21 ZINC000245790200 388605479 /nfs/dbraw/zinc/60/54/79/388605479.db2.gz VYNXLSDZHJKLNX-XNRPHZJLSA-N 1 1 244.382 3.543 20 0 BHADMO C[C@@H](c1cccc(O)c1)[N@@H+](C)C[C@@H]1CC=CCC1 ZINC000245810775 388606627 /nfs/dbraw/zinc/60/66/27/388606627.db2.gz ZIHLKEPJRBNRHU-UONOGXRCSA-N 1 1 245.366 3.741 20 0 BHADMO C[C@H](c1cccc(O)c1)[N@@H+](C)C[C@@H]1CC=CCC1 ZINC000245810777 388606435 /nfs/dbraw/zinc/60/64/35/388606435.db2.gz ZIHLKEPJRBNRHU-ZIAGYGMSSA-N 1 1 245.366 3.741 20 0 BHADMO CC[C@@H](C)[N@@H+](C)C[C@H](C)c1ccc(OC)cc1 ZINC000245843062 388607511 /nfs/dbraw/zinc/60/75/11/388607511.db2.gz KFKWZBRCWKNELT-QWHCGFSZSA-N 1 1 235.371 3.529 20 0 BHADMO CC[C@H](C)[N@@H+](C)C[C@H](C)c1ccc(OC)cc1 ZINC000245843068 388607516 /nfs/dbraw/zinc/60/75/16/388607516.db2.gz KFKWZBRCWKNELT-STQMWFEESA-N 1 1 235.371 3.529 20 0 BHADMO CCC[C@@H](C)C[N@H+]1CCC[C@H]1c1cccn1C ZINC000245843474 388607985 /nfs/dbraw/zinc/60/79/85/388607985.db2.gz KMPBMIZYDWABOZ-HIFRSBDPSA-N 1 1 234.387 3.598 20 0 BHADMO CCC[C@H](C)C[N@H+]1CCC[C@H]1c1cccn1C ZINC000245843479 388607391 /nfs/dbraw/zinc/60/73/91/388607391.db2.gz KMPBMIZYDWABOZ-ZFWWWQNUSA-N 1 1 234.387 3.598 20 0 BHADMO CCCO[C@@H]1CCC[N@@H+](C[C@H](C)CCC)CC1 ZINC000245845336 388607878 /nfs/dbraw/zinc/60/78/78/388607878.db2.gz KYFBSSZARRHKKP-HUUCEWRRSA-N 1 1 241.419 3.704 20 0 BHADMO CCCO[C@@H]1CCC[N@@H+](C[C@@H](C)CCC)CC1 ZINC000245845340 388607582 /nfs/dbraw/zinc/60/75/82/388607582.db2.gz KYFBSSZARRHKKP-LSDHHAIUSA-N 1 1 241.419 3.704 20 0 BHADMO CCC[C@H](C)C[N@H+]1CCC[C@H]1c1cccc(C)n1 ZINC000245852012 388607606 /nfs/dbraw/zinc/60/76/06/388607606.db2.gz MPBCOGQWBSNIIX-BBRMVZONSA-N 1 1 246.398 3.963 20 0 BHADMO CCC[C@@H](C)C[N@H+]1CCC[C@H]1c1cccc(C)n1 ZINC000245852018 388607890 /nfs/dbraw/zinc/60/78/90/388607890.db2.gz MPBCOGQWBSNIIX-CJNGLKHVSA-N 1 1 246.398 3.963 20 0 BHADMO CC[C@@H](C)C[N@@H+](C)[C@H](C)c1cccs1 ZINC000245860159 388607436 /nfs/dbraw/zinc/60/74/36/388607436.db2.gz HTCYRBPPABDAPB-GHMZBOCLSA-N 1 1 211.374 3.787 20 0 BHADMO CC[C@H](C)C[N@@H+](C)[C@H](C)c1cccs1 ZINC000245860170 388607323 /nfs/dbraw/zinc/60/73/23/388607323.db2.gz HTCYRBPPABDAPB-WDEREUQCSA-N 1 1 211.374 3.787 20 0 BHADMO CCC[C@H](C)C[N@@H+](C)[C@H](C)c1ccco1 ZINC000245866531 388607521 /nfs/dbraw/zinc/60/75/21/388607521.db2.gz QIUFLRREPLFCGO-NWDGAFQWSA-N 1 1 209.333 3.709 20 0 BHADMO CCC[C@@H](C)C[N@@H+](C)[C@H](C)c1ccco1 ZINC000245866532 388607246 /nfs/dbraw/zinc/60/72/46/388607246.db2.gz QIUFLRREPLFCGO-VXGBXAGGSA-N 1 1 209.333 3.709 20 0 BHADMO COc1ccc([C@H](C)C[N@@H+](C)[C@H](C)C2CC2)cc1 ZINC000245871533 349090910 /nfs/dbraw/zinc/09/09/10/349090910.db2.gz RTEZHNZDEUCGTA-CHWSQXEVSA-N 1 1 247.382 3.529 20 0 BHADMO COc1ccc([C@@H](C)C[N@@H+](C)[C@H](C)C2CC2)cc1 ZINC000245871537 349090904 /nfs/dbraw/zinc/09/09/04/349090904.db2.gz RTEZHNZDEUCGTA-QWHCGFSZSA-N 1 1 247.382 3.529 20 0 BHADMO Cc1[nH]ncc1[C@H](C)[NH2+][C@H]1CCC(C)(C)C[C@H]1C ZINC000245879092 537955384 /nfs/dbraw/zinc/95/53/84/537955384.db2.gz AWHCISQWUDGCHH-SUNKGSAMSA-N 1 1 249.402 3.584 20 0 BHADMO Cc1[nH]ncc1[C@H](C)[NH2+][C@@H]1CCC(C)(C)C[C@H]1C ZINC000245879096 537956441 /nfs/dbraw/zinc/95/64/41/537956441.db2.gz AWHCISQWUDGCHH-UHIISALHSA-N 1 1 249.402 3.584 20 0 BHADMO CC[C@@H](C)C[N@@H+](CC)[C@H](C)c1ccccn1 ZINC000245913301 387992551 /nfs/dbraw/zinc/99/25/51/387992551.db2.gz VTNWSWAHGJBFPW-CHWSQXEVSA-N 1 1 220.360 3.511 20 0 BHADMO CC[C@H](C)C[N@@H+](CC)[C@H](C)c1ccccn1 ZINC000245913304 387992705 /nfs/dbraw/zinc/99/27/05/387992705.db2.gz VTNWSWAHGJBFPW-QWHCGFSZSA-N 1 1 220.360 3.511 20 0 BHADMO Cc1[nH]ncc1[C@H](C)[NH2+][C@@H]1CCC[C@@H](C(C)C)C1 ZINC000245934405 537958128 /nfs/dbraw/zinc/95/81/28/537958128.db2.gz IUAOWQRDHKDAMT-IACUBPJLSA-N 1 1 249.402 3.584 20 0 BHADMO Cc1[nH]ncc1[C@H](C)[NH2+][C@H]1CCC[C@@H](C(C)C)C1 ZINC000245934409 537957424 /nfs/dbraw/zinc/95/74/24/537957424.db2.gz IUAOWQRDHKDAMT-YUTCNCBUSA-N 1 1 249.402 3.584 20 0 BHADMO CCCC[C@@H]1CCC[C@@H]1[NH2+][C@H](C)c1cn[nH]c1C ZINC000246012265 537962365 /nfs/dbraw/zinc/96/23/65/537962365.db2.gz TYBSQZPFQIIJMB-KYOSRNDESA-N 1 1 249.402 3.728 20 0 BHADMO CCCC[C@@H]1CCC[C@H]1[NH2+][C@H](C)c1cn[nH]c1C ZINC000246012267 537962690 /nfs/dbraw/zinc/96/26/90/537962690.db2.gz TYBSQZPFQIIJMB-UXIGCNINSA-N 1 1 249.402 3.728 20 0 BHADMO CC(C)C[C@@H]1CC[N@H+]([C@H](C)c2ccccn2)C1 ZINC000246098536 388008798 /nfs/dbraw/zinc/00/87/98/388008798.db2.gz AQIMCNWSWFICDV-KGLIPLIRSA-N 1 1 232.371 3.511 20 0 BHADMO CC(C)C[C@H]1CC[N@H+]([C@H](C)c2ccccn2)C1 ZINC000246098549 388008119 /nfs/dbraw/zinc/00/81/19/388008119.db2.gz AQIMCNWSWFICDV-ZIAGYGMSSA-N 1 1 232.371 3.511 20 0 BHADMO CC[C@H]1CCC[N@H+]([C@H](C)c2ccccn2)CC1 ZINC000246111722 388010211 /nfs/dbraw/zinc/01/02/11/388010211.db2.gz CDIUVDPOBQTBCL-KGLIPLIRSA-N 1 1 232.371 3.655 20 0 BHADMO CC[C@@H]1CCC[N@H+]([C@H](C)c2ccccn2)CC1 ZINC000246111733 388010367 /nfs/dbraw/zinc/01/03/67/388010367.db2.gz CDIUVDPOBQTBCL-ZIAGYGMSSA-N 1 1 232.371 3.655 20 0 BHADMO C[C@H](c1ccco1)[N@@H+](C1CC1)[C@@H]1C=CCCC1 ZINC000246117036 388617572 /nfs/dbraw/zinc/61/75/72/388617572.db2.gz UHGCWNOKRITRHV-CHWSQXEVSA-N 1 1 231.339 3.914 20 0 BHADMO C[C@@H](c1ccco1)[N@@H+](C1CC1)[C@@H]1C=CCCC1 ZINC000246117042 388618075 /nfs/dbraw/zinc/61/80/75/388618075.db2.gz UHGCWNOKRITRHV-QWHCGFSZSA-N 1 1 231.339 3.914 20 0 BHADMO CC[C@H](C)C[N@@H+](C)[C@H](C)c1sc(C)nc1C ZINC000246147640 388013719 /nfs/dbraw/zinc/01/37/19/388013719.db2.gz BTDDKBWHNAEYPZ-GXSJLCMTSA-N 1 1 240.416 3.799 20 0 BHADMO CC[C@@H](C)C[N@@H+](C)[C@H](C)c1sc(C)nc1C ZINC000246147649 535494930 /nfs/dbraw/zinc/49/49/30/535494930.db2.gz BTDDKBWHNAEYPZ-MWLCHTKSSA-N 1 1 240.416 3.799 20 0 BHADMO C[C@@H](c1cccs1)[N@@H+](C)[C@@H]1C=CCCC1 ZINC000246149017 374178607 /nfs/dbraw/zinc/17/86/07/374178607.db2.gz SQVDOBGWIXJJFM-NWDGAFQWSA-N 1 1 221.369 3.850 20 0 BHADMO C[C@H](c1cccs1)[N@@H+](C)[C@@H]1C=CCCC1 ZINC000246149024 374178321 /nfs/dbraw/zinc/17/83/21/374178321.db2.gz SQVDOBGWIXJJFM-VXGBXAGGSA-N 1 1 221.369 3.850 20 0 BHADMO c1csc([C@H]2CCC[N@H+]2[C@@H]2C=CCCC2)c1 ZINC000246153449 388619850 /nfs/dbraw/zinc/61/98/50/388619850.db2.gz UCMMSNXORJLDKC-CHWSQXEVSA-N 1 1 233.380 3.994 20 0 BHADMO c1csc([C@@H]2CCC[N@H+]2[C@@H]2C=CCCC2)c1 ZINC000246153458 388620265 /nfs/dbraw/zinc/62/02/65/388620265.db2.gz UCMMSNXORJLDKC-OLZOCXBDSA-N 1 1 233.380 3.994 20 0 BHADMO COc1ccc([C@H](C)[N@@H+](C)[C@@H]2C=CCCC2)cc1 ZINC000246275101 388627554 /nfs/dbraw/zinc/62/75/54/388627554.db2.gz RHYJRVGUTNTEBJ-DZGCQCFKSA-N 1 1 245.366 3.797 20 0 BHADMO COc1ccc([C@@H](C)[N@@H+](C)[C@@H]2C=CCCC2)cc1 ZINC000246275120 388627689 /nfs/dbraw/zinc/62/76/89/388627689.db2.gz RHYJRVGUTNTEBJ-UKRRQHHQSA-N 1 1 245.366 3.797 20 0 BHADMO CC[C@@H](C)C[N@H+]1CCCC[C@H]1c1cccn1C ZINC000246295546 388628951 /nfs/dbraw/zinc/62/89/51/388628951.db2.gz UXHOGGNYMJSLKP-HIFRSBDPSA-N 1 1 234.387 3.598 20 0 BHADMO CC[C@H](C)C[N@H+]1CCCC[C@H]1c1cccn1C ZINC000246295561 388628800 /nfs/dbraw/zinc/62/88/00/388628800.db2.gz UXHOGGNYMJSLKP-ZFWWWQNUSA-N 1 1 234.387 3.598 20 0 BHADMO C[C@H](c1ccccn1)[N@H+]1CC[C@@H](C)C[C@H](C)C1 ZINC000246544116 359144755 /nfs/dbraw/zinc/14/47/55/359144755.db2.gz DDIXFZICYVJLNR-HZSPNIEDSA-N 1 1 232.371 3.511 20 0 BHADMO C[C@H](c1ccccn1)[N@H+]1CC[C@@H](C)C[C@@H](C)C1 ZINC000246544124 359144632 /nfs/dbraw/zinc/14/46/32/359144632.db2.gz DDIXFZICYVJLNR-MGPQQGTHSA-N 1 1 232.371 3.511 20 0 BHADMO C[C@@H](c1ccccn1)[N@H+]1CC[C@@H](C)C[C@H](C)C1 ZINC000246544133 359145758 /nfs/dbraw/zinc/14/57/58/359145758.db2.gz DDIXFZICYVJLNR-RDBSUJKOSA-N 1 1 232.371 3.511 20 0 BHADMO CCC[C@H]1CCC[N@H+]([C@H](C)c2ccccn2)C1 ZINC000246632798 359153445 /nfs/dbraw/zinc/15/34/45/359153445.db2.gz SXIJDTLLWBZDNF-KGLIPLIRSA-N 1 1 232.371 3.655 20 0 BHADMO CCC[C@@H]1CCC[N@H+]([C@H](C)c2ccccn2)C1 ZINC000246632806 359153534 /nfs/dbraw/zinc/15/35/34/359153534.db2.gz SXIJDTLLWBZDNF-ZIAGYGMSSA-N 1 1 232.371 3.655 20 0 BHADMO CC[N@@H+]([C@H](C)c1cccc(O)c1)[C@H]1C=CCCC1 ZINC000246879811 388654295 /nfs/dbraw/zinc/65/42/95/388654295.db2.gz DKHQSVWXJSWNGL-HIFRSBDPSA-N 1 1 245.366 3.884 20 0 BHADMO CC[N@@H+]([C@H](C)c1cccc(O)c1)[C@@H]1C=CCCC1 ZINC000246879836 388654098 /nfs/dbraw/zinc/65/40/98/388654098.db2.gz DKHQSVWXJSWNGL-UKRRQHHQSA-N 1 1 245.366 3.884 20 0 BHADMO CC(C)[N@H+]1CC[C@@H](c2ccccc2)[C@@H](C)C1 ZINC000246993955 343016567 /nfs/dbraw/zinc/01/65/67/343016567.db2.gz STQFVGJGEHWGAA-DZGCQCFKSA-N 1 1 217.356 3.520 20 0 BHADMO CC(C)[N@H+]1CC[C@@H](c2ccccc2)[C@H](C)C1 ZINC000246993979 343016577 /nfs/dbraw/zinc/01/65/77/343016577.db2.gz STQFVGJGEHWGAA-UKRRQHHQSA-N 1 1 217.356 3.520 20 0 BHADMO C[C@H](C1CC1)[N@H+](C)C[C@@H](C)c1ccccc1 ZINC000247027019 349110924 /nfs/dbraw/zinc/11/09/24/349110924.db2.gz ICCJMIPMVWFQAM-CHWSQXEVSA-N 1 1 217.356 3.520 20 0 BHADMO C[C@@H](C[N@@H+](C)[C@H](C)C1CC1)c1ccccc1 ZINC000247027042 349111086 /nfs/dbraw/zinc/11/10/86/349111086.db2.gz ICCJMIPMVWFQAM-QWHCGFSZSA-N 1 1 217.356 3.520 20 0 BHADMO CC[C@@H](C)[N@@H+](C)C[C@H](C)c1ccccc1 ZINC000247059373 388658624 /nfs/dbraw/zinc/65/86/24/388658624.db2.gz KAFBZTPFXDJITK-QWHCGFSZSA-N 1 1 205.345 3.520 20 0 BHADMO CC[C@H](C)[N@@H+](C)C[C@H](C)c1ccccc1 ZINC000247059400 388658471 /nfs/dbraw/zinc/65/84/71/388658471.db2.gz KAFBZTPFXDJITK-STQMWFEESA-N 1 1 205.345 3.520 20 0 BHADMO C[C@H](c1c(F)cccc1F)[N@H+]1CCC[C@H]1C ZINC000247193262 359199984 /nfs/dbraw/zinc/19/99/84/359199984.db2.gz BTENMRQIFBHTDZ-NXEZZACHSA-N 1 1 225.282 3.510 20 0 BHADMO C[C@H](c1c(F)cccc1F)[N@H+]1CCC[C@@H]1C ZINC000247193274 359200757 /nfs/dbraw/zinc/20/07/57/359200757.db2.gz BTENMRQIFBHTDZ-VHSXEESVSA-N 1 1 225.282 3.510 20 0 BHADMO CC[C@@H](c1ccccc1)[N@H+]1CCC[C@H]1C ZINC000247249407 388660433 /nfs/dbraw/zinc/66/04/33/388660433.db2.gz DVLPJEBCSMUYCE-OCCSQVGLSA-N 1 1 203.329 3.622 20 0 BHADMO CC[C@H](c1ccccc1)[N@H+]1CCC[C@H]1C ZINC000247249417 388660683 /nfs/dbraw/zinc/66/06/83/388660683.db2.gz DVLPJEBCSMUYCE-TZMCWYRMSA-N 1 1 203.329 3.622 20 0 BHADMO c1csc(CC[N@H+]2CCC[C@@H]3CCC[C@H]32)c1 ZINC000247263862 644627341 /nfs/dbraw/zinc/62/73/41/644627341.db2.gz FLTMFFKVXVIJQI-GXTWGEPZSA-N 1 1 235.396 3.555 20 0 BHADMO c1csc(CC[N@H+]2CCC[C@H]3CCC[C@H]32)c1 ZINC000247263872 644627815 /nfs/dbraw/zinc/62/78/15/644627815.db2.gz FLTMFFKVXVIJQI-TZMCWYRMSA-N 1 1 235.396 3.555 20 0 BHADMO CC[C@@H](C)[N@H+]1CCC[C@H]1c1cccs1 ZINC000247294944 359209035 /nfs/dbraw/zinc/20/90/35/359209035.db2.gz USGRCEBXOKKQOR-MNOVXSKESA-N 1 1 209.358 3.684 20 0 BHADMO CC[C@H](C)[N@H+]1CCC[C@H]1c1cccs1 ZINC000247294952 359209169 /nfs/dbraw/zinc/20/91/69/359209169.db2.gz USGRCEBXOKKQOR-QWRGUYRKSA-N 1 1 209.358 3.684 20 0 BHADMO CC[C@H]1C[N@H+]([C@H](C)c2ccccc2)CCS1 ZINC000247488561 388665146 /nfs/dbraw/zinc/66/51/46/388665146.db2.gz KTHZYQRKRSAEMG-OCCSQVGLSA-N 1 1 235.396 3.575 20 0 BHADMO CC[C@@H]1C[N@H+]([C@H](C)c2ccccc2)CCS1 ZINC000247489016 388665176 /nfs/dbraw/zinc/66/51/76/388665176.db2.gz KTHZYQRKRSAEMG-TZMCWYRMSA-N 1 1 235.396 3.575 20 0 BHADMO Cc1cccc([C@@H](C)[N@H+]2CCC[C@H]2C)c1 ZINC000247492191 411210292 /nfs/dbraw/zinc/21/02/92/411210292.db2.gz LAFBQIMDSPGFLO-CHWSQXEVSA-N 1 1 203.329 3.540 20 0 BHADMO Cc1cccc([C@H](C)[N@H+]2CCC[C@H]2C)c1 ZINC000247492207 411210324 /nfs/dbraw/zinc/21/03/24/411210324.db2.gz LAFBQIMDSPGFLO-OLZOCXBDSA-N 1 1 203.329 3.540 20 0 BHADMO C[C@H](c1cc(F)ccc1F)[N@H+]1CCC[C@H]1C ZINC000247527015 359231175 /nfs/dbraw/zinc/23/11/75/359231175.db2.gz NWFNINUDQWZCTO-NXEZZACHSA-N 1 1 225.282 3.510 20 0 BHADMO C[C@H](c1cc(F)ccc1F)[N@H+]1CCC[C@@H]1C ZINC000247527024 359231701 /nfs/dbraw/zinc/23/17/01/359231701.db2.gz NWFNINUDQWZCTO-VHSXEESVSA-N 1 1 225.282 3.510 20 0 BHADMO C[C@H](c1ccc(F)cc1F)[N@H+]1CCC[C@H]1C ZINC000247555197 359233749 /nfs/dbraw/zinc/23/37/49/359233749.db2.gz QHLFQOZKBFAGCO-NXEZZACHSA-N 1 1 225.282 3.510 20 0 BHADMO C[C@H](c1ccc(F)cc1F)[N@H+]1CCC[C@@H]1C ZINC000247555211 359234248 /nfs/dbraw/zinc/23/42/48/359234248.db2.gz QHLFQOZKBFAGCO-VHSXEESVSA-N 1 1 225.282 3.510 20 0 BHADMO Fc1ccccc1C[N@H+]1CCC[C@@H]2CCCC[C@@H]21 ZINC000247558749 388666714 /nfs/dbraw/zinc/66/67/14/388666714.db2.gz YBRGKWIRSJZWKQ-BBRMVZONSA-N 1 1 247.357 3.980 20 0 BHADMO Fc1ccccc1C[N@H+]1CCC[C@H]2CCCC[C@@H]21 ZINC000247558756 388666312 /nfs/dbraw/zinc/66/63/12/388666312.db2.gz YBRGKWIRSJZWKQ-CJNGLKHVSA-N 1 1 247.357 3.980 20 0 BHADMO Fc1ccccc1C[N@H+]1CCC[C@H]2CCCC[C@H]21 ZINC000247558762 388666653 /nfs/dbraw/zinc/66/66/53/388666653.db2.gz YBRGKWIRSJZWKQ-CZUORRHYSA-N 1 1 247.357 3.980 20 0 BHADMO Fc1ccccc1C[N@H+]1CCC[C@@H]2CCCC[C@H]21 ZINC000247558769 388666587 /nfs/dbraw/zinc/66/65/87/388666587.db2.gz YBRGKWIRSJZWKQ-XJKSGUPXSA-N 1 1 247.357 3.980 20 0 BHADMO CCS[C@@H]1CC[C@H]([N@@H+](C)[C@@H]2C=CCCC2)C1 ZINC000247560872 388666741 /nfs/dbraw/zinc/66/67/41/388666741.db2.gz QTRITKWXMJIIGP-HZSPNIEDSA-N 1 1 239.428 3.701 20 0 BHADMO CCS[C@@H]1CC[C@@H]([N@@H+](C)[C@@H]2C=CCCC2)C1 ZINC000247560875 388666412 /nfs/dbraw/zinc/66/64/12/388666412.db2.gz QTRITKWXMJIIGP-MGPQQGTHSA-N 1 1 239.428 3.701 20 0 BHADMO C[C@H](c1ccc(F)c(F)c1)[N@H+]1CCC[C@H]1C ZINC000247572660 359235297 /nfs/dbraw/zinc/23/52/97/359235297.db2.gz RYFVNZIWMSJTRW-NXEZZACHSA-N 1 1 225.282 3.510 20 0 BHADMO C[C@H](c1ccc(F)c(F)c1)[N@H+]1CCC[C@@H]1C ZINC000247572672 359235031 /nfs/dbraw/zinc/23/50/31/359235031.db2.gz RYFVNZIWMSJTRW-VHSXEESVSA-N 1 1 225.282 3.510 20 0 BHADMO CC(C)C[C@@H]1CCC[N@H+]([C@H](C)c2ccccn2)C1 ZINC000247573826 388667800 /nfs/dbraw/zinc/66/78/00/388667800.db2.gz LNXWJOIKWKZYTA-CABCVRRESA-N 1 1 246.398 3.901 20 0 BHADMO CC(C)C[C@H]1CCC[N@H+]([C@H](C)c2ccccn2)C1 ZINC000247573832 388667785 /nfs/dbraw/zinc/66/77/85/388667785.db2.gz LNXWJOIKWKZYTA-HUUCEWRRSA-N 1 1 246.398 3.901 20 0 BHADMO CCC[N@H+](Cc1cccc(C)c1)CC1CC1 ZINC000247871012 538102690 /nfs/dbraw/zinc/10/26/90/538102690.db2.gz LEMJPGNHIVOLMH-UHFFFAOYSA-N 1 1 217.356 3.617 20 0 BHADMO COc1cccc(C[N@@H+](C)CC2CCCCC2)c1 ZINC000247897423 388670762 /nfs/dbraw/zinc/67/07/62/388670762.db2.gz PHLNKVMWLGMUKH-UHFFFAOYSA-N 1 1 247.382 3.707 20 0 BHADMO Cc1ccc(C)c(C[N@@H+]2CCCC[C@@H]2C)c1 ZINC000247934083 344983469 /nfs/dbraw/zinc/98/34/69/344983469.db2.gz RNEBXTVXNJUEMK-AWEZNQCLSA-N 1 1 217.356 3.678 20 0 BHADMO Cc1ccccc1[C@@H](C)[N@H+]1CCC[C@H]1C ZINC000247934369 359250057 /nfs/dbraw/zinc/25/00/57/359250057.db2.gz CIIYDNWQQYUVOO-CHWSQXEVSA-N 1 1 203.329 3.540 20 0 BHADMO Cc1ccccc1[C@H](C)[N@H+]1CCC[C@H]1C ZINC000247934370 359250022 /nfs/dbraw/zinc/25/00/22/359250022.db2.gz CIIYDNWQQYUVOO-OLZOCXBDSA-N 1 1 203.329 3.540 20 0 BHADMO CC[C@@H](C)C[N@H+]1CCC[C@H]1c1cccc(C)n1 ZINC000247964432 387137171 /nfs/dbraw/zinc/13/71/71/387137171.db2.gz GPTQUXWWGSEUAH-DOMZBBRYSA-N 1 1 232.371 3.573 20 0 BHADMO CC[C@H](C)C[N@H+]1CCC[C@H]1c1cccc(C)n1 ZINC000247964435 171280732 /nfs/dbraw/zinc/28/07/32/171280732.db2.gz GPTQUXWWGSEUAH-WFASDCNBSA-N 1 1 232.371 3.573 20 0 BHADMO CCC[N@H+](Cc1ccccc1Cl)CC1CC1 ZINC000247978355 538103986 /nfs/dbraw/zinc/10/39/86/538103986.db2.gz GNAJRGCXCVPYSF-UHFFFAOYSA-N 1 1 237.774 3.962 20 0 BHADMO Cc1cccc([C@H]2CCC[N@H+]2[C@@H]2C=CCCC2)n1 ZINC000247995934 359251946 /nfs/dbraw/zinc/25/19/46/359251946.db2.gz JWCBZRHUSOPZLY-GDBMZVCRSA-N 1 1 242.366 3.636 20 0 BHADMO Cc1cccc([C@@H]2CCC[N@H+]2[C@@H]2C=CCCC2)n1 ZINC000247995938 359250862 /nfs/dbraw/zinc/25/08/62/359250862.db2.gz JWCBZRHUSOPZLY-ZBFHGGJFSA-N 1 1 242.366 3.636 20 0 BHADMO CCC[N@H+](Cc1ccc(Cl)cc1)CC1CC1 ZINC000248005809 541427544 /nfs/dbraw/zinc/42/75/44/541427544.db2.gz PQCSXKUTXITONN-UHFFFAOYSA-N 1 1 237.774 3.962 20 0 BHADMO CC[C@@H]1CCCC[N@H+]1CCOc1ccc(C)cc1 ZINC000248042787 644661683 /nfs/dbraw/zinc/66/16/83/644661683.db2.gz VLYDPLPWVSGSBZ-OAHLLOKOSA-N 1 1 247.382 3.638 20 0 BHADMO C[N@@H+](CCOc1ccccc1)CC1CCCCC1 ZINC000248082317 388673516 /nfs/dbraw/zinc/67/35/16/388673516.db2.gz VSWJRBWUVPZJJA-UHFFFAOYSA-N 1 1 247.382 3.578 20 0 BHADMO CCC[N@H+](Cc1ccc(C)cc1)CC1CC1 ZINC000248106024 537806826 /nfs/dbraw/zinc/80/68/26/537806826.db2.gz PDQCXVXJDIHWHG-UHFFFAOYSA-N 1 1 217.356 3.617 20 0 BHADMO C[C@@H]1CC[N@@H+](CCCF)[C@H]1c1cccc(F)c1 ZINC000248128256 323134225 /nfs/dbraw/zinc/13/42/25/323134225.db2.gz OEGOLQFLBWSRAG-BXUZGUMPSA-N 1 1 239.309 3.568 20 0 BHADMO C[C@H]1CC[N@@H+](CCCF)[C@H]1c1cccc(F)c1 ZINC000248128259 388674234 /nfs/dbraw/zinc/67/42/34/388674234.db2.gz OEGOLQFLBWSRAG-SMDDNHRTSA-N 1 1 239.309 3.568 20 0 BHADMO Cc1cc(C)cc(C[N@@H+]2CCCC[C@@H]2C)c1 ZINC000248128727 388674573 /nfs/dbraw/zinc/67/45/73/388674573.db2.gz XUJCNGPSUUENOE-AWEZNQCLSA-N 1 1 217.356 3.678 20 0 BHADMO C[C@@H]1CCCC[N@H+]1Cc1ccc(Cl)s1 ZINC000248130652 388674275 /nfs/dbraw/zinc/67/42/75/388674275.db2.gz YKDGUSVULWMXKO-SECBINFHSA-N 1 1 229.776 3.776 20 0 BHADMO C[C@H]1CCCC[N@H+]1Cc1ccc(Cl)s1 ZINC000248130656 388673846 /nfs/dbraw/zinc/67/38/46/388673846.db2.gz YKDGUSVULWMXKO-VIFPVBQESA-N 1 1 229.776 3.776 20 0 BHADMO CCCCC[N@@H+](C)Cc1ccccc1C ZINC000248142863 537811002 /nfs/dbraw/zinc/81/10/02/537811002.db2.gz GDYBTQDSALGRFC-UHFFFAOYSA-N 1 1 205.345 3.617 20 0 BHADMO CCCC[N@@H+](CC)Cc1ccccc1C ZINC000248150123 537811844 /nfs/dbraw/zinc/81/18/44/537811844.db2.gz JJHDZVHXLNIIOE-UHFFFAOYSA-N 1 1 205.345 3.617 20 0 BHADMO CC[N@@H+](Cc1cccc(F)c1)C1CCCCC1 ZINC000248232496 541429300 /nfs/dbraw/zinc/42/93/00/541429300.db2.gz CJDIHAHCUPCFPI-UHFFFAOYSA-N 1 1 235.346 3.980 20 0 BHADMO CCCC[N@@H+](C)CCSc1ccccc1F ZINC000248243218 345090918 /nfs/dbraw/zinc/09/09/18/345090918.db2.gz PIQQPHWJVICLEE-UHFFFAOYSA-N 1 1 241.375 3.650 20 0 BHADMO CC(C)C[N@@H+](C)Cc1ccc(C(F)(F)F)cc1 ZINC000248243876 388675190 /nfs/dbraw/zinc/67/51/90/388675190.db2.gz PQVZBYFKQSKHAR-UHFFFAOYSA-N 1 1 245.288 3.793 20 0 BHADMO CCCCC[N@@H+](C)Cc1ccc(Cl)cc1 ZINC000248250283 537816430 /nfs/dbraw/zinc/81/64/30/537816430.db2.gz IRMYVNPDOPBLAR-UHFFFAOYSA-N 1 1 225.763 3.962 20 0 BHADMO CC(C)C[N@@H+](C)[C@@H](C)c1ccc(F)c(F)c1 ZINC000248253854 488195461 /nfs/dbraw/zinc/19/54/61/488195461.db2.gz TYJWCPOXFSLKCU-JTQLQIEISA-N 1 1 227.298 3.614 20 0 BHADMO CC(C)C[N@@H+](C)[C@H](C)c1ccc(F)c(F)c1 ZINC000248253855 488195518 /nfs/dbraw/zinc/19/55/18/488195518.db2.gz TYJWCPOXFSLKCU-SNVBAGLBSA-N 1 1 227.298 3.614 20 0 BHADMO CC[N@@H+](Cc1cccc(OC)c1)C1CCCCC1 ZINC000248266288 388675659 /nfs/dbraw/zinc/67/56/59/388675659.db2.gz SVAKDGPEYQCCMR-UHFFFAOYSA-N 1 1 247.382 3.850 20 0 BHADMO CC[N@H+](Cc1ccc(Cl)s1)CC(C)C ZINC000248268090 537817113 /nfs/dbraw/zinc/81/71/13/537817113.db2.gz UHOLZULTNWLASC-UHFFFAOYSA-N 1 1 231.792 3.879 20 0 BHADMO CC[C@@H]1c2ccsc2CC[N@@H+]1CC(C)C ZINC000248268618 537817656 /nfs/dbraw/zinc/81/76/56/537817656.db2.gz YVVSQJIUGZVXTA-GFCCVEGCSA-N 1 1 223.385 3.713 20 0 BHADMO CC[C@H]1c2ccsc2CC[N@@H+]1CC(C)C ZINC000248268619 537816239 /nfs/dbraw/zinc/81/62/39/537816239.db2.gz YVVSQJIUGZVXTA-LBPRGKRZSA-N 1 1 223.385 3.713 20 0 BHADMO CCCCC[N@@H+](C)Cc1nc2ccccc2s1 ZINC000248290466 388675155 /nfs/dbraw/zinc/67/51/55/388675155.db2.gz SIESSFJWSMODBL-UHFFFAOYSA-N 1 1 248.395 3.918 20 0 BHADMO CCCCC[N@@H+](Cc1ccccc1F)C1CC1 ZINC000248296714 537827731 /nfs/dbraw/zinc/82/77/31/537827731.db2.gz XRFBLYSCRYGAPY-UHFFFAOYSA-N 1 1 235.346 3.980 20 0 BHADMO Cl/C=C(\Cl)C[N@H+]1CCC[C@@H]2CCC[C@@H]21 ZINC000248297365 644673896 /nfs/dbraw/zinc/67/38/96/644673896.db2.gz ZKZFIWLRXQWWIP-YHQIDKOESA-N 1 1 234.170 3.570 20 0 BHADMO C[C@@H]1CC[N@@H+](Cc2nc3ccccc3s2)[C@H]1C ZINC000248367784 359271335 /nfs/dbraw/zinc/27/13/35/359271335.db2.gz ULQIGZZNBLDDKH-MNOVXSKESA-N 1 1 246.379 3.527 20 0 BHADMO C[C@H]1CC[N@@H+](Cc2nc3ccccc3s2)[C@H]1C ZINC000248367785 359271304 /nfs/dbraw/zinc/27/13/04/359271304.db2.gz ULQIGZZNBLDDKH-QWRGUYRKSA-N 1 1 246.379 3.527 20 0 BHADMO CC[C@H](C)[N@H+]1CCC[C@H]1c1cccc(N(C)C)c1 ZINC000248375108 388677814 /nfs/dbraw/zinc/67/78/14/388677814.db2.gz VNRNLEKKSPSVBK-BBRMVZONSA-N 1 1 246.398 3.688 20 0 BHADMO CC[C@@H](C)[N@H+]1CCC[C@H]1c1cccc(N(C)C)c1 ZINC000248375109 388677624 /nfs/dbraw/zinc/67/76/24/388677624.db2.gz VNRNLEKKSPSVBK-CJNGLKHVSA-N 1 1 246.398 3.688 20 0 BHADMO CCC[C@H](C)[N@@H+](C)[C@H](C)Cc1ccsc1 ZINC000248385932 388677745 /nfs/dbraw/zinc/67/77/45/388677745.db2.gz KMLGQPNKIIFDSE-NWDGAFQWSA-N 1 1 225.401 3.800 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)[C@H](C)Cc1ccsc1 ZINC000248385933 388677991 /nfs/dbraw/zinc/67/79/91/388677991.db2.gz KMLGQPNKIIFDSE-VXGBXAGGSA-N 1 1 225.401 3.800 20 0 BHADMO C[C@@H]1CC[N@@H+](Cc2ccc(C(F)F)cc2)[C@H]1C ZINC000248387843 135001430 /nfs/dbraw/zinc/00/14/30/135001430.db2.gz BZUAWHIWRWMNGC-MNOVXSKESA-N 1 1 239.309 3.855 20 0 BHADMO C[C@H]1CC[N@@H+](Cc2ccc(C(F)F)cc2)[C@H]1C ZINC000248387844 135001575 /nfs/dbraw/zinc/00/15/75/135001575.db2.gz BZUAWHIWRWMNGC-QWRGUYRKSA-N 1 1 239.309 3.855 20 0 BHADMO CO[C@@H](C)C[N@H+]1CCCC[C@@H]1c1ccc(C)cc1 ZINC000248411572 388678317 /nfs/dbraw/zinc/67/83/17/388678317.db2.gz DVEADIGMAJRWCE-GOEBONIOSA-N 1 1 247.382 3.557 20 0 BHADMO CO[C@@H](C)C[N@H+]1CCCC[C@H]1c1ccc(C)cc1 ZINC000248411573 388679003 /nfs/dbraw/zinc/67/90/03/388679003.db2.gz DVEADIGMAJRWCE-HOCLYGCPSA-N 1 1 247.382 3.557 20 0 BHADMO CCC[C@@H](C)C[N@@H+](C)[C@H](C)c1ccccn1 ZINC000248413190 135006581 /nfs/dbraw/zinc/00/65/81/135006581.db2.gz KZKZGPBNDONJLZ-CHWSQXEVSA-N 1 1 220.360 3.511 20 0 BHADMO CCC[C@H](C)C[N@@H+](C)[C@H](C)c1ccccn1 ZINC000248413191 535607834 /nfs/dbraw/zinc/60/78/34/535607834.db2.gz KZKZGPBNDONJLZ-QWHCGFSZSA-N 1 1 220.360 3.511 20 0 BHADMO CO[C@@H](C)C[N@H+]1CCCCC[C@H]1c1ccccc1 ZINC000248439886 388680299 /nfs/dbraw/zinc/68/02/99/388680299.db2.gz UKSQXLDCUYGDGR-HOCLYGCPSA-N 1 1 247.382 3.639 20 0 BHADMO CO[C@H](C)C[N@H+]1CCCCC[C@H]1c1ccccc1 ZINC000248439888 388679788 /nfs/dbraw/zinc/67/97/88/388679788.db2.gz UKSQXLDCUYGDGR-ZBFHGGJFSA-N 1 1 247.382 3.639 20 0 BHADMO CC(C)c1ccc([C@H](C)[N@H+](C)CC[C@H](C)O)cc1 ZINC000248466760 388681654 /nfs/dbraw/zinc/68/16/54/388681654.db2.gz SNGCMSCUZHQIAK-KBPBESRZSA-N 1 1 249.398 3.574 20 0 BHADMO CC(C)c1ccc([C@@H](C)[N@H+](C)CC[C@H](C)O)cc1 ZINC000248466761 388681230 /nfs/dbraw/zinc/68/12/30/388681230.db2.gz SNGCMSCUZHQIAK-UONOGXRCSA-N 1 1 249.398 3.574 20 0 BHADMO CCC[C@@H](C)C[N@@H+](C)C[C@H](C)c1nccs1 ZINC000248490826 388681970 /nfs/dbraw/zinc/68/19/70/388681970.db2.gz NOUSMHYHABZSGB-NEPJUHHUSA-N 1 1 240.416 3.615 20 0 BHADMO CCC[C@H](C)C[N@@H+](C)C[C@H](C)c1nccs1 ZINC000248490827 388682287 /nfs/dbraw/zinc/68/22/87/388682287.db2.gz NOUSMHYHABZSGB-RYUDHWBXSA-N 1 1 240.416 3.615 20 0 BHADMO C[C@H](c1cccnc1)[N@@H+](C)C[C@@H]1CCCC[C@H]1C ZINC000248572512 388684286 /nfs/dbraw/zinc/68/42/86/388684286.db2.gz CXCKJNUKGNWHRS-FMKPAKJESA-N 1 1 246.398 3.901 20 0 BHADMO C[C@H](c1cccnc1)[N@@H+](C)C[C@H]1CCCC[C@H]1C ZINC000248572516 388684441 /nfs/dbraw/zinc/68/44/41/388684441.db2.gz CXCKJNUKGNWHRS-IIAWOOMASA-N 1 1 246.398 3.901 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@@H]2CCC[C@@H](C)C2)c(C)n1 ZINC000248573944 135020335 /nfs/dbraw/zinc/02/03/35/135020335.db2.gz SIXDNLQVWOQCKM-MLGOLLRUSA-N 1 1 246.398 3.709 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@H]2CCC[C@@H](C)C2)c(C)n1 ZINC000248573947 135020805 /nfs/dbraw/zinc/02/08/05/135020805.db2.gz SIXDNLQVWOQCKM-WBMJQRKESA-N 1 1 246.398 3.709 20 0 BHADMO CCC[C@@H](C)C[N@@H+](C)[C@H](C)c1ccncc1 ZINC000248609012 135015527 /nfs/dbraw/zinc/01/55/27/135015527.db2.gz KLEGTGVJENHLEC-CHWSQXEVSA-N 1 1 220.360 3.511 20 0 BHADMO CCC[C@H](C)C[N@@H+](C)[C@H](C)c1ccncc1 ZINC000248609017 535608172 /nfs/dbraw/zinc/60/81/72/535608172.db2.gz KLEGTGVJENHLEC-QWHCGFSZSA-N 1 1 220.360 3.511 20 0 BHADMO C[C@H](c1ccccn1)[N@@H+](C)C[C@@H]1CCCC[C@H]1C ZINC000248611950 388686388 /nfs/dbraw/zinc/68/63/88/388686388.db2.gz LBDOIVCFFHAEMR-KFWWJZLASA-N 1 1 246.398 3.901 20 0 BHADMO C[C@H](c1ccccn1)[N@@H+](C)C[C@H]1CCCC[C@H]1C ZINC000248611953 388686627 /nfs/dbraw/zinc/68/66/27/388686627.db2.gz LBDOIVCFFHAEMR-RBSFLKMASA-N 1 1 246.398 3.901 20 0 BHADMO CCC[C@@H](C)C[N@@H+](C)[C@H](C)c1cccnc1 ZINC000248615944 135016680 /nfs/dbraw/zinc/01/66/80/135016680.db2.gz LWFBWSWGXQGPDL-CHWSQXEVSA-N 1 1 220.360 3.511 20 0 BHADMO CCC[C@H](C)C[N@@H+](C)[C@H](C)c1cccnc1 ZINC000248615945 535608431 /nfs/dbraw/zinc/60/84/31/535608431.db2.gz LWFBWSWGXQGPDL-QWHCGFSZSA-N 1 1 220.360 3.511 20 0 BHADMO C[C@H](c1ccncc1)[N@@H+](C)C[C@@H]1CCCC[C@H]1C ZINC000248625362 388687560 /nfs/dbraw/zinc/68/75/60/388687560.db2.gz NXYATFXHAJUWEQ-FMKPAKJESA-N 1 1 246.398 3.901 20 0 BHADMO C[C@H](c1ccncc1)[N@@H+](C)C[C@H]1CCCC[C@H]1C ZINC000248625366 388686538 /nfs/dbraw/zinc/68/65/38/388686538.db2.gz NXYATFXHAJUWEQ-IIAWOOMASA-N 1 1 246.398 3.901 20 0 BHADMO C[C@@H](C[N@H+]1CCSCC[C@@H]1C)c1ccccc1 ZINC000248741611 388692030 /nfs/dbraw/zinc/69/20/30/388692030.db2.gz AHFMWLODTDHYNN-KBPBESRZSA-N 1 1 249.423 3.618 20 0 BHADMO C[C@@H](C[N@H+]1CCSCC[C@H]1C)c1ccccc1 ZINC000248741614 388691473 /nfs/dbraw/zinc/69/14/73/388691473.db2.gz AHFMWLODTDHYNN-UONOGXRCSA-N 1 1 249.423 3.618 20 0 BHADMO C[C@H](CC[N@@H+](C)[C@H]1CCSC1)c1ccccc1 ZINC000248753965 388693179 /nfs/dbraw/zinc/69/31/79/388693179.db2.gz CKCMQEPXTJLJHI-HIFRSBDPSA-N 1 1 249.423 3.618 20 0 BHADMO C[C@@H](CC[N@@H+](C)[C@H]1CCSC1)c1ccccc1 ZINC000248753967 388693278 /nfs/dbraw/zinc/69/32/78/388693278.db2.gz CKCMQEPXTJLJHI-ZFWWWQNUSA-N 1 1 249.423 3.618 20 0 BHADMO Cc1cncc(C[N@H+]2CCC[C@H]3CCCC[C@H]32)c1 ZINC000248889071 388697707 /nfs/dbraw/zinc/69/77/07/388697707.db2.gz FLECTBQCWRLSDO-HZPDHXFCSA-N 1 1 244.382 3.545 20 0 BHADMO Cc1cncc(C[N@H+]2CCC[C@@H]3CCCC[C@H]32)c1 ZINC000248889076 388697699 /nfs/dbraw/zinc/69/76/99/388697699.db2.gz FLECTBQCWRLSDO-JKSUJKDBSA-N 1 1 244.382 3.545 20 0 BHADMO CCCC[C@@H](CC)C[N@@H+](C)C[C@H]1CCCOC1 ZINC000248901444 388698606 /nfs/dbraw/zinc/69/86/06/388698606.db2.gz XCFMPLIAPCAIMS-HUUCEWRRSA-N 1 1 241.419 3.561 20 0 BHADMO CCCC[C@H](CC)C[N@@H+](C)C[C@H]1CCCOC1 ZINC000248901447 388698326 /nfs/dbraw/zinc/69/83/26/388698326.db2.gz XCFMPLIAPCAIMS-LSDHHAIUSA-N 1 1 241.419 3.561 20 0 BHADMO Cc1cncc(C[N@H+]2[C@H](C)C[C@H]3CCCC[C@H]32)c1 ZINC000248929397 388699423 /nfs/dbraw/zinc/69/94/23/388699423.db2.gz MFSCSJNAEHTPGJ-FVQBIDKESA-N 1 1 244.382 3.543 20 0 BHADMO Cc1cncc(C[N@H+]2[C@H](C)C[C@@H]3CCCC[C@@H]32)c1 ZINC000248929401 388700133 /nfs/dbraw/zinc/70/01/33/388700133.db2.gz MFSCSJNAEHTPGJ-KBMXLJTQSA-N 1 1 244.382 3.543 20 0 BHADMO Cc1cncc(C[N@H+]2[C@H](C)C[C@@H]3CCCC[C@H]32)c1 ZINC000248930096 388700230 /nfs/dbraw/zinc/70/02/30/388700230.db2.gz MFSCSJNAEHTPGJ-VNQPRFMTSA-N 1 1 244.382 3.543 20 0 BHADMO Cc1ccc([C@H](C)[N@@H+](C)C[C@H]2CC[C@@H](C)O2)cc1 ZINC000248972419 135028807 /nfs/dbraw/zinc/02/88/07/135028807.db2.gz CXZRXRJNOUXPTP-IJEWVQPXSA-N 1 1 247.382 3.555 20 0 BHADMO Cc1ccc([C@H](C)[N@@H+](C)C[C@H]2CC[C@H](C)O2)cc1 ZINC000248972422 135028416 /nfs/dbraw/zinc/02/84/16/135028416.db2.gz CXZRXRJNOUXPTP-OFQRWUPVSA-N 1 1 247.382 3.555 20 0 BHADMO Cc1ccc([C@H](C)[N@@H+](C)C[C@@H]2CC[C@@H](C)O2)cc1 ZINC000248972426 135028422 /nfs/dbraw/zinc/02/84/22/135028422.db2.gz CXZRXRJNOUXPTP-YCPHGPKFSA-N 1 1 247.382 3.555 20 0 BHADMO c1csc([C@H]2CCC[N@@H+]2C[C@H]2CCC=CO2)c1 ZINC000248994595 135029308 /nfs/dbraw/zinc/02/93/08/135029308.db2.gz OMBJUYLPIYEDHE-CHWSQXEVSA-N 1 1 249.379 3.578 20 0 BHADMO c1csc([C@@H]2CCC[N@@H+]2C[C@H]2CCC=CO2)c1 ZINC000248994598 135029596 /nfs/dbraw/zinc/02/95/96/135029596.db2.gz OMBJUYLPIYEDHE-OLZOCXBDSA-N 1 1 249.379 3.578 20 0 BHADMO Cc1ccc([C@@H](C)[N@@H+](C)C[C@H]2CCC=CO2)cc1 ZINC000248996383 644707034 /nfs/dbraw/zinc/70/70/34/644707034.db2.gz PBOASEVTAFPFSG-GDBMZVCRSA-N 1 1 245.366 3.681 20 0 BHADMO Cc1ccc([C@H](C)[N@@H+](C)C[C@H]2CCC=CO2)cc1 ZINC000248996385 644705995 /nfs/dbraw/zinc/70/59/95/644705995.db2.gz PBOASEVTAFPFSG-GOEBONIOSA-N 1 1 245.366 3.681 20 0 BHADMO C[C@H](c1ccccc1)[N@H+]1CCS[C@H](C)CC1 ZINC000249005841 388703824 /nfs/dbraw/zinc/70/38/24/388703824.db2.gz IZHVPENILFDEGT-CHWSQXEVSA-N 1 1 235.396 3.575 20 0 BHADMO C[C@H](c1ccccc1)[N@H+]1CCS[C@@H](C)CC1 ZINC000249005844 388703410 /nfs/dbraw/zinc/70/34/10/388703410.db2.gz IZHVPENILFDEGT-QWHCGFSZSA-N 1 1 235.396 3.575 20 0 BHADMO c1ccc([C@@H]2CCC[N@@H+]2C[C@H]2CCC=CO2)cc1 ZINC000249036183 135031252 /nfs/dbraw/zinc/03/12/52/135031252.db2.gz SQMFKAKIGQOTHB-CVEARBPZSA-N 1 1 243.350 3.516 20 0 BHADMO c1ccc([C@H]2CCC[N@@H+]2C[C@H]2CCC=CO2)cc1 ZINC000249036186 135030383 /nfs/dbraw/zinc/03/03/83/135030383.db2.gz SQMFKAKIGQOTHB-HZPDHXFCSA-N 1 1 243.350 3.516 20 0 BHADMO C1=CC[C@]2(CC1)CCC[N@H+](C[C@H]1CCC=CO1)C2 ZINC000249040447 644710065 /nfs/dbraw/zinc/71/00/65/644710065.db2.gz UOUCQHYXPXMKFX-CVEARBPZSA-N 1 1 247.382 3.501 20 0 BHADMO C1=CC[C@@]2(CC1)CCC[N@H+](C[C@H]1CCC=CO1)C2 ZINC000249040450 644709714 /nfs/dbraw/zinc/70/97/14/644709714.db2.gz UOUCQHYXPXMKFX-HZPDHXFCSA-N 1 1 247.382 3.501 20 0 BHADMO C[C@@H](C[N@H+]1CCS[C@@H](C)CC1)c1ccccc1 ZINC000249115365 388709650 /nfs/dbraw/zinc/70/96/50/388709650.db2.gz WHEOKPDVQDACCB-KBPBESRZSA-N 1 1 249.423 3.618 20 0 BHADMO C[C@@H](C[N@H+]1CCS[C@H](C)CC1)c1ccccc1 ZINC000249115366 388709028 /nfs/dbraw/zinc/70/90/28/388709028.db2.gz WHEOKPDVQDACCB-UONOGXRCSA-N 1 1 249.423 3.618 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@@H]2CCCC[C@H]2C)c(C)n1 ZINC000249291968 388715416 /nfs/dbraw/zinc/71/54/16/388715416.db2.gz ANQANWWLHKQDHY-MLGOLLRUSA-N 1 1 246.398 3.709 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@H]2CCCC[C@H]2C)c(C)n1 ZINC000249291970 388715390 /nfs/dbraw/zinc/71/53/90/388715390.db2.gz ANQANWWLHKQDHY-WBMJQRKESA-N 1 1 246.398 3.709 20 0 BHADMO Cc1ccc([C@@H](C)[N@@H+](C)CC[C@H]2CCCO2)cc1 ZINC000249299349 388716740 /nfs/dbraw/zinc/71/67/40/388716740.db2.gz NJKHJDWBPRNJPW-GDBMZVCRSA-N 1 1 247.382 3.557 20 0 BHADMO Cc1ccc([C@H](C)[N@@H+](C)CC[C@H]2CCCO2)cc1 ZINC000249299350 388717194 /nfs/dbraw/zinc/71/71/94/388717194.db2.gz NJKHJDWBPRNJPW-GOEBONIOSA-N 1 1 247.382 3.557 20 0 BHADMO CC[N@@H+](CCc1cccnc1)[C@@H]1CCCC[C@H]1C ZINC000249364702 135036846 /nfs/dbraw/zinc/03/68/46/135036846.db2.gz MGAMUFUZUAMJII-GDBMZVCRSA-N 1 1 246.398 3.525 20 0 BHADMO CC[N@@H+](CCc1cccnc1)[C@H]1CCCC[C@H]1C ZINC000249364705 135037116 /nfs/dbraw/zinc/03/71/16/135037116.db2.gz MGAMUFUZUAMJII-ZBFHGGJFSA-N 1 1 246.398 3.525 20 0 BHADMO CC[N@@H+](Cc1nccs1)[C@H]1CCCC[C@H]1C ZINC000249377847 388719213 /nfs/dbraw/zinc/71/92/13/388719213.db2.gz OMFJGNDIVKJWHF-NEPJUHHUSA-N 1 1 238.400 3.544 20 0 BHADMO CC[N@@H+](Cc1nccs1)[C@@H]1CCCC[C@H]1C ZINC000249377850 388719947 /nfs/dbraw/zinc/71/99/47/388719947.db2.gz OMFJGNDIVKJWHF-VXGBXAGGSA-N 1 1 238.400 3.544 20 0 BHADMO CCC[C@H](C)[N@H+]1CCC[C@@H](c2nccs2)C1 ZINC000249409756 388720227 /nfs/dbraw/zinc/72/02/27/388720227.db2.gz XQGQJKWQXWSIJL-NWDGAFQWSA-N 1 1 238.400 3.511 20 0 BHADMO CCC[C@@H](C)[N@H+]1CCC[C@@H](c2nccs2)C1 ZINC000249409760 388720459 /nfs/dbraw/zinc/72/04/59/388720459.db2.gz XQGQJKWQXWSIJL-VXGBXAGGSA-N 1 1 238.400 3.511 20 0 BHADMO CC[N@@H+](CCCCCOC)[C@H]1CCCC[C@H]1C ZINC000249424041 388720401 /nfs/dbraw/zinc/72/04/01/388720401.db2.gz XOPRIIQESSBCOQ-CABCVRRESA-N 1 1 241.419 3.704 20 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ZINC000263794771 351188032 /nfs/dbraw/zinc/18/80/32/351188032.db2.gz RNYVRWGXPQMHDT-INIZCTEOSA-N 1 1 249.398 3.622 20 0 BHADMO CC[C@H](c1ccccc1)[N@@H+](CC)CCCCCO ZINC000263794774 386177933 /nfs/dbraw/zinc/17/79/33/386177933.db2.gz RNYVRWGXPQMHDT-MRXNPFEDSA-N 1 1 249.398 3.622 20 0 BHADMO CC(C)[N@@H+](Cc1ccco1)Cc1cccs1 ZINC000263885336 188020787 /nfs/dbraw/zinc/02/07/87/188020787.db2.gz XZDASYGLJZXTOO-UHFFFAOYSA-N 1 1 235.352 3.752 20 0 BHADMO CC[N@@H+](Cc1cccs1)[C@H](C)c1cccnc1 ZINC000263918788 351199652 /nfs/dbraw/zinc/19/96/52/351199652.db2.gz QDOCIAYITMTVOO-GFCCVEGCSA-N 1 1 246.379 3.726 20 0 BHADMO CC[N@@H+](Cc1cccs1)[C@@H](C)c1cccnc1 ZINC000263918790 351199594 /nfs/dbraw/zinc/19/95/94/351199594.db2.gz QDOCIAYITMTVOO-LBPRGKRZSA-N 1 1 246.379 3.726 20 0 BHADMO COCCCCC[N@@H+](C)C[C@H](C)c1ccccc1 ZINC000264003860 174175701 /nfs/dbraw/zinc/17/57/01/174175701.db2.gz BQGIPEVWWIYHOI-HNNXBMFYSA-N 1 1 249.398 3.539 20 0 BHADMO COCCCCC[N@@H+](C)C[C@@H](C)c1ccccc1 ZINC000264003861 174175161 /nfs/dbraw/zinc/17/51/61/174175161.db2.gz BQGIPEVWWIYHOI-OAHLLOKOSA-N 1 1 249.398 3.539 20 0 BHADMO CCC[N@@H+](CCCCO)[C@@H](CC)c1ccccc1 ZINC000264024782 169154568 /nfs/dbraw/zinc/15/45/68/169154568.db2.gz XSKTWJGHRHJCIU-INIZCTEOSA-N 1 1 249.398 3.622 20 0 BHADMO CCC[N@@H+](CCCCO)[C@H](CC)c1ccccc1 ZINC000264024783 169154693 /nfs/dbraw/zinc/15/46/93/169154693.db2.gz XSKTWJGHRHJCIU-MRXNPFEDSA-N 1 1 249.398 3.622 20 0 BHADMO CC(C)c1ccc([C@H](C)[N@@H+](C)CCCCO)cc1 ZINC000264026042 344537747 /nfs/dbraw/zinc/53/77/47/344537747.db2.gz YEHWKKGVMOOBKK-AWEZNQCLSA-N 1 1 249.398 3.575 20 0 BHADMO CC(C)c1ccc([C@@H](C)[N@@H+](C)CCCCO)cc1 ZINC000264026043 344537521 /nfs/dbraw/zinc/53/75/21/344537521.db2.gz YEHWKKGVMOOBKK-CQSZACIVSA-N 1 1 249.398 3.575 20 0 BHADMO Cc1[nH+]ccn1CCCSc1ccccc1C ZINC000264102185 188021913 /nfs/dbraw/zinc/02/19/13/188021913.db2.gz CFRCKOMZQNRPIY-UHFFFAOYSA-N 1 1 246.379 3.682 20 0 BHADMO Cc1[nH+]ccn1CCCSc1ccc(C)cc1 ZINC000264112610 188021657 /nfs/dbraw/zinc/02/16/57/188021657.db2.gz DYHCFRPSOZJWBG-UHFFFAOYSA-N 1 1 246.379 3.682 20 0 BHADMO C[C@H](c1ccccc1F)[N@@H+](C)CCC(F)(F)F ZINC000264150461 177041720 /nfs/dbraw/zinc/04/17/20/177041720.db2.gz CYFRXUFHMZGGAB-SECBINFHSA-N 1 1 249.251 3.771 20 0 BHADMO C[C@H](c1ccccc1F)[N@H+](C)CCC(F)(F)F ZINC000264150461 177041717 /nfs/dbraw/zinc/04/17/17/177041717.db2.gz CYFRXUFHMZGGAB-SECBINFHSA-N 1 1 249.251 3.771 20 0 BHADMO C[C@@H](c1ccccc1F)[N@@H+](C)CCC(F)(F)F ZINC000264150466 176025129 /nfs/dbraw/zinc/02/51/29/176025129.db2.gz CYFRXUFHMZGGAB-VIFPVBQESA-N 1 1 249.251 3.771 20 0 BHADMO C[C@@H](c1ccccc1F)[N@H+](C)CCC(F)(F)F ZINC000264150466 176025128 /nfs/dbraw/zinc/02/51/28/176025128.db2.gz CYFRXUFHMZGGAB-VIFPVBQESA-N 1 1 249.251 3.771 20 0 BHADMO C[C@H](c1ccc(F)cc1)[N@@H+](C)CCC(F)(F)F ZINC000264160865 177034079 /nfs/dbraw/zinc/03/40/79/177034079.db2.gz FWRQEPNONCHEGD-SECBINFHSA-N 1 1 249.251 3.771 20 0 BHADMO C[C@@H](c1ccc(F)cc1)[N@@H+](C)CCC(F)(F)F ZINC000264160866 176015425 /nfs/dbraw/zinc/01/54/25/176015425.db2.gz FWRQEPNONCHEGD-VIFPVBQESA-N 1 1 249.251 3.771 20 0 BHADMO CCC(CC)SCCCn1cc[nH+]c1C ZINC000264192412 168395125 /nfs/dbraw/zinc/39/51/25/168395125.db2.gz OVXVGFWIRHUDCR-UHFFFAOYSA-N 1 1 226.389 3.503 20 0 BHADMO Cc1[nH+]ccn1CCCSc1cccc(C)c1 ZINC000264210183 179177502 /nfs/dbraw/zinc/17/75/02/179177502.db2.gz USANYGIPJTVJMY-UHFFFAOYSA-N 1 1 246.379 3.682 20 0 BHADMO Cc1ccccc1[C@H](C)[N@@H+](C)Cc1ccccn1 ZINC000264260503 179334673 /nfs/dbraw/zinc/33/46/73/179334673.db2.gz IIKGYJMMSJDGAS-AWEZNQCLSA-N 1 1 240.350 3.583 20 0 BHADMO Cc1ccccc1[C@@H](C)[N@@H+](C)Cc1ccccn1 ZINC000264260506 179317826 /nfs/dbraw/zinc/31/78/26/179317826.db2.gz IIKGYJMMSJDGAS-CQSZACIVSA-N 1 1 240.350 3.583 20 0 BHADMO CC[C@@H](c1ccccc1)[N@@H+](C)Cc1ccccn1 ZINC000264288923 351231919 /nfs/dbraw/zinc/23/19/19/351231919.db2.gz QUFFQBFHEGHRFA-INIZCTEOSA-N 1 1 240.350 3.665 20 0 BHADMO CC[C@H](c1ccccc1)[N@@H+](C)Cc1ccccn1 ZINC000264288926 386223674 /nfs/dbraw/zinc/22/36/74/386223674.db2.gz QUFFQBFHEGHRFA-MRXNPFEDSA-N 1 1 240.350 3.665 20 0 BHADMO CC[C@@H](c1ccccc1)[N@@H+](CC)Cc1ccno1 ZINC000264702058 351252183 /nfs/dbraw/zinc/25/21/83/351252183.db2.gz KCMRQBMBQZDRLE-HNNXBMFYSA-N 1 1 244.338 3.648 20 0 BHADMO CC[C@H](c1ccccc1)[N@@H+](CC)Cc1ccno1 ZINC000264702061 386263679 /nfs/dbraw/zinc/26/36/79/386263679.db2.gz KCMRQBMBQZDRLE-OAHLLOKOSA-N 1 1 244.338 3.648 20 0 BHADMO CCC(C)(C)[N@@H+](C)Cc1cc(-c2ccco2)on1 ZINC000265238131 168286464 /nfs/dbraw/zinc/28/64/64/168286464.db2.gz QSZOFPBICZONNN-UHFFFAOYSA-N 1 1 248.326 3.555 20 0 BHADMO C[C@H](C[N@@H+](C)CCC(F)(F)F)c1ccccc1 ZINC000265359023 386331085 /nfs/dbraw/zinc/33/10/85/386331085.db2.gz WJAMSUADYSGEGI-LLVKDONJSA-N 1 1 245.288 3.674 20 0 BHADMO C[C@@H](C[N@@H+](C)CCC(F)(F)F)c1ccccc1 ZINC000265359025 386330423 /nfs/dbraw/zinc/33/04/23/386330423.db2.gz WJAMSUADYSGEGI-NSHDSACASA-N 1 1 245.288 3.674 20 0 BHADMO COCCCC[N@@H+]([C@@H](C)c1ccccc1)C1CC1 ZINC000265477853 174190540 /nfs/dbraw/zinc/19/05/40/174190540.db2.gz RMBZFBBREXAUCD-AWEZNQCLSA-N 1 1 247.382 3.639 20 0 BHADMO COCCCC[N@@H+]([C@H](C)c1ccccc1)C1CC1 ZINC000265477854 174190947 /nfs/dbraw/zinc/19/09/47/174190947.db2.gz RMBZFBBREXAUCD-CQSZACIVSA-N 1 1 247.382 3.639 20 0 BHADMO C[N@@H+](CCC(F)(F)F)[C@@H]1CCc2ccccc21 ZINC000265877935 386380985 /nfs/dbraw/zinc/38/09/85/386380985.db2.gz XLYYHRIEYVGQIE-GFCCVEGCSA-N 1 1 243.272 3.558 20 0 BHADMO C[N@@H+](CCC(F)(F)F)[C@H]1CCc2ccccc21 ZINC000265877938 386382122 /nfs/dbraw/zinc/38/21/22/386382122.db2.gz XLYYHRIEYVGQIE-LBPRGKRZSA-N 1 1 243.272 3.558 20 0 BHADMO Cc1ccccc1[C@H](C)[N@@H+](C)Cc1ccncc1 ZINC000265981722 179334095 /nfs/dbraw/zinc/33/40/95/179334095.db2.gz BRAHWFIGZJFRJY-AWEZNQCLSA-N 1 1 240.350 3.583 20 0 BHADMO Cc1ccccc1[C@@H](C)[N@@H+](C)Cc1ccncc1 ZINC000265981723 179317967 /nfs/dbraw/zinc/31/79/67/179317967.db2.gz BRAHWFIGZJFRJY-CQSZACIVSA-N 1 1 240.350 3.583 20 0 BHADMO CC(C)[N@@H+](Cc1cccs1)Cc1ccncc1 ZINC000266021055 386391866 /nfs/dbraw/zinc/39/18/66/386391866.db2.gz OQFPGRFXKIWUNG-UHFFFAOYSA-N 1 1 246.379 3.554 20 0 BHADMO C[C@@H](c1cccnc1)[N@H+]1CCC2(C1)CCCCC2 ZINC000266050052 176028507 /nfs/dbraw/zinc/02/85/07/176028507.db2.gz YSXCWYIXGAXKMJ-AWEZNQCLSA-N 1 1 244.382 3.799 20 0 BHADMO C[C@H](c1cccnc1)[N@H+]1CCC2(C1)CCCCC2 ZINC000266050055 177045111 /nfs/dbraw/zinc/04/51/11/177045111.db2.gz YSXCWYIXGAXKMJ-CQSZACIVSA-N 1 1 244.382 3.799 20 0 BHADMO Cc1ccoc1C[NH2+]C1(c2cccc(F)c2)CC1 ZINC000266157074 386406392 /nfs/dbraw/zinc/40/63/92/386406392.db2.gz MGVBEXZOTRIIFB-UHFFFAOYSA-N 1 1 245.297 3.506 20 0 BHADMO Cc1ccoc1C[NH2+]C1(c2ccccc2F)CC1 ZINC000266170437 386405002 /nfs/dbraw/zinc/40/50/02/386405002.db2.gz QYUDIQNEHMMRJD-UHFFFAOYSA-N 1 1 245.297 3.506 20 0 BHADMO Cc1ccoc1C[NH2+]Cc1ccc([C@H]2C[C@@H]2C)o1 ZINC000266243574 388995731 /nfs/dbraw/zinc/99/57/31/388995731.db2.gz XUGXDPCOLBOESU-AAEUAGOBSA-N 1 1 245.322 3.594 20 0 BHADMO Cc1ccoc1C[NH2+]Cc1ccc([C@@H]2C[C@H]2C)o1 ZINC000266243576 388995348 /nfs/dbraw/zinc/99/53/48/388995348.db2.gz XUGXDPCOLBOESU-DGCLKSJQSA-N 1 1 245.322 3.594 20 0 BHADMO Cc1ccoc1C[NH2+]Cc1ccc([C@@H]2C[C@@H]2C)o1 ZINC000266243578 388995710 /nfs/dbraw/zinc/99/57/10/388995710.db2.gz XUGXDPCOLBOESU-WCQYABFASA-N 1 1 245.322 3.594 20 0 BHADMO Cc1ccoc1C[NH2+]Cc1ccc([C@H]2C[C@H]2C)o1 ZINC000266243579 388995098 /nfs/dbraw/zinc/99/50/98/388995098.db2.gz XUGXDPCOLBOESU-YPMHNXCESA-N 1 1 245.322 3.594 20 0 BHADMO CC(C)C[C@@H]1CC[N@H+]([C@H](C)c2cccnc2)C1 ZINC000266742431 386464921 /nfs/dbraw/zinc/46/49/21/386464921.db2.gz OJGXLXCFGCDBQL-KGLIPLIRSA-N 1 1 232.371 3.511 20 0 BHADMO CC(C)C[C@H]1CC[N@H+]([C@H](C)c2cccnc2)C1 ZINC000266742434 188372457 /nfs/dbraw/zinc/37/24/57/188372457.db2.gz OJGXLXCFGCDBQL-ZIAGYGMSSA-N 1 1 232.371 3.511 20 0 BHADMO C[C@H]1C[N@@H+](CCC(F)(F)F)[C@H]1c1ccccc1 ZINC000266869533 177246638 /nfs/dbraw/zinc/24/66/38/177246638.db2.gz OZOJWOVLUWSCOS-CMPLNLGQSA-N 1 1 243.272 3.632 20 0 BHADMO C[C@H]1C[N@@H+](CCC(F)(F)F)[C@@H]1c1ccccc1 ZINC000266869537 177247061 /nfs/dbraw/zinc/24/70/61/177247061.db2.gz OZOJWOVLUWSCOS-JQWIXIFHSA-N 1 1 243.272 3.632 20 0 BHADMO C[C@@H]1C[N@@H+](CCC(F)(F)F)[C@@H]1c1ccccc1 ZINC000266869541 176286227 /nfs/dbraw/zinc/28/62/27/176286227.db2.gz OZOJWOVLUWSCOS-PWSUYJOCSA-N 1 1 243.272 3.632 20 0 BHADMO C[C@@H]1C[N@@H+](CCC(F)(F)F)[C@H]1c1ccccc1 ZINC000266869544 176286479 /nfs/dbraw/zinc/28/64/79/176286479.db2.gz OZOJWOVLUWSCOS-ZYHUDNBSSA-N 1 1 243.272 3.632 20 0 BHADMO Cc1ccsc1C[N@@H+](C)Cc1cccs1 ZINC000266974862 397942273 /nfs/dbraw/zinc/94/22/73/397942273.db2.gz ICXYGLINKXGPOV-UHFFFAOYSA-N 1 1 237.393 3.750 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@@H](C)c2ccccn2)cc1 ZINC000267338721 386530553 /nfs/dbraw/zinc/53/05/53/386530553.db2.gz DFTDKOVHMMEPMT-AWEZNQCLSA-N 1 1 240.350 3.583 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@H](C)c2ccccn2)cc1 ZINC000267339831 386529987 /nfs/dbraw/zinc/52/99/87/386529987.db2.gz DFTDKOVHMMEPMT-CQSZACIVSA-N 1 1 240.350 3.583 20 0 BHADMO Cc1ccccc1[C@H](C)[N@@H+](C)CCCCCCO ZINC000267523958 179334370 /nfs/dbraw/zinc/33/43/70/179334370.db2.gz NGKQIYAUASMVGZ-HNNXBMFYSA-N 1 1 249.398 3.541 20 0 BHADMO Cc1ccccc1[C@@H](C)[N@@H+](C)CCCCCCO ZINC000267523960 179318141 /nfs/dbraw/zinc/31/81/41/179318141.db2.gz NGKQIYAUASMVGZ-OAHLLOKOSA-N 1 1 249.398 3.541 20 0 BHADMO C[C@H](c1ccco1)[N@@H+](CCC(F)(F)F)C1CC1 ZINC000267939231 177047410 /nfs/dbraw/zinc/04/74/10/177047410.db2.gz PLLOYITUTFIJBC-SECBINFHSA-N 1 1 247.260 3.757 20 0 BHADMO C[C@H](c1ccco1)[N@H+](CCC(F)(F)F)C1CC1 ZINC000267939231 177047409 /nfs/dbraw/zinc/04/74/09/177047409.db2.gz PLLOYITUTFIJBC-SECBINFHSA-N 1 1 247.260 3.757 20 0 BHADMO C[C@@H](c1ccco1)[N@@H+](CCC(F)(F)F)C1CC1 ZINC000267939232 176031384 /nfs/dbraw/zinc/03/13/84/176031384.db2.gz PLLOYITUTFIJBC-VIFPVBQESA-N 1 1 247.260 3.757 20 0 BHADMO C[C@@H](c1ccco1)[N@H+](CCC(F)(F)F)C1CC1 ZINC000267939232 176031382 /nfs/dbraw/zinc/03/13/82/176031382.db2.gz PLLOYITUTFIJBC-VIFPVBQESA-N 1 1 247.260 3.757 20 0 BHADMO CC[N@@H+](Cc1ccncc1)[C@@H](C)c1ccccc1 ZINC000267942414 351325612 /nfs/dbraw/zinc/32/56/12/351325612.db2.gz UVJGKOLELOFSNM-AWEZNQCLSA-N 1 1 240.350 3.665 20 0 BHADMO CC[N@@H+](Cc1ccncc1)[C@H](C)c1ccccc1 ZINC000267942415 351325203 /nfs/dbraw/zinc/32/52/03/351325203.db2.gz UVJGKOLELOFSNM-CQSZACIVSA-N 1 1 240.350 3.665 20 0 BHADMO CCc1nc([C@H](C)Nc2cc(C)cc[nH+]2)cs1 ZINC000268289478 172007188 /nfs/dbraw/zinc/00/71/88/172007188.db2.gz DCBYWFNMUYFGBT-JTQLQIEISA-N 1 1 247.367 3.582 20 0 BHADMO CCc1nc([C@@H](C)Nc2cc(C)cc[nH+]2)cs1 ZINC000268289479 172001605 /nfs/dbraw/zinc/00/16/05/172001605.db2.gz DCBYWFNMUYFGBT-SNVBAGLBSA-N 1 1 247.367 3.582 20 0 BHADMO Cc1cc[nH+]c(N2CCC[C@@H]2c2cccs2)c1 ZINC000268295574 386640057 /nfs/dbraw/zinc/64/00/57/386640057.db2.gz FSKJLBVRNOJLNO-GFCCVEGCSA-N 1 1 244.363 3.793 20 0 BHADMO Cc1cc[nH+]c(N2CCC[C@H]2c2cccs2)c1 ZINC000268295576 386639760 /nfs/dbraw/zinc/63/97/60/386639760.db2.gz FSKJLBVRNOJLNO-LBPRGKRZSA-N 1 1 244.363 3.793 20 0 BHADMO Cc1cc[nH+]c(N2CCc3sccc3[C@H]2C)c1 ZINC000268313085 132191614 /nfs/dbraw/zinc/19/16/14/132191614.db2.gz KNGCVKBSYWQYOO-LLVKDONJSA-N 1 1 244.363 3.575 20 0 BHADMO Cc1cc[nH+]c(N2CCc3sccc3[C@@H]2C)c1 ZINC000268313086 132191565 /nfs/dbraw/zinc/19/15/65/132191565.db2.gz KNGCVKBSYWQYOO-NSHDSACASA-N 1 1 244.363 3.575 20 0 BHADMO Cc1[nH+]ccn1CCS[C@H](C)c1ccccc1 ZINC000268438446 180261914 /nfs/dbraw/zinc/26/19/14/180261914.db2.gz UJMKTOHTTCJGJZ-GFCCVEGCSA-N 1 1 246.379 3.686 20 0 BHADMO Cc1[nH+]ccn1CCS[C@@H](C)c1ccccc1 ZINC000268438448 180261986 /nfs/dbraw/zinc/26/19/86/180261986.db2.gz UJMKTOHTTCJGJZ-LBPRGKRZSA-N 1 1 246.379 3.686 20 0 BHADMO Cl/C=C(\Cl)C[NH2+]C1(c2ccccc2)CC1 ZINC000268674911 487502414 /nfs/dbraw/zinc/50/24/14/487502414.db2.gz MOSVVPVCUYDZJD-FLIBITNWSA-N 1 1 242.149 3.584 20 0 BHADMO C[C@H](c1ccccc1)[N@@H+](CCCF)C1CC1 ZINC000268929728 177039337 /nfs/dbraw/zinc/03/93/37/177039337.db2.gz XRBKGBCFSJEOBE-GFCCVEGCSA-N 1 1 221.319 3.572 20 0 BHADMO C[C@@H](c1ccccc1)[N@@H+](CCCF)C1CC1 ZINC000268929730 176020792 /nfs/dbraw/zinc/02/07/92/176020792.db2.gz XRBKGBCFSJEOBE-LBPRGKRZSA-N 1 1 221.319 3.572 20 0 BHADMO CC[N@@H+](Cc1cnccc1C)C1CCCCC1 ZINC000269547831 351359014 /nfs/dbraw/zinc/35/90/14/351359014.db2.gz DBIUORNTGITFIU-UHFFFAOYSA-N 1 1 232.371 3.545 20 0 BHADMO Cc1ccncc1C[N@H+](C)[C@H](C)c1cccs1 ZINC000269550763 385606178 /nfs/dbraw/zinc/60/61/78/385606178.db2.gz FGZPELJTVHBFIK-GFCCVEGCSA-N 1 1 246.379 3.645 20 0 BHADMO Cc1ccncc1C[N@H+](C)[C@@H](C)c1cccs1 ZINC000269550765 385606114 /nfs/dbraw/zinc/60/61/14/385606114.db2.gz FGZPELJTVHBFIK-LBPRGKRZSA-N 1 1 246.379 3.645 20 0 BHADMO Cc1occc1C[N@@H+](C)CCCCC(F)(F)F ZINC000269867012 385642604 /nfs/dbraw/zinc/64/26/04/385642604.db2.gz LYJHLLBYJXOQMJ-UHFFFAOYSA-N 1 1 249.276 3.752 20 0 BHADMO CCCc1[nH+]ccn1CCCCC(F)(F)F ZINC000270135797 385674930 /nfs/dbraw/zinc/67/49/30/385674930.db2.gz NNSBSUAQZJLTOG-UHFFFAOYSA-N 1 1 234.265 3.568 20 0 BHADMO CC[N@@H+](Cc1ccccc1)[C@@H](C)c1cccnc1 ZINC000270681872 411427834 /nfs/dbraw/zinc/42/78/34/411427834.db2.gz VCHLHDUVTUUXQW-AWEZNQCLSA-N 1 1 240.350 3.665 20 0 BHADMO CC[N@@H+](Cc1ccccc1)[C@H](C)c1cccnc1 ZINC000270681873 411428364 /nfs/dbraw/zinc/42/83/64/411428364.db2.gz VCHLHDUVTUUXQW-CQSZACIVSA-N 1 1 240.350 3.665 20 0 BHADMO CC[C@@H](C)C[N@@H+](CC)[C@H](C)c1cccnc1 ZINC000270683336 170701839 /nfs/dbraw/zinc/70/18/39/170701839.db2.gz AHQWHNLECSVKEG-CHWSQXEVSA-N 1 1 220.360 3.511 20 0 BHADMO CC[C@@H](C)C[N@@H+](CC)[C@@H](C)c1cccnc1 ZINC000270683339 411428230 /nfs/dbraw/zinc/42/82/30/411428230.db2.gz AHQWHNLECSVKEG-OLZOCXBDSA-N 1 1 220.360 3.511 20 0 BHADMO CC[C@H](C)C[N@@H+](CC)[C@H](C)c1cccnc1 ZINC000270683342 171278270 /nfs/dbraw/zinc/27/82/70/171278270.db2.gz AHQWHNLECSVKEG-QWHCGFSZSA-N 1 1 220.360 3.511 20 0 BHADMO CC[C@H](C)C[N@@H+](CC)[C@@H](C)c1cccnc1 ZINC000270683343 171278208 /nfs/dbraw/zinc/27/82/08/171278208.db2.gz AHQWHNLECSVKEG-STQMWFEESA-N 1 1 220.360 3.511 20 0 BHADMO Cc1ccoc1C[N@H+](C)Cc1sccc1C ZINC000271026722 385771559 /nfs/dbraw/zinc/77/15/59/385771559.db2.gz FIMUWLJMWIWSMZ-UHFFFAOYSA-N 1 1 235.352 3.590 20 0 BHADMO c1c[nH]c([C@@H]2CCC[N@@H+]2C[C@@H]2CC=CCC2)c1 ZINC000271027171 326227363 /nfs/dbraw/zinc/22/73/63/326227363.db2.gz WNHIMAVPXOJRSF-HIFRSBDPSA-N 1 1 230.355 3.508 20 0 BHADMO c1c[nH]c([C@H]2CCC[N@@H+]2C[C@@H]2CC=CCC2)c1 ZINC000271027174 326227628 /nfs/dbraw/zinc/22/76/28/326227628.db2.gz WNHIMAVPXOJRSF-UKRRQHHQSA-N 1 1 230.355 3.508 20 0 BHADMO C[N@@H+](Cc1ccc2ncccc2c1)C1CCCC1 ZINC000271038484 385776759 /nfs/dbraw/zinc/77/67/59/385776759.db2.gz KYPDOJWRZFSEGN-UHFFFAOYSA-N 1 1 240.350 3.609 20 0 BHADMO Cc1ccoc1C[N@H+](Cc1ccco1)C(C)C ZINC000271049968 385779742 /nfs/dbraw/zinc/77/97/42/385779742.db2.gz OKXDLTAJTXQIGT-UHFFFAOYSA-N 1 1 233.311 3.592 20 0 BHADMO Cc1ccccc1[C@@H](C)[N@@H+](C)Cc1cncs1 ZINC000271054559 179318186 /nfs/dbraw/zinc/31/81/86/179318186.db2.gz SJLMRGPAGCLOIF-GFCCVEGCSA-N 1 1 246.379 3.645 20 0 BHADMO Cc1ccccc1[C@H](C)[N@@H+](C)Cc1cncs1 ZINC000271054561 179333852 /nfs/dbraw/zinc/33/38/52/179333852.db2.gz SJLMRGPAGCLOIF-LBPRGKRZSA-N 1 1 246.379 3.645 20 0 BHADMO C[N@@H+](Cc1cnc2ccccc2c1)C1CCCC1 ZINC000271055258 385778904 /nfs/dbraw/zinc/77/89/04/385778904.db2.gz ZFJUMYIWHVNSQG-UHFFFAOYSA-N 1 1 240.350 3.609 20 0 BHADMO C[N@@H+](Cc1cccc2cc[nH]c21)C1CCCC1 ZINC000271056149 385778701 /nfs/dbraw/zinc/77/87/01/385778701.db2.gz ZMZSEAWFMDEPIS-UHFFFAOYSA-N 1 1 228.339 3.542 20 0 BHADMO CC(C)[N@H+](Cc1ccsc1)Cc1ccco1 ZINC000271058485 385779208 /nfs/dbraw/zinc/77/92/08/385779208.db2.gz VMUCJIZPODXOSD-UHFFFAOYSA-N 1 1 235.352 3.752 20 0 BHADMO CC(C)[N@@H+](Cc1cnc2ccccc2c1)C1CC1 ZINC000271067309 385781515 /nfs/dbraw/zinc/78/15/15/385781515.db2.gz JZVNEZDNVNWLEX-UHFFFAOYSA-N 1 1 240.350 3.608 20 0 BHADMO CC(C)[N@@H+](Cc1cccc2cc[nH]c21)C1CC1 ZINC000271079257 187336428 /nfs/dbraw/zinc/33/64/28/187336428.db2.gz UWZINXJELQZLLE-UHFFFAOYSA-N 1 1 228.339 3.541 20 0 BHADMO c1cc2cccc(C[N@H+]3CCC4(CCC4)C3)c2[nH]1 ZINC000271155125 183340377 /nfs/dbraw/zinc/34/03/77/183340377.db2.gz BAJAALHFBLAFBQ-UHFFFAOYSA-N 1 1 240.350 3.544 20 0 BHADMO CCn1cccc1C[N@@H+](C)Cc1ccc(C)s1 ZINC000271173466 172204167 /nfs/dbraw/zinc/20/41/67/172204167.db2.gz IHJGYWKXQZPFET-UHFFFAOYSA-N 1 1 248.395 3.510 20 0 BHADMO Cc1ccc(C[NH2+][C@H](C)c2cscn2)c(C)c1 ZINC000271175331 385797782 /nfs/dbraw/zinc/79/77/82/385797782.db2.gz UZZRDHAUJDRQPW-GFCCVEGCSA-N 1 1 246.379 3.611 20 0 BHADMO Cc1ccc(C[NH2+][C@@H](C)c2cscn2)c(C)c1 ZINC000271175334 385796370 /nfs/dbraw/zinc/79/63/70/385796370.db2.gz UZZRDHAUJDRQPW-LBPRGKRZSA-N 1 1 246.379 3.611 20 0 BHADMO C[C@@H](c1ccccn1)[N@H+]1CC[C@H](C)C2(CCC2)C1 ZINC000271296963 176028003 /nfs/dbraw/zinc/02/80/03/176028003.db2.gz DLXXAVVVYJAOKP-KBPBESRZSA-N 1 1 244.382 3.655 20 0 BHADMO C[C@@H](c1ccccn1)[N@H+]1CC[C@@H](C)C2(CCC2)C1 ZINC000271296964 176027922 /nfs/dbraw/zinc/02/79/22/176027922.db2.gz DLXXAVVVYJAOKP-KGLIPLIRSA-N 1 1 244.382 3.655 20 0 BHADMO C[C@H](c1ccccn1)[N@H+]1CC[C@H](C)C2(CCC2)C1 ZINC000271296966 177170181 /nfs/dbraw/zinc/17/01/81/177170181.db2.gz DLXXAVVVYJAOKP-UONOGXRCSA-N 1 1 244.382 3.655 20 0 BHADMO C[C@H](c1ccccn1)[N@H+]1CC[C@@H](C)C2(CCC2)C1 ZINC000271296968 177043601 /nfs/dbraw/zinc/04/36/01/177043601.db2.gz DLXXAVVVYJAOKP-ZIAGYGMSSA-N 1 1 244.382 3.655 20 0 BHADMO C[C@@H](c1cccnc1)[N@H+]1CC[C@H](C)C2(CCC2)C1 ZINC000271369455 176030854 /nfs/dbraw/zinc/03/08/54/176030854.db2.gz RGSCMYFWSIZMDA-KBPBESRZSA-N 1 1 244.382 3.655 20 0 BHADMO C[C@@H](c1cccnc1)[N@H+]1CC[C@@H](C)C2(CCC2)C1 ZINC000271369457 176029919 /nfs/dbraw/zinc/02/99/19/176029919.db2.gz RGSCMYFWSIZMDA-KGLIPLIRSA-N 1 1 244.382 3.655 20 0 BHADMO C[C@H](c1cccnc1)[N@H+]1CC[C@H](C)C2(CCC2)C1 ZINC000271369460 177170317 /nfs/dbraw/zinc/17/03/17/177170317.db2.gz RGSCMYFWSIZMDA-UONOGXRCSA-N 1 1 244.382 3.655 20 0 BHADMO C[C@H](c1cccnc1)[N@H+]1CC[C@@H](C)C2(CCC2)C1 ZINC000271371004 177046082 /nfs/dbraw/zinc/04/60/82/177046082.db2.gz RGSCMYFWSIZMDA-ZIAGYGMSSA-N 1 1 244.382 3.655 20 0 BHADMO CC(C)=CCC[C@H](C)[NH2+][C@@H]1CCCc2c[nH]nc21 ZINC000271570366 188199403 /nfs/dbraw/zinc/19/94/03/188199403.db2.gz YPNOEYWKSAZMOB-GXTWGEPZSA-N 1 1 247.386 3.512 20 0 BHADMO CC(C)=CCC[C@H](C)[NH2+][C@H]1CCCc2c[nH]nc21 ZINC000271570367 385838203 /nfs/dbraw/zinc/83/82/03/385838203.db2.gz YPNOEYWKSAZMOB-JSGCOSHPSA-N 1 1 247.386 3.512 20 0 BHADMO CC(C)=CCC[C@@H](C)[NH2+][C@H]1CCCc2c[nH]nc21 ZINC000271570368 188199148 /nfs/dbraw/zinc/19/91/48/188199148.db2.gz YPNOEYWKSAZMOB-OCCSQVGLSA-N 1 1 247.386 3.512 20 0 BHADMO CC(C)=CCC[C@@H](C)[NH2+][C@@H]1CCCc2c[nH]nc21 ZINC000271570369 188376601 /nfs/dbraw/zinc/37/66/01/188376601.db2.gz YPNOEYWKSAZMOB-TZMCWYRMSA-N 1 1 247.386 3.512 20 0 BHADMO CCCCCSCCCn1cc[nH+]c1C ZINC000271612065 385841667 /nfs/dbraw/zinc/84/16/67/385841667.db2.gz KTJFNEAFWBIKTF-UHFFFAOYSA-N 1 1 226.389 3.505 20 0 BHADMO C[C@@H]([NH2+]CCF)c1cccc(Cl)c1Cl ZINC000271825221 389026077 /nfs/dbraw/zinc/02/60/77/389026077.db2.gz SSXZTPPOHSLLNY-SSDOTTSWSA-N 1 1 236.117 3.614 20 0 BHADMO C[C@H]([NH2+]CCF)c1cccc(Cl)c1Cl ZINC000271825224 176847031 /nfs/dbraw/zinc/84/70/31/176847031.db2.gz SSXZTPPOHSLLNY-ZETCQYMHSA-N 1 1 236.117 3.614 20 0 BHADMO COc1ccccc1[C@@H](C)Nc1cccc(C)[nH+]1 ZINC000271964626 175346053 /nfs/dbraw/zinc/34/60/53/175346053.db2.gz SGPSUMKDBQKXFO-GFCCVEGCSA-N 1 1 242.322 3.572 20 0 BHADMO COc1ccccc1[C@H](C)Nc1cccc(C)[nH+]1 ZINC000271964628 175352521 /nfs/dbraw/zinc/35/25/21/175352521.db2.gz SGPSUMKDBQKXFO-LBPRGKRZSA-N 1 1 242.322 3.572 20 0 BHADMO C[C@H](c1nc2ccccc2o1)[N@@H+](C)CC(C)(C)C ZINC000272305019 177054611 /nfs/dbraw/zinc/05/46/11/177054611.db2.gz OAJFOEOLMJWXMG-LLVKDONJSA-N 1 1 246.354 3.867 20 0 BHADMO C[C@@H](c1nc2ccccc2o1)[N@@H+](C)CC(C)(C)C ZINC000272305023 176039801 /nfs/dbraw/zinc/03/98/01/176039801.db2.gz OAJFOEOLMJWXMG-NSHDSACASA-N 1 1 246.354 3.867 20 0 BHADMO CCC[N@@H+](CC)[C@H](C)c1nc2ccccc2o1 ZINC000272386852 169132758 /nfs/dbraw/zinc/13/27/58/169132758.db2.gz YZVUDRNKBCIGIJ-LLVKDONJSA-N 1 1 232.327 3.621 20 0 BHADMO CCC[N@@H+](CC)[C@@H](C)c1nc2ccccc2o1 ZINC000272386856 169131974 /nfs/dbraw/zinc/13/19/74/169131974.db2.gz YZVUDRNKBCIGIJ-NSHDSACASA-N 1 1 232.327 3.621 20 0 BHADMO CC1=CC[N@@H+]([C@H](C)c2nc3ccccc3o2)CC1 ZINC000272404099 168118101 /nfs/dbraw/zinc/11/81/01/168118101.db2.gz AWVXZTYXBRRCFH-GFCCVEGCSA-N 1 1 242.322 3.541 20 0 BHADMO CC1=CC[N@@H+]([C@@H](C)c2nc3ccccc3o2)CC1 ZINC000272404103 168116556 /nfs/dbraw/zinc/11/65/56/168116556.db2.gz AWVXZTYXBRRCFH-LBPRGKRZSA-N 1 1 242.322 3.541 20 0 BHADMO CC(C)c1[nH+]ccn1CCCCC(F)(F)F ZINC000272421307 385902076 /nfs/dbraw/zinc/90/20/76/385902076.db2.gz IAFWPKDEPOCBLW-UHFFFAOYSA-N 1 1 234.265 3.739 20 0 BHADMO CSc1ccccc1C[N@@H+](C)Cc1ccco1 ZINC000272973318 385956737 /nfs/dbraw/zinc/95/67/37/385956737.db2.gz ZNWFVJXTZQUSPX-UHFFFAOYSA-N 1 1 247.363 3.634 20 0 BHADMO CSc1ccccc1C[N@H+](C)Cc1ccco1 ZINC000272973318 385956723 /nfs/dbraw/zinc/95/67/23/385956723.db2.gz ZNWFVJXTZQUSPX-UHFFFAOYSA-N 1 1 247.363 3.634 20 0 BHADMO FCCC[N@H+]1CCCC[C@H]1c1ccccc1 ZINC000273858426 644521411 /nfs/dbraw/zinc/52/14/11/644521411.db2.gz NDULZGCNUTYJLH-AWEZNQCLSA-N 1 1 221.319 3.573 20 0 BHADMO FCCC[N@H+]1CCCC[C@@H]1c1ccccc1 ZINC000273858427 644521065 /nfs/dbraw/zinc/52/10/65/644521065.db2.gz NDULZGCNUTYJLH-CQSZACIVSA-N 1 1 221.319 3.573 20 0 BHADMO CC/C=C/CC[N@H+]1CCC[C@@H]1c1ccc[nH]1 ZINC000274301343 386089195 /nfs/dbraw/zinc/08/91/95/386089195.db2.gz BXFARKGBIRLLTB-RDFMZFSFSA-N 1 1 218.344 3.508 20 0 BHADMO CC/C=C/CC[N@H+]1CCC[C@H]1c1ccc[nH]1 ZINC000274301344 386088710 /nfs/dbraw/zinc/08/87/10/386088710.db2.gz BXFARKGBIRLLTB-XGACYXMMSA-N 1 1 218.344 3.508 20 0 BHADMO CC/C=C/CC[N@@H+](C)Cc1nc2ccccc2o1 ZINC000274318674 487661259 /nfs/dbraw/zinc/66/12/59/487661259.db2.gz HXVMDQJNUFWOQR-SNAWJCMRSA-N 1 1 244.338 3.616 20 0 BHADMO CC/C=C/CCSCCCn1cc[nH+]c1C ZINC000274424206 386101745 /nfs/dbraw/zinc/10/17/45/386101745.db2.gz FLCKZOLCRNPVOU-SNAWJCMRSA-N 1 1 238.400 3.671 20 0 BHADMO CCCCCCSCCn1cc[nH+]c1C ZINC000274434639 386101995 /nfs/dbraw/zinc/10/19/95/386101995.db2.gz HMXNMHIGGRLSJX-UHFFFAOYSA-N 1 1 226.389 3.505 20 0 BHADMO c1cc2cccc(C[N@H+]3CCCC4(CC4)C3)c2[nH]1 ZINC000274476261 183338964 /nfs/dbraw/zinc/33/89/64/183338964.db2.gz LJVVWFNTSTUXHW-UHFFFAOYSA-N 1 1 240.350 3.544 20 0 BHADMO Cc1[nH+]ccn1CC1CCC(C(F)(F)F)CC1 ZINC000274523138 180233056 /nfs/dbraw/zinc/23/30/56/180233056.db2.gz PKVILTHGCSECAK-UHFFFAOYSA-N 1 1 246.276 3.560 20 0 BHADMO Cc1cccc(N2CCc3sccc3[C@H]2C)[nH+]1 ZINC000274594172 132203541 /nfs/dbraw/zinc/20/35/41/132203541.db2.gz KVVICZMKUGBJGV-LLVKDONJSA-N 1 1 244.363 3.575 20 0 BHADMO Cc1cccc(N2CCc3sccc3[C@@H]2C)[nH+]1 ZINC000274594173 132203467 /nfs/dbraw/zinc/20/34/67/132203467.db2.gz KVVICZMKUGBJGV-NSHDSACASA-N 1 1 244.363 3.575 20 0 BHADMO Cc1cccc(N2CCC[C@@H]2c2ccsc2)[nH+]1 ZINC000274687622 179121597 /nfs/dbraw/zinc/12/15/97/179121597.db2.gz YYPQXIHELMMVAB-CYBMUJFWSA-N 1 1 244.363 3.793 20 0 BHADMO Cc1cccc(N2CCC[C@H]2c2ccsc2)[nH+]1 ZINC000274687625 179122062 /nfs/dbraw/zinc/12/20/62/179122062.db2.gz YYPQXIHELMMVAB-ZDUSSCGKSA-N 1 1 244.363 3.793 20 0 BHADMO CC(C)CCC[N@@H+](C)[C@H](C)c1ccccn1 ZINC000275095212 386180827 /nfs/dbraw/zinc/18/08/27/386180827.db2.gz DFJUEDLMTSFZTH-CYBMUJFWSA-N 1 1 220.360 3.511 20 0 BHADMO CC(C)CCC[N@@H+](C)[C@@H](C)c1ccccn1 ZINC000275095214 386180362 /nfs/dbraw/zinc/18/03/62/386180362.db2.gz DFJUEDLMTSFZTH-ZDUSSCGKSA-N 1 1 220.360 3.511 20 0 BHADMO CC(C)CCC[N@@H+](C)[C@H](C)c1cccnc1 ZINC000275138895 386185587 /nfs/dbraw/zinc/18/55/87/386185587.db2.gz MMLFLAYEXNXLSE-CYBMUJFWSA-N 1 1 220.360 3.511 20 0 BHADMO CC(C)CCC[N@@H+](C)[C@@H](C)c1cccnc1 ZINC000275138897 386185320 /nfs/dbraw/zinc/18/53/20/386185320.db2.gz MMLFLAYEXNXLSE-ZDUSSCGKSA-N 1 1 220.360 3.511 20 0 BHADMO CC(C)CCC[N@@H+](C)[C@H](C)c1ccncc1 ZINC000275154590 386184329 /nfs/dbraw/zinc/18/43/29/386184329.db2.gz QBKMFCDCGPRVLO-CYBMUJFWSA-N 1 1 220.360 3.511 20 0 BHADMO CC(C)CCC[N@@H+](C)[C@@H](C)c1ccncc1 ZINC000275154591 386185454 /nfs/dbraw/zinc/18/54/54/386185454.db2.gz QBKMFCDCGPRVLO-ZDUSSCGKSA-N 1 1 220.360 3.511 20 0 BHADMO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1cccs1 ZINC000275345264 351597918 /nfs/dbraw/zinc/59/79/18/351597918.db2.gz YNNAHPVTCVZQBH-AWEZNQCLSA-N 1 1 246.379 3.726 20 0 BHADMO CC[C@H](c1ccncc1)[N@@H+](C)Cc1cccs1 ZINC000275345266 386202746 /nfs/dbraw/zinc/20/27/46/386202746.db2.gz YNNAHPVTCVZQBH-CQSZACIVSA-N 1 1 246.379 3.726 20 0 BHADMO Cc1cccc([C@H](C)[N@@H+](C)Cc2ccccn2)c1 ZINC000275515574 179193339 /nfs/dbraw/zinc/19/33/39/179193339.db2.gz DHMVSOAXEKEGKH-AWEZNQCLSA-N 1 1 240.350 3.583 20 0 BHADMO Cc1cccc([C@@H](C)[N@@H+](C)Cc2ccccn2)c1 ZINC000275515580 179178752 /nfs/dbraw/zinc/17/87/52/179178752.db2.gz DHMVSOAXEKEGKH-CQSZACIVSA-N 1 1 240.350 3.583 20 0 BHADMO CCC(=O)CC[N@H+]1CCCC[C@H]1c1ccccc1 ZINC000276908976 643018510 /nfs/dbraw/zinc/01/85/10/643018510.db2.gz PXEUIZRDMXYUPQ-INIZCTEOSA-N 1 1 245.366 3.583 20 0 BHADMO CCC(=O)CC[N@H+]1CCCC[C@@H]1c1ccccc1 ZINC000276908978 643019021 /nfs/dbraw/zinc/01/90/21/643019021.db2.gz PXEUIZRDMXYUPQ-MRXNPFEDSA-N 1 1 245.366 3.583 20 0 BHADMO CCC(=O)CC[N@@H+]([C@H](C)c1ccccc1)C1CC1 ZINC000276953371 168200880 /nfs/dbraw/zinc/20/08/80/168200880.db2.gz WDCWCONFFSZMMW-CYBMUJFWSA-N 1 1 245.366 3.581 20 0 BHADMO CCC(=O)CC[N@@H+]([C@@H](C)c1ccccc1)C1CC1 ZINC000276953374 168201178 /nfs/dbraw/zinc/20/11/78/168201178.db2.gz WDCWCONFFSZMMW-ZDUSSCGKSA-N 1 1 245.366 3.581 20 0 BHADMO FC1(F)CC(Nc2cc[nH+]c3ccsc32)C1 ZINC000277246809 388353833 /nfs/dbraw/zinc/35/38/33/388353833.db2.gz VFTYHGCTRREPIO-UHFFFAOYSA-N 1 1 240.278 3.506 20 0 BHADMO CC(C)CCC[N@H+]1CCC[C@H]1c1ccncc1 ZINC000277499893 386438596 /nfs/dbraw/zinc/43/85/96/386438596.db2.gz PLPHCEWHRUQRSP-HNNXBMFYSA-N 1 1 232.371 3.655 20 0 BHADMO CC(C)CCC[N@H+]1CCC[C@@H]1c1ccncc1 ZINC000277499895 386439979 /nfs/dbraw/zinc/43/99/79/386439979.db2.gz PLPHCEWHRUQRSP-OAHLLOKOSA-N 1 1 232.371 3.655 20 0 BHADMO FC(F)(F)C[C@H]1CC[N@@H+](Cc2ccsc2)C1 ZINC000278128022 386491925 /nfs/dbraw/zinc/49/19/25/386491925.db2.gz BSHMYOZVMGNKBD-SECBINFHSA-N 1 1 249.301 3.522 20 0 BHADMO FC(F)(F)C[C@@H]1CC[N@@H+](Cc2ccsc2)C1 ZINC000278128025 386492869 /nfs/dbraw/zinc/49/28/69/386492869.db2.gz BSHMYOZVMGNKBD-VIFPVBQESA-N 1 1 249.301 3.522 20 0 BHADMO c1cc([C@@H]2CCC[N@@H+]2C[C@H]2CCC=CO2)cs1 ZINC000278178617 386496858 /nfs/dbraw/zinc/49/68/58/386496858.db2.gz GQCKVZBHGIKONU-KGLIPLIRSA-N 1 1 249.379 3.578 20 0 BHADMO c1cc([C@H]2CCC[N@@H+]2C[C@@H]2CCC=CO2)cs1 ZINC000278178620 188030577 /nfs/dbraw/zinc/03/05/77/188030577.db2.gz GQCKVZBHGIKONU-UONOGXRCSA-N 1 1 249.379 3.578 20 0 BHADMO c1cc([C@H]2CCC[N@@H+]2C[C@H]2CCC=CO2)cs1 ZINC000278178623 386498351 /nfs/dbraw/zinc/49/83/51/386498351.db2.gz GQCKVZBHGIKONU-ZIAGYGMSSA-N 1 1 249.379 3.578 20 0 BHADMO CC[C@@H](c1ccccc1)[N@@H+](CC)Cc1cocn1 ZINC000278201746 351750889 /nfs/dbraw/zinc/75/08/89/351750889.db2.gz QTGFXZGJDYHISE-HNNXBMFYSA-N 1 1 244.338 3.648 20 0 BHADMO CC[C@@H](c1ccccc1)[N@H+](CC)Cc1cocn1 ZINC000278201746 351750885 /nfs/dbraw/zinc/75/08/85/351750885.db2.gz QTGFXZGJDYHISE-HNNXBMFYSA-N 1 1 244.338 3.648 20 0 BHADMO CC[C@H](c1ccccc1)[N@@H+](CC)Cc1cocn1 ZINC000278201751 386500742 /nfs/dbraw/zinc/50/07/42/386500742.db2.gz QTGFXZGJDYHISE-OAHLLOKOSA-N 1 1 244.338 3.648 20 0 BHADMO CC[C@H](c1ccccc1)[N@H+](CC)Cc1cocn1 ZINC000278201751 386500738 /nfs/dbraw/zinc/50/07/38/386500738.db2.gz QTGFXZGJDYHISE-OAHLLOKOSA-N 1 1 244.338 3.648 20 0 BHADMO c1ccc([C@H]2CCC[N@@H+]2C[C@@H]2CCSC2)cc1 ZINC000278399171 487683443 /nfs/dbraw/zinc/68/34/43/487683443.db2.gz FRHCUYQUPKAHQY-DZGCQCFKSA-N 1 1 247.407 3.577 20 0 BHADMO c1ccc([C@@H]2CCC[N@@H+]2C[C@H]2CCSC2)cc1 ZINC000278399173 386519599 /nfs/dbraw/zinc/51/95/99/386519599.db2.gz FRHCUYQUPKAHQY-HIFRSBDPSA-N 1 1 247.407 3.577 20 0 BHADMO c1ccc([C@H]2CCC[N@@H+]2C[C@H]2CCSC2)cc1 ZINC000278399175 386521079 /nfs/dbraw/zinc/52/10/79/386521079.db2.gz FRHCUYQUPKAHQY-UKRRQHHQSA-N 1 1 247.407 3.577 20 0 BHADMO c1ccc([C@@H]2CCC[N@@H+]2C[C@@H]2CCSC2)cc1 ZINC000278399178 386521214 /nfs/dbraw/zinc/52/12/14/386521214.db2.gz FRHCUYQUPKAHQY-ZFWWWQNUSA-N 1 1 247.407 3.577 20 0 BHADMO CC(C)c1[nH+]ccn1CC(=O)C1CCCCCC1 ZINC000278780300 386584952 /nfs/dbraw/zinc/58/49/52/386584952.db2.gz UHBGACYDNNXDIG-UHFFFAOYSA-N 1 1 248.370 3.546 20 0 BHADMO FC(F)(F)C[C@H]1CC[N@@H+](Cc2cccs2)C1 ZINC000278927451 386605460 /nfs/dbraw/zinc/60/54/60/386605460.db2.gz XCABLJCPNPOPFD-SECBINFHSA-N 1 1 249.301 3.522 20 0 BHADMO FC(F)(F)C[C@@H]1CC[N@@H+](Cc2cccs2)C1 ZINC000278927460 386605387 /nfs/dbraw/zinc/60/53/87/386605387.db2.gz XCABLJCPNPOPFD-VIFPVBQESA-N 1 1 249.301 3.522 20 0 BHADMO CC[N@@H+](Cc1cccc(C(F)F)c1)C1CC1 ZINC000279365324 351810295 /nfs/dbraw/zinc/81/02/95/351810295.db2.gz KYWWYFVZCPQQOV-UHFFFAOYSA-N 1 1 225.282 3.609 20 0 BHADMO C[N@@H+](Cc1cccc(C(F)F)c1)C1CCC1 ZINC000279685698 386720711 /nfs/dbraw/zinc/72/07/11/386720711.db2.gz HHXVIMDCBIYDKQ-UHFFFAOYSA-N 1 1 225.282 3.609 20 0 BHADMO C[C@H]1CCC[N@H+]1Cc1cccc(C(F)F)c1 ZINC000279696071 177110754 /nfs/dbraw/zinc/11/07/54/177110754.db2.gz IROBHOVOCRGPLI-JTQLQIEISA-N 1 1 225.282 3.609 20 0 BHADMO C[C@@H]1CCC[N@H+]1Cc1cccc(C(F)F)c1 ZINC000279696073 176110126 /nfs/dbraw/zinc/11/01/26/176110126.db2.gz IROBHOVOCRGPLI-SNVBAGLBSA-N 1 1 225.282 3.609 20 0 BHADMO CCC[C@@H](CC)SCCn1cc[nH+]c1C ZINC000280004037 169381185 /nfs/dbraw/zinc/38/11/85/169381185.db2.gz SNBILBFWBMZYNS-GFCCVEGCSA-N 1 1 226.389 3.503 20 0 BHADMO CCC[C@H](CC)SCCn1cc[nH+]c1C ZINC000280004038 386766117 /nfs/dbraw/zinc/76/61/17/386766117.db2.gz SNBILBFWBMZYNS-LBPRGKRZSA-N 1 1 226.389 3.503 20 0 BHADMO CO[C@]1(C)CCC[N@H+]([C@H](C)c2ccccc2)CC1 ZINC000280582744 188031385 /nfs/dbraw/zinc/03/13/85/188031385.db2.gz SYPWCWLXLAHCJF-GDBMZVCRSA-N 1 1 247.382 3.639 20 0 BHADMO CO[C@]1(C)CCC[N@H+]([C@@H](C)c2ccccc2)CC1 ZINC000280582748 188031686 /nfs/dbraw/zinc/03/16/86/188031686.db2.gz SYPWCWLXLAHCJF-GOEBONIOSA-N 1 1 247.382 3.639 20 0 BHADMO CO[C@@]1(C)CCC[N@H+]([C@@H](C)c2ccccc2)CC1 ZINC000280582750 386824714 /nfs/dbraw/zinc/82/47/14/386824714.db2.gz SYPWCWLXLAHCJF-HOCLYGCPSA-N 1 1 247.382 3.639 20 0 BHADMO CO[C@@]1(C)CCC[N@H+]([C@H](C)c2ccccc2)CC1 ZINC000280582754 386824616 /nfs/dbraw/zinc/82/46/16/386824616.db2.gz SYPWCWLXLAHCJF-ZBFHGGJFSA-N 1 1 247.382 3.639 20 0 BHADMO CC1=CCC[N@H+]([C@H](C)c2ncc(C(C)(C)C)o2)C1 ZINC000280717261 168099267 /nfs/dbraw/zinc/09/92/67/168099267.db2.gz FHLARVWWUVOVEW-GFCCVEGCSA-N 1 1 248.370 3.685 20 0 BHADMO CC1=CCC[N@@H+]([C@H](C)c2ncc(C(C)(C)C)o2)C1 ZINC000280717261 168099264 /nfs/dbraw/zinc/09/92/64/168099264.db2.gz FHLARVWWUVOVEW-GFCCVEGCSA-N 1 1 248.370 3.685 20 0 BHADMO CC1=CCC[N@H+]([C@@H](C)c2ncc(C(C)(C)C)o2)C1 ZINC000280717266 168100237 /nfs/dbraw/zinc/10/02/37/168100237.db2.gz FHLARVWWUVOVEW-LBPRGKRZSA-N 1 1 248.370 3.685 20 0 BHADMO CC1=CCC[N@@H+]([C@@H](C)c2ncc(C(C)(C)C)o2)C1 ZINC000280717266 168100233 /nfs/dbraw/zinc/10/02/33/168100233.db2.gz FHLARVWWUVOVEW-LBPRGKRZSA-N 1 1 248.370 3.685 20 0 BHADMO CC1=C(C)C[N@@H+](Cc2csc(C3CC3)n2)CC1 ZINC000280871119 168085768 /nfs/dbraw/zinc/08/57/68/168085768.db2.gz NSXJQPLCASPTHA-UHFFFAOYSA-N 1 1 248.395 3.563 20 0 BHADMO CC1=C(C)C[N@H+](Cc2csc(C3CC3)n2)CC1 ZINC000280871119 168085766 /nfs/dbraw/zinc/08/57/66/168085766.db2.gz NSXJQPLCASPTHA-UHFFFAOYSA-N 1 1 248.395 3.563 20 0 BHADMO CC1=CCC[N@H+]([C@H](C)c2nc3ccccc3o2)C1 ZINC000280930696 168099608 /nfs/dbraw/zinc/09/96/08/168099608.db2.gz VBEVPEIUVXODCZ-GFCCVEGCSA-N 1 1 242.322 3.541 20 0 BHADMO CC1=CCC[N@H+]([C@@H](C)c2nc3ccccc3o2)C1 ZINC000280930702 168100711 /nfs/dbraw/zinc/10/07/11/168100711.db2.gz VBEVPEIUVXODCZ-LBPRGKRZSA-N 1 1 242.322 3.541 20 0 BHADMO C[C@@H]([NH2+]CCF)c1ccc(-c2ccccc2)o1 ZINC000280991492 385625948 /nfs/dbraw/zinc/62/59/48/385625948.db2.gz JTEYGNDIMMEOMP-LLVKDONJSA-N 1 1 233.286 3.567 20 0 BHADMO C[C@H]([NH2+]CCF)c1ccc(-c2ccccc2)o1 ZINC000280991498 385624461 /nfs/dbraw/zinc/62/44/61/385624461.db2.gz JTEYGNDIMMEOMP-NSHDSACASA-N 1 1 233.286 3.567 20 0 BHADMO Cc1cc([C@H](C)[NH2+][C@H](C)c2ccccn2)oc1C ZINC000281995381 178258235 /nfs/dbraw/zinc/25/82/35/178258235.db2.gz CQTCPDBRUQGAJJ-NEPJUHHUSA-N 1 1 244.338 3.703 20 0 BHADMO Cc1cc([C@@H](C)[NH2+][C@@H](C)c2ccccn2)oc1C ZINC000281995383 178230328 /nfs/dbraw/zinc/23/03/28/178230328.db2.gz CQTCPDBRUQGAJJ-NWDGAFQWSA-N 1 1 244.338 3.703 20 0 BHADMO Cc1cc([C@H](C)[NH2+][C@@H](C)c2ccccn2)oc1C ZINC000281995386 178252892 /nfs/dbraw/zinc/25/28/92/178252892.db2.gz CQTCPDBRUQGAJJ-RYUDHWBXSA-N 1 1 244.338 3.703 20 0 BHADMO Cc1cc([C@@H](C)[NH2+][C@H](C)c2ccccn2)oc1C ZINC000281995388 178232789 /nfs/dbraw/zinc/23/27/89/178232789.db2.gz CQTCPDBRUQGAJJ-VXGBXAGGSA-N 1 1 244.338 3.703 20 0 BHADMO Cc1cc([C@@H](C)[NH2+]Cc2ccccc2F)oc1C ZINC000282182063 178228267 /nfs/dbraw/zinc/22/82/67/178228267.db2.gz MUXZNKLHDQICFA-LLVKDONJSA-N 1 1 247.313 3.886 20 0 BHADMO Cc1cc([C@H](C)[NH2+]Cc2ccccc2F)oc1C ZINC000282182064 178251893 /nfs/dbraw/zinc/25/18/93/178251893.db2.gz MUXZNKLHDQICFA-NSHDSACASA-N 1 1 247.313 3.886 20 0 BHADMO Cc1cc[nH+]c(NC2CCC(C(F)F)CC2)c1 ZINC000282303900 385749616 /nfs/dbraw/zinc/74/96/16/385749616.db2.gz MNZVSVXVHSMLTL-UHFFFAOYSA-N 1 1 240.297 3.626 20 0 BHADMO Cc1ccc(NC2CCC(C(F)F)CC2)[nH+]c1 ZINC000282335370 385751640 /nfs/dbraw/zinc/75/16/40/385751640.db2.gz OLPMEXBALKBATO-UHFFFAOYSA-N 1 1 240.297 3.626 20 0 BHADMO CC[C@H](C)[N@H+]1CCC[C@@H]1c1ccsc1 ZINC000282575488 171317295 /nfs/dbraw/zinc/31/72/95/171317295.db2.gz FRTDNUCKBXMTDR-CMPLNLGQSA-N 1 1 209.358 3.684 20 0 BHADMO CC[C@H](C)[N@H+]1CCC[C@H]1c1ccsc1 ZINC000282575491 171317854 /nfs/dbraw/zinc/31/78/54/171317854.db2.gz FRTDNUCKBXMTDR-JQWIXIFHSA-N 1 1 209.358 3.684 20 0 BHADMO CC[C@@H](C)[N@H+]1CCC[C@H]1c1ccsc1 ZINC000282575493 385773229 /nfs/dbraw/zinc/77/32/29/385773229.db2.gz FRTDNUCKBXMTDR-PWSUYJOCSA-N 1 1 209.358 3.684 20 0 BHADMO CC[C@@H](C)[N@H+]1CCC[C@@H]1c1ccsc1 ZINC000282575495 385772607 /nfs/dbraw/zinc/77/26/07/385772607.db2.gz FRTDNUCKBXMTDR-ZYHUDNBSSA-N 1 1 209.358 3.684 20 0 BHADMO Cc1cc([C@@H](C)[NH2+][C@H](C)c2ccc(C)cc2)no1 ZINC000282829208 385789669 /nfs/dbraw/zinc/78/96/69/385789669.db2.gz SELAFKZGWRUUIX-CHWSQXEVSA-N 1 1 244.338 3.703 20 0 BHADMO Cc1cc([C@H](C)[NH2+][C@H](C)c2ccc(C)cc2)no1 ZINC000282829220 385790779 /nfs/dbraw/zinc/79/07/79/385790779.db2.gz SELAFKZGWRUUIX-OLZOCXBDSA-N 1 1 244.338 3.703 20 0 BHADMO Cc1cc([C@@H](C)[NH2+][C@@H](C)c2ccc(C)cc2)no1 ZINC000282829233 385789173 /nfs/dbraw/zinc/78/91/73/385789173.db2.gz SELAFKZGWRUUIX-QWHCGFSZSA-N 1 1 244.338 3.703 20 0 BHADMO Cc1cc([C@H](C)[NH2+][C@@H](C)c2ccc(C)cc2)no1 ZINC000282829248 385788761 /nfs/dbraw/zinc/78/87/61/385788761.db2.gz SELAFKZGWRUUIX-STQMWFEESA-N 1 1 244.338 3.703 20 0 BHADMO CC(C)c1[nH+]ccn1Cc1sccc1Cl ZINC000283077053 385808237 /nfs/dbraw/zinc/80/82/37/385808237.db2.gz PQQRYJOAOYVDJF-UHFFFAOYSA-N 1 1 240.759 3.770 20 0 BHADMO Cc1cc([C@@H](C)[NH2+][C@H](C)c2ccccc2C)no1 ZINC000283451383 178232194 /nfs/dbraw/zinc/23/21/94/178232194.db2.gz IMNDDSHOCKCFNK-CHWSQXEVSA-N 1 1 244.338 3.703 20 0 BHADMO Cc1cc([C@H](C)[NH2+][C@H](C)c2ccccc2C)no1 ZINC000283451385 178257370 /nfs/dbraw/zinc/25/73/70/178257370.db2.gz IMNDDSHOCKCFNK-OLZOCXBDSA-N 1 1 244.338 3.703 20 0 BHADMO CC[C@@H]([NH2+][C@@H](C)c1cc(C)on1)c1ccccc1 ZINC000283537728 398075917 /nfs/dbraw/zinc/07/59/17/398075917.db2.gz ODSKISXZSDYIMK-GXTWGEPZSA-N 1 1 244.338 3.785 20 0 BHADMO CC[C@H]([NH2+][C@@H](C)c1cc(C)on1)c1ccccc1 ZINC000283537731 398075729 /nfs/dbraw/zinc/07/57/29/398075729.db2.gz ODSKISXZSDYIMK-JSGCOSHPSA-N 1 1 244.338 3.785 20 0 BHADMO CC[C@H]([NH2+][C@H](C)c1cc(C)on1)c1ccccc1 ZINC000283537734 398075788 /nfs/dbraw/zinc/07/57/88/398075788.db2.gz ODSKISXZSDYIMK-OCCSQVGLSA-N 1 1 244.338 3.785 20 0 BHADMO CC[C@@H]([NH2+][C@H](C)c1cc(C)on1)c1ccccc1 ZINC000283537737 170912513 /nfs/dbraw/zinc/91/25/13/170912513.db2.gz ODSKISXZSDYIMK-TZMCWYRMSA-N 1 1 244.338 3.785 20 0 BHADMO C[C@H](c1cccc(O)c1)[N@@H+](C)CCCCCF ZINC000283908661 177036817 /nfs/dbraw/zinc/03/68/17/177036817.db2.gz BSQRDEFMWQSOAL-GFCCVEGCSA-N 1 1 239.334 3.525 20 0 BHADMO C[C@@H](c1cccc(O)c1)[N@@H+](C)CCCCCF ZINC000283908663 176019387 /nfs/dbraw/zinc/01/93/87/176019387.db2.gz BSQRDEFMWQSOAL-LBPRGKRZSA-N 1 1 239.334 3.525 20 0 BHADMO CC(C)[N@@H+](CCCCCF)Cc1ccco1 ZINC000284134023 188207033 /nfs/dbraw/zinc/20/70/33/188207033.db2.gz OJCPDVAIWYIRKP-UHFFFAOYSA-N 1 1 227.323 3.630 20 0 BHADMO CC[C@@H](c1ccncc1)[N@@H+](C)CC1(C)CCC1 ZINC000284155564 351993264 /nfs/dbraw/zinc/99/32/64/351993264.db2.gz WDLYCMDTVRYIOF-AWEZNQCLSA-N 1 1 232.371 3.655 20 0 BHADMO CC[C@H](c1ccncc1)[N@@H+](C)CC1(C)CCC1 ZINC000284155570 385854447 /nfs/dbraw/zinc/85/44/47/385854447.db2.gz WDLYCMDTVRYIOF-CQSZACIVSA-N 1 1 232.371 3.655 20 0 BHADMO C[C@H](c1cccs1)[N@@H+](C)CCCCCF ZINC000284191548 177048477 /nfs/dbraw/zinc/04/84/77/177048477.db2.gz RWLLFKLPNYOVJV-LLVKDONJSA-N 1 1 229.364 3.881 20 0 BHADMO C[C@@H](c1cccs1)[N@@H+](C)CCCCCF ZINC000284191550 176033229 /nfs/dbraw/zinc/03/32/29/176033229.db2.gz RWLLFKLPNYOVJV-NSHDSACASA-N 1 1 229.364 3.881 20 0 BHADMO C[C@H](c1ccco1)[N@@H+](CCCCCF)C1CC1 ZINC000284196483 177047342 /nfs/dbraw/zinc/04/73/42/177047342.db2.gz SECLRVAXLWMVKU-GFCCVEGCSA-N 1 1 239.334 3.945 20 0 BHADMO C[C@@H](c1ccco1)[N@@H+](CCCCCF)C1CC1 ZINC000284196485 176031350 /nfs/dbraw/zinc/03/13/50/176031350.db2.gz SECLRVAXLWMVKU-LBPRGKRZSA-N 1 1 239.334 3.945 20 0 BHADMO CC[C@@H](c1ccncc1)[N@@H+](C)CCCCCF ZINC000284213415 170956369 /nfs/dbraw/zinc/95/63/69/170956369.db2.gz TYDIFFSCOJOYJL-AWEZNQCLSA-N 1 1 238.350 3.604 20 0 BHADMO CC[C@H](c1ccncc1)[N@@H+](C)CCCCCF ZINC000284213417 385857981 /nfs/dbraw/zinc/85/79/81/385857981.db2.gz TYDIFFSCOJOYJL-CQSZACIVSA-N 1 1 238.350 3.604 20 0 BHADMO FCCCC[N@H+]1CCC[C@H]1c1ccccc1 ZINC000285064476 385897871 /nfs/dbraw/zinc/89/78/71/385897871.db2.gz DSBUUBCNYJXQFZ-AWEZNQCLSA-N 1 1 221.319 3.573 20 0 BHADMO FCCCC[N@H+]1CCC[C@@H]1c1ccccc1 ZINC000285064479 385898041 /nfs/dbraw/zinc/89/80/41/385898041.db2.gz DSBUUBCNYJXQFZ-CQSZACIVSA-N 1 1 221.319 3.573 20 0 BHADMO CCCc1[nH+]ccn1Cc1sccc1Cl ZINC000285066336 387251206 /nfs/dbraw/zinc/25/12/06/387251206.db2.gz GRPWWZHKQOSQGK-UHFFFAOYSA-N 1 1 240.759 3.599 20 0 BHADMO C[C@H](c1ccc(F)cc1)[N@@H+](C)CCCCF ZINC000285185711 177033627 /nfs/dbraw/zinc/03/36/27/177033627.db2.gz NIDUSCQITKHIIM-LLVKDONJSA-N 1 1 227.298 3.568 20 0 BHADMO C[C@@H](c1ccc(F)cc1)[N@@H+](C)CCCCF ZINC000285185715 176015638 /nfs/dbraw/zinc/01/56/38/176015638.db2.gz NIDUSCQITKHIIM-NSHDSACASA-N 1 1 227.298 3.568 20 0 BHADMO c1coc(C2=CCC[N@H+](Cc3cccs3)C2)c1 ZINC000285199793 385905428 /nfs/dbraw/zinc/90/54/28/385905428.db2.gz CXMPEAKICVFOBS-UHFFFAOYSA-N 1 1 245.347 3.630 20 0 BHADMO CC[N@@H+](Cc1cc(-c2ccccc2)on1)C(C)C ZINC000285247662 352031669 /nfs/dbraw/zinc/03/16/69/352031669.db2.gz YWKPUYHRAXJWQT-UHFFFAOYSA-N 1 1 244.338 3.572 20 0 BHADMO CC[N@@H+](CCCCF)[C@H](C)Cc1ccsc1 ZINC000285292022 385912476 /nfs/dbraw/zinc/91/24/76/385912476.db2.gz LGFAPPCDMVTPRC-GFCCVEGCSA-N 1 1 243.391 3.751 20 0 BHADMO CC[N@@H+](CCCCF)[C@@H](C)Cc1ccsc1 ZINC000285292024 385913498 /nfs/dbraw/zinc/91/34/98/385913498.db2.gz LGFAPPCDMVTPRC-LBPRGKRZSA-N 1 1 243.391 3.751 20 0 BHADMO C[C@@H](c1ccc(F)c(F)c1)[N@@H+](C)CCCCF ZINC000285303116 176014493 /nfs/dbraw/zinc/01/44/93/176014493.db2.gz UWGSJSWNZLWXDK-JTQLQIEISA-N 1 1 245.288 3.707 20 0 BHADMO C[C@H](c1ccc(F)c(F)c1)[N@@H+](C)CCCCF ZINC000285303117 177033022 /nfs/dbraw/zinc/03/30/22/177033022.db2.gz UWGSJSWNZLWXDK-SNVBAGLBSA-N 1 1 245.288 3.707 20 0 BHADMO FCCCC[N@H+]1CCC[C@H]1c1ccc(F)cc1 ZINC000285338895 385915419 /nfs/dbraw/zinc/91/54/19/385915419.db2.gz YEVNPORPOSYFCX-AWEZNQCLSA-N 1 1 239.309 3.712 20 0 BHADMO FCCCC[N@H+]1CCC[C@@H]1c1ccc(F)cc1 ZINC000285338896 385916146 /nfs/dbraw/zinc/91/61/46/385916146.db2.gz YEVNPORPOSYFCX-CQSZACIVSA-N 1 1 239.309 3.712 20 0 BHADMO C[C@@H](c1cc(F)ccc1F)[N@@H+](C)CCCCF ZINC000285363973 176013488 /nfs/dbraw/zinc/01/34/88/176013488.db2.gz AKGISBXFOCCTSU-JTQLQIEISA-N 1 1 245.288 3.707 20 0 BHADMO C[C@H](c1cc(F)ccc1F)[N@@H+](C)CCCCF ZINC000285363984 177032256 /nfs/dbraw/zinc/03/22/56/177032256.db2.gz AKGISBXFOCCTSU-SNVBAGLBSA-N 1 1 245.288 3.707 20 0 BHADMO FCCCCC[N@H+]1CCC=C(c2ccco2)C1 ZINC000285433093 370687735 /nfs/dbraw/zinc/68/77/35/370687735.db2.gz WWFXKDANMDMCSD-UHFFFAOYSA-N 1 1 237.318 3.509 20 0 BHADMO C[C@H](c1ccco1)[N@@H+](CCCCF)C1CC1 ZINC000285483664 177047443 /nfs/dbraw/zinc/04/74/43/177047443.db2.gz CVRQLAKLMDGMGF-LLVKDONJSA-N 1 1 225.307 3.555 20 0 BHADMO C[C@@H](c1ccco1)[N@@H+](CCCCF)C1CC1 ZINC000285483666 176031795 /nfs/dbraw/zinc/03/17/95/176031795.db2.gz CVRQLAKLMDGMGF-NSHDSACASA-N 1 1 225.307 3.555 20 0 BHADMO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2cc(C)ccn2)o1 ZINC000285734964 385961435 /nfs/dbraw/zinc/96/14/35/385961435.db2.gz QVQBILSULBVTJF-CHWSQXEVSA-N 1 1 244.338 3.703 20 0 BHADMO Cc1ccc([C@H](C)[NH2+][C@H](C)c2cc(C)ccn2)o1 ZINC000285734971 385962176 /nfs/dbraw/zinc/96/21/76/385962176.db2.gz QVQBILSULBVTJF-OLZOCXBDSA-N 1 1 244.338 3.703 20 0 BHADMO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2cc(C)ccn2)o1 ZINC000285734979 385961191 /nfs/dbraw/zinc/96/11/91/385961191.db2.gz QVQBILSULBVTJF-QWHCGFSZSA-N 1 1 244.338 3.703 20 0 BHADMO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2cc(C)ccn2)o1 ZINC000285734986 385962039 /nfs/dbraw/zinc/96/20/39/385962039.db2.gz QVQBILSULBVTJF-STQMWFEESA-N 1 1 244.338 3.703 20 0 BHADMO C[C@H](c1ccccc1F)[N@@H+](C)CCCCF ZINC000285883975 177041470 /nfs/dbraw/zinc/04/14/70/177041470.db2.gz FUICZBZXUOFDLR-LLVKDONJSA-N 1 1 227.298 3.568 20 0 BHADMO C[C@@H](c1ccccc1F)[N@@H+](C)CCCCF ZINC000285883984 176024633 /nfs/dbraw/zinc/02/46/33/176024633.db2.gz FUICZBZXUOFDLR-NSHDSACASA-N 1 1 227.298 3.568 20 0 BHADMO FCCCC[N@H+]1CCC[C@@H]1c1ccsc1 ZINC000285914565 385978595 /nfs/dbraw/zinc/97/85/95/385978595.db2.gz HPKSIHIDXMPEJW-GFCCVEGCSA-N 1 1 227.348 3.635 20 0 BHADMO FCCCC[N@H+]1CCC[C@H]1c1ccsc1 ZINC000285914574 385978108 /nfs/dbraw/zinc/97/81/08/385978108.db2.gz HPKSIHIDXMPEJW-LBPRGKRZSA-N 1 1 227.348 3.635 20 0 BHADMO FCCCC[N@@H+](Cc1ccco1)C1CCCC1 ZINC000285954957 385980786 /nfs/dbraw/zinc/98/07/86/385980786.db2.gz KGSPCVAASTWMDE-UHFFFAOYSA-N 1 1 239.334 3.774 20 0 BHADMO CC[C@@H]([NH2+]Cc1nccs1)c1cccc(C)c1 ZINC000286091230 359351356 /nfs/dbraw/zinc/35/13/56/359351356.db2.gz MSQDRWVSPBHGIC-CYBMUJFWSA-N 1 1 246.379 3.692 20 0 BHADMO CC[C@H]([NH2+]Cc1nccs1)c1cccc(C)c1 ZINC000286091235 387314935 /nfs/dbraw/zinc/31/49/35/387314935.db2.gz MSQDRWVSPBHGIC-ZDUSSCGKSA-N 1 1 246.379 3.692 20 0 BHADMO CCc1ccc[nH+]c1N[C@H](C)c1cc(C)ccn1 ZINC000286325168 386025602 /nfs/dbraw/zinc/02/56/02/386025602.db2.gz YEMPWDUQBXYIIH-GFCCVEGCSA-N 1 1 241.338 3.521 20 0 BHADMO CCc1ccc[nH+]c1N[C@@H](C)c1cc(C)ccn1 ZINC000286325171 386024986 /nfs/dbraw/zinc/02/49/86/386024986.db2.gz YEMPWDUQBXYIIH-LBPRGKRZSA-N 1 1 241.338 3.521 20 0 BHADMO C[N@@H+](CCCCF)Cc1cc2ccccc2o1 ZINC000286367049 386028713 /nfs/dbraw/zinc/02/87/13/386028713.db2.gz JQPBMRFRZBHZTP-UHFFFAOYSA-N 1 1 235.302 3.614 20 0 BHADMO FCCCC[N@H+]1CC[C@@H]1c1ccc(Cl)cc1 ZINC000286477102 386044762 /nfs/dbraw/zinc/04/47/62/386044762.db2.gz PRQDOVWMWULAIA-CYBMUJFWSA-N 1 1 241.737 3.837 20 0 BHADMO FCCCC[N@H+]1CC[C@H]1c1ccc(Cl)cc1 ZINC000286477103 386044526 /nfs/dbraw/zinc/04/45/26/386044526.db2.gz PRQDOVWMWULAIA-ZDUSSCGKSA-N 1 1 241.737 3.837 20 0 BHADMO Cc1nc(C)c([C@H](C)[N@@H+](C)CCCCF)s1 ZINC000286577599 386056496 /nfs/dbraw/zinc/05/64/96/386056496.db2.gz WIMNRBZSWPLUBW-JTQLQIEISA-N 1 1 244.379 3.502 20 0 BHADMO Cc1nc(C)c([C@@H](C)[N@@H+](C)CCCCF)s1 ZINC000286577608 386055089 /nfs/dbraw/zinc/05/50/89/386055089.db2.gz WIMNRBZSWPLUBW-SNVBAGLBSA-N 1 1 244.379 3.502 20 0 BHADMO C[N@@H+](Cc1cccs1)C1CCC(F)(F)CC1 ZINC000286939867 386084245 /nfs/dbraw/zinc/08/42/45/386084245.db2.gz LUCWNLACJOKHTQ-UHFFFAOYSA-N 1 1 245.338 3.758 20 0 BHADMO CC(C)[N@H+]1CC(C)(C)[C@H]1c1cccs1 ZINC000286943735 187345726 /nfs/dbraw/zinc/34/57/26/187345726.db2.gz MDTPTZVOVBBUAU-LLVKDONJSA-N 1 1 209.358 3.539 20 0 BHADMO CC(C)[N@H+]1CC(C)(C)[C@@H]1c1cccs1 ZINC000286943743 188386663 /nfs/dbraw/zinc/38/66/63/188386663.db2.gz MDTPTZVOVBBUAU-NSHDSACASA-N 1 1 209.358 3.539 20 0 BHADMO C[N@@H+](Cc1ccccc1)C1CCC(F)(F)CC1 ZINC000287026923 386090904 /nfs/dbraw/zinc/09/09/04/386090904.db2.gz RVTGKGQEEWKWNF-UHFFFAOYSA-N 1 1 239.309 3.696 20 0 BHADMO C[C@H](CF)[NH2+]Cc1ccc(Oc2ccccc2)o1 ZINC000288334342 386187349 /nfs/dbraw/zinc/18/73/49/386187349.db2.gz AVUOTJCZFBYDLJ-LLVKDONJSA-N 1 1 249.285 3.520 20 0 BHADMO C[C@@H](CF)[NH2+]Cc1ccc(Oc2ccccc2)o1 ZINC000288334346 386188768 /nfs/dbraw/zinc/18/87/68/386188768.db2.gz AVUOTJCZFBYDLJ-NSHDSACASA-N 1 1 249.285 3.520 20 0 BHADMO C[C@H](CF)[NH2+]Cc1c(Cl)oc2ccccc21 ZINC000288371655 386755003 /nfs/dbraw/zinc/75/50/03/386755003.db2.gz FEUZLKIMSHVWGF-MRVPVSSYSA-N 1 1 241.693 3.534 20 0 BHADMO C[C@@H](CF)[NH2+]Cc1c(Cl)oc2ccccc21 ZINC000288371656 386756518 /nfs/dbraw/zinc/75/65/18/386756518.db2.gz FEUZLKIMSHVWGF-QMMMGPOBSA-N 1 1 241.693 3.534 20 0 BHADMO Cc1ccncc1CCC[N@H+](C)C1CCCCC1 ZINC000289024237 566383834 /nfs/dbraw/zinc/38/38/34/566383834.db2.gz GMXBMOOYGIBDQV-UHFFFAOYSA-N 1 1 246.398 3.587 20 0 BHADMO CC[N@@H+](CCCc1cnccc1C)C1CCCC1 ZINC000289096809 386259792 /nfs/dbraw/zinc/25/97/92/386259792.db2.gz LTLCWIZLLSEEFV-UHFFFAOYSA-N 1 1 246.398 3.587 20 0 BHADMO CSC1(C[N@@H+](C)[C@@H](C)c2cccs2)CC1 ZINC000289229753 386274271 /nfs/dbraw/zinc/27/42/71/386274271.db2.gz YJRFYLPNZRTKMA-JTQLQIEISA-N 1 1 241.425 3.637 20 0 BHADMO CSC1(C[N@@H+](C)[C@H](C)c2cccs2)CC1 ZINC000289229758 386274173 /nfs/dbraw/zinc/27/41/73/386274173.db2.gz YJRFYLPNZRTKMA-SNVBAGLBSA-N 1 1 241.425 3.637 20 0 BHADMO CCC(=O)CCC[N@H+]1CCC[C@H]1c1ccccc1 ZINC000289343016 168198985 /nfs/dbraw/zinc/19/89/85/168198985.db2.gz MBDNIBRWWCKHPH-INIZCTEOSA-N 1 1 245.366 3.583 20 0 BHADMO CCC(=O)CCC[N@H+]1CCC[C@@H]1c1ccccc1 ZINC000289343023 168197966 /nfs/dbraw/zinc/19/79/66/168197966.db2.gz MBDNIBRWWCKHPH-MRXNPFEDSA-N 1 1 245.366 3.583 20 0 BHADMO CC1=C(C)C[N@@H+](Cc2cc(C(C)(C)C)on2)CC1 ZINC000289384015 168086086 /nfs/dbraw/zinc/08/60/86/168086086.db2.gz LOKNIRRIYZKJSF-UHFFFAOYSA-N 1 1 248.370 3.514 20 0 BHADMO CC1=C(C)C[N@H+](Cc2cc(C(C)(C)C)on2)CC1 ZINC000289384015 168086084 /nfs/dbraw/zinc/08/60/84/168086084.db2.gz LOKNIRRIYZKJSF-UHFFFAOYSA-N 1 1 248.370 3.514 20 0 BHADMO c1csc(CNc2cc(C3CC3)cc[nH+]2)c1 ZINC000289416620 183520736 /nfs/dbraw/zinc/52/07/36/183520736.db2.gz AWYXNAJRHXPOEA-UHFFFAOYSA-N 1 1 230.336 3.633 20 0 BHADMO C[N@@H+](Cc1csc(Cl)n1)C1CCCCC1 ZINC000289510054 386319764 /nfs/dbraw/zinc/31/97/64/386319764.db2.gz FJHVVMYHSICCID-UHFFFAOYSA-N 1 1 244.791 3.561 20 0 BHADMO C[N@H+](Cc1csc(Cl)n1)C1CCCCC1 ZINC000289510054 386319757 /nfs/dbraw/zinc/31/97/57/386319757.db2.gz FJHVVMYHSICCID-UHFFFAOYSA-N 1 1 244.791 3.561 20 0 BHADMO C[C@@H](c1ccccc1)[N@H+]1CCC(F)(F)[C@H](C)C1 ZINC000289802750 176020721 /nfs/dbraw/zinc/02/07/21/176020721.db2.gz MZWKWBQBUCNVDF-NEPJUHHUSA-N 1 1 239.309 3.725 20 0 BHADMO C[C@H](c1ccccc1)[N@H+]1CCC(F)(F)[C@@H](C)C1 ZINC000289802753 177274773 /nfs/dbraw/zinc/27/47/73/177274773.db2.gz MZWKWBQBUCNVDF-NWDGAFQWSA-N 1 1 239.309 3.725 20 0 BHADMO C[C@@H](c1ccccc1)[N@H+]1CCC(F)(F)[C@@H](C)C1 ZINC000289802755 176021003 /nfs/dbraw/zinc/02/10/03/176021003.db2.gz MZWKWBQBUCNVDF-RYUDHWBXSA-N 1 1 239.309 3.725 20 0 BHADMO C[C@H](c1ccccc1)[N@H+]1CCC(F)(F)[C@H](C)C1 ZINC000289802759 177038638 /nfs/dbraw/zinc/03/86/38/177038638.db2.gz MZWKWBQBUCNVDF-VXGBXAGGSA-N 1 1 239.309 3.725 20 0 BHADMO c1cc([C@H]2CCC[N@@H+]2C[C@@H]2CC=CCC2)ccn1 ZINC000289821884 188211008 /nfs/dbraw/zinc/21/10/08/188211008.db2.gz OEOPBSOWUBEPSN-GDBMZVCRSA-N 1 1 242.366 3.575 20 0 BHADMO c1cc([C@H]2CCC[N@@H+]2C[C@H]2CC=CCC2)ccn1 ZINC000289821888 386359830 /nfs/dbraw/zinc/35/98/30/386359830.db2.gz OEOPBSOWUBEPSN-GOEBONIOSA-N 1 1 242.366 3.575 20 0 BHADMO c1cc([C@@H]2CCC[N@@H+]2C[C@H]2CC=CCC2)ccn1 ZINC000289821891 188211157 /nfs/dbraw/zinc/21/11/57/188211157.db2.gz OEOPBSOWUBEPSN-HOCLYGCPSA-N 1 1 242.366 3.575 20 0 BHADMO c1cc([C@@H]2CCC[N@@H+]2C[C@@H]2CC=CCC2)ccn1 ZINC000289821896 188036285 /nfs/dbraw/zinc/03/62/85/188036285.db2.gz OEOPBSOWUBEPSN-ZBFHGGJFSA-N 1 1 242.366 3.575 20 0 BHADMO c1cc(CNc2cc(C3CC3)cc[nH+]2)cs1 ZINC000289846449 183334079 /nfs/dbraw/zinc/33/40/79/183334079.db2.gz PHSMHAGOJWZNAD-UHFFFAOYSA-N 1 1 230.336 3.633 20 0 BHADMO CCC[C@H](C)C[N@H+]1CCC[C@@H]1c1ccncc1 ZINC000289858216 386363993 /nfs/dbraw/zinc/36/39/93/386363993.db2.gz QKAUPBGWVKBDHS-DZGCQCFKSA-N 1 1 232.371 3.655 20 0 BHADMO CCC[C@@H](C)C[N@H+]1CCC[C@H]1c1ccncc1 ZINC000289858221 169357861 /nfs/dbraw/zinc/35/78/61/169357861.db2.gz QKAUPBGWVKBDHS-HIFRSBDPSA-N 1 1 232.371 3.655 20 0 BHADMO CCC[C@@H](C)C[N@H+]1CCC[C@@H]1c1ccncc1 ZINC000289858224 169358341 /nfs/dbraw/zinc/35/83/41/169358341.db2.gz QKAUPBGWVKBDHS-UKRRQHHQSA-N 1 1 232.371 3.655 20 0 BHADMO CCC[C@H](C)C[N@H+]1CCC[C@H]1c1ccncc1 ZINC000289858227 386365340 /nfs/dbraw/zinc/36/53/40/386365340.db2.gz QKAUPBGWVKBDHS-ZFWWWQNUSA-N 1 1 232.371 3.655 20 0 BHADMO C[C@@H](Nc1cc(C2CC2)cc[nH+]1)c1ccncc1 ZINC000290099223 386393528 /nfs/dbraw/zinc/39/35/28/386393528.db2.gz HVZZRZWNOIKROQ-LLVKDONJSA-N 1 1 239.322 3.527 20 0 BHADMO C[C@H](Nc1cc(C2CC2)cc[nH+]1)c1ccncc1 ZINC000290099226 386392619 /nfs/dbraw/zinc/39/26/19/386392619.db2.gz HVZZRZWNOIKROQ-NSHDSACASA-N 1 1 239.322 3.527 20 0 BHADMO C[N@@H+](Cc1ccsc1)C1CCC(F)(F)CC1 ZINC000290124078 386396147 /nfs/dbraw/zinc/39/61/47/386396147.db2.gz JBYXMBMVSUMBIK-UHFFFAOYSA-N 1 1 245.338 3.758 20 0 BHADMO Cc1ccc(C[N@H+](C)C2CCC(F)(F)CC2)o1 ZINC000290200746 386407166 /nfs/dbraw/zinc/40/71/66/386407166.db2.gz POGLFFLZSYWQHY-UHFFFAOYSA-N 1 1 243.297 3.598 20 0 BHADMO C[C@@H](Nc1cc(C2CC2)cc[nH+]1)c1cccnc1 ZINC000290227183 386410045 /nfs/dbraw/zinc/41/00/45/386410045.db2.gz RKEIFOOCPZRPPT-LLVKDONJSA-N 1 1 239.322 3.527 20 0 BHADMO C[C@H](Nc1cc(C2CC2)cc[nH+]1)c1cccnc1 ZINC000290227185 386410057 /nfs/dbraw/zinc/41/00/57/386410057.db2.gz RKEIFOOCPZRPPT-NSHDSACASA-N 1 1 239.322 3.527 20 0 BHADMO Cc1ccoc1C[N@H+](C)C1CCC(F)(F)CC1 ZINC000290229715 386409786 /nfs/dbraw/zinc/40/97/86/386409786.db2.gz STSXXSISVYNRAE-UHFFFAOYSA-N 1 1 243.297 3.598 20 0 BHADMO C[C@@H](Nc1cc(C2CC2)cc[nH+]1)c1ccccn1 ZINC000290261207 386413447 /nfs/dbraw/zinc/41/34/47/386413447.db2.gz VECNEBARFXITHK-LLVKDONJSA-N 1 1 239.322 3.527 20 0 BHADMO C[C@H](Nc1cc(C2CC2)cc[nH+]1)c1ccccn1 ZINC000290261210 386413373 /nfs/dbraw/zinc/41/33/73/386413373.db2.gz VECNEBARFXITHK-NSHDSACASA-N 1 1 239.322 3.527 20 0 BHADMO C[C@@H](Nc1cc(C2CC2)cc[nH+]1)c1nccs1 ZINC000290262170 386413406 /nfs/dbraw/zinc/41/34/06/386413406.db2.gz VGXXQKOKCLGDIA-SECBINFHSA-N 1 1 245.351 3.589 20 0 BHADMO C[C@H](Nc1cc(C2CC2)cc[nH+]1)c1nccs1 ZINC000290262173 386413217 /nfs/dbraw/zinc/41/32/17/386413217.db2.gz VGXXQKOKCLGDIA-VIFPVBQESA-N 1 1 245.351 3.589 20 0 BHADMO C[C@@H](Nc1cc(C2CC2)cc[nH+]1)c1cscn1 ZINC000290282903 386416463 /nfs/dbraw/zinc/41/64/63/386416463.db2.gz XHYUMODMNZLNBC-SECBINFHSA-N 1 1 245.351 3.589 20 0 BHADMO C[C@H](Nc1cc(C2CC2)cc[nH+]1)c1cscn1 ZINC000290282906 386417112 /nfs/dbraw/zinc/41/71/12/386417112.db2.gz XHYUMODMNZLNBC-VIFPVBQESA-N 1 1 245.351 3.589 20 0 BHADMO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1ccsc1 ZINC000290328703 352220502 /nfs/dbraw/zinc/22/05/02/352220502.db2.gz DMGYVGYQDMAQDG-AWEZNQCLSA-N 1 1 246.379 3.726 20 0 BHADMO CC[C@H](c1ccncc1)[N@@H+](C)Cc1ccsc1 ZINC000290328705 487751114 /nfs/dbraw/zinc/75/11/14/487751114.db2.gz DMGYVGYQDMAQDG-CQSZACIVSA-N 1 1 246.379 3.726 20 0 BHADMO CC[N@@H+](Cc1ccc(C)o1)[C@H](C)c1cccnc1 ZINC000290330269 352221377 /nfs/dbraw/zinc/22/13/77/352221377.db2.gz DPTLPFLIWNAJTN-CYBMUJFWSA-N 1 1 244.338 3.566 20 0 BHADMO CC[N@@H+](Cc1ccc(C)o1)[C@@H](C)c1cccnc1 ZINC000290330272 352221071 /nfs/dbraw/zinc/22/10/71/352221071.db2.gz DPTLPFLIWNAJTN-ZDUSSCGKSA-N 1 1 244.338 3.566 20 0 BHADMO CC[N@@H+](Cc1ccnc(Cl)c1Cl)C(C)C ZINC000290360059 352221990 /nfs/dbraw/zinc/22/19/90/352221990.db2.gz GQCUVTRDRNGOPN-UHFFFAOYSA-N 1 1 247.169 3.619 20 0 BHADMO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1occc1C ZINC000290367997 352221859 /nfs/dbraw/zinc/22/18/59/352221859.db2.gz HFTGGDGCYURELF-AWEZNQCLSA-N 1 1 244.338 3.566 20 0 BHADMO CC[C@H](c1ccncc1)[N@@H+](C)Cc1occc1C ZINC000290368007 386426177 /nfs/dbraw/zinc/42/61/77/386426177.db2.gz HFTGGDGCYURELF-CQSZACIVSA-N 1 1 244.338 3.566 20 0 BHADMO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1ccc(C)o1 ZINC000290421498 352223871 /nfs/dbraw/zinc/22/38/71/352223871.db2.gz KSLYHFUAVIMMNY-HNNXBMFYSA-N 1 1 244.338 3.566 20 0 BHADMO CC[C@H](c1ccncc1)[N@@H+](C)Cc1ccc(C)o1 ZINC000290421500 386431889 /nfs/dbraw/zinc/43/18/89/386431889.db2.gz KSLYHFUAVIMMNY-OAHLLOKOSA-N 1 1 244.338 3.566 20 0 BHADMO CCC[N@@H+](CC)Cc1ccnc(Cl)c1Cl ZINC000290475304 169129682 /nfs/dbraw/zinc/12/96/82/169129682.db2.gz QMAQEXAHJRPPQE-UHFFFAOYSA-N 1 1 247.169 3.620 20 0 BHADMO CSC1(C[N@@H+](C)[C@H](C)c2ccco2)CCC1 ZINC000290521831 386447451 /nfs/dbraw/zinc/44/74/51/386447451.db2.gz USDWCVORUGYGTH-LLVKDONJSA-N 1 1 239.384 3.558 20 0 BHADMO CSC1(C[N@@H+](C)[C@@H](C)c2ccco2)CCC1 ZINC000290521833 386445252 /nfs/dbraw/zinc/44/52/52/386445252.db2.gz USDWCVORUGYGTH-NSHDSACASA-N 1 1 239.384 3.558 20 0 BHADMO CCCC[N@@H+](C)Cc1ccnc(Cl)c1Cl ZINC000290523641 386445036 /nfs/dbraw/zinc/44/50/36/386445036.db2.gz UVFONGWMPXDTLQ-UHFFFAOYSA-N 1 1 247.169 3.620 20 0 BHADMO CCCC[N@H+](C)Cc1ccnc(Cl)c1Cl ZINC000290523641 386445030 /nfs/dbraw/zinc/44/50/30/386445030.db2.gz UVFONGWMPXDTLQ-UHFFFAOYSA-N 1 1 247.169 3.620 20 0 BHADMO CC[C@H](c1ccncc1)[N@@H+](C)C[C@@H]1CC=CCC1 ZINC000290613121 386459625 /nfs/dbraw/zinc/45/96/25/386459625.db2.gz WRZIYHAGCUNWRB-GDBMZVCRSA-N 1 1 244.382 3.821 20 0 BHADMO CC[C@H](c1ccncc1)[N@@H+](C)C[C@H]1CC=CCC1 ZINC000290613122 171600428 /nfs/dbraw/zinc/60/04/28/171600428.db2.gz WRZIYHAGCUNWRB-GOEBONIOSA-N 1 1 244.382 3.821 20 0 BHADMO CC[C@@H](c1ccncc1)[N@@H+](C)C[C@H]1CC=CCC1 ZINC000290613125 352232106 /nfs/dbraw/zinc/23/21/06/352232106.db2.gz WRZIYHAGCUNWRB-HOCLYGCPSA-N 1 1 244.382 3.821 20 0 BHADMO CC[C@@H](c1ccncc1)[N@@H+](C)C[C@@H]1CC=CCC1 ZINC000290613127 352232161 /nfs/dbraw/zinc/23/21/61/352232161.db2.gz WRZIYHAGCUNWRB-ZBFHGGJFSA-N 1 1 244.382 3.821 20 0 BHADMO CC[N@@H+](C[C@H]1CC=CCC1)[C@H](C)c1cccnc1 ZINC000290618674 386458108 /nfs/dbraw/zinc/45/81/08/386458108.db2.gz XAVOGTYUEYBNHS-CABCVRRESA-N 1 1 244.382 3.821 20 0 BHADMO CC[N@@H+](C[C@H]1CC=CCC1)[C@@H](C)c1cccnc1 ZINC000290618677 386459998 /nfs/dbraw/zinc/45/99/98/386459998.db2.gz XAVOGTYUEYBNHS-GJZGRUSLSA-N 1 1 244.382 3.821 20 0 BHADMO CC[N@@H+](C[C@@H]1CC=CCC1)[C@H](C)c1cccnc1 ZINC000290618680 386459889 /nfs/dbraw/zinc/45/98/89/386459889.db2.gz XAVOGTYUEYBNHS-HUUCEWRRSA-N 1 1 244.382 3.821 20 0 BHADMO CC[N@@H+](C[C@@H]1CC=CCC1)[C@@H](C)c1cccnc1 ZINC000290618681 386460299 /nfs/dbraw/zinc/46/02/99/386460299.db2.gz XAVOGTYUEYBNHS-LSDHHAIUSA-N 1 1 244.382 3.821 20 0 BHADMO CC[N@@H+](Cc1occc1C)[C@H](C)c1cccnc1 ZINC000290649987 352233216 /nfs/dbraw/zinc/23/32/16/352233216.db2.gz ZBLWDDKQBBGYSH-CYBMUJFWSA-N 1 1 244.338 3.566 20 0 BHADMO CC[N@@H+](Cc1occc1C)[C@@H](C)c1cccnc1 ZINC000290650000 352233351 /nfs/dbraw/zinc/23/33/51/352233351.db2.gz ZBLWDDKQBBGYSH-ZDUSSCGKSA-N 1 1 244.338 3.566 20 0 BHADMO CC[N@@H+](Cc1ccsc1)[C@H](C)c1cccnc1 ZINC000290659758 352234222 /nfs/dbraw/zinc/23/42/22/352234222.db2.gz ZOMTVRVNZBBOET-GFCCVEGCSA-N 1 1 246.379 3.726 20 0 BHADMO CC[N@@H+](Cc1ccsc1)[C@@H](C)c1cccnc1 ZINC000290659760 352233779 /nfs/dbraw/zinc/23/37/79/352233779.db2.gz ZOMTVRVNZBBOET-LBPRGKRZSA-N 1 1 246.379 3.726 20 0 BHADMO c1cc(C[N@H+]2CC3(CCC3)[C@H]2C2CC2)cs1 ZINC000291003693 183340763 /nfs/dbraw/zinc/34/07/63/183340763.db2.gz BBWNCCSIAOUOMW-CYBMUJFWSA-N 1 1 233.380 3.513 20 0 BHADMO c1cc(C[N@H+]2CC3(CCC3)[C@@H]2C2CC2)cs1 ZINC000291003695 183339435 /nfs/dbraw/zinc/33/94/35/183339435.db2.gz BBWNCCSIAOUOMW-ZDUSSCGKSA-N 1 1 233.380 3.513 20 0 BHADMO CC[N@@H+](Cc1cnc(Cl)s1)CC(C)(C)C ZINC000291342289 346368629 /nfs/dbraw/zinc/36/86/29/346368629.db2.gz WXHSCWKJNBQKPO-UHFFFAOYSA-N 1 1 246.807 3.665 20 0 BHADMO Cc1ccc(C[N@H+]2CCC(F)(F)[C@H](C)C2)s1 ZINC000291497212 386553113 /nfs/dbraw/zinc/55/31/13/386553113.db2.gz HDGABEKYPBKIAE-SECBINFHSA-N 1 1 245.338 3.534 20 0 BHADMO Cc1ccc(C[N@H+]2CCC(F)(F)[C@@H](C)C2)s1 ZINC000291497216 386552180 /nfs/dbraw/zinc/55/21/80/386552180.db2.gz HDGABEKYPBKIAE-VIFPVBQESA-N 1 1 245.338 3.534 20 0 BHADMO Cc1ccsc1C[N@H+]1CCC(F)(F)[C@@H](C)C1 ZINC000291626575 386559865 /nfs/dbraw/zinc/55/98/65/386559865.db2.gz SAFJFESRFFDLBK-JTQLQIEISA-N 1 1 245.338 3.534 20 0 BHADMO Cc1ccsc1C[N@H+]1CCC(F)(F)[C@H](C)C1 ZINC000291626584 386561608 /nfs/dbraw/zinc/56/16/08/386561608.db2.gz SAFJFESRFFDLBK-SNVBAGLBSA-N 1 1 245.338 3.534 20 0 BHADMO c1csc(C[N@H+]2CC3(CCC3)[C@H]2C2CC2)c1 ZINC000291629464 386561219 /nfs/dbraw/zinc/56/12/19/386561219.db2.gz SHEZYFCECNAOLW-CYBMUJFWSA-N 1 1 233.380 3.513 20 0 BHADMO c1csc(C[N@H+]2CC3(CCC3)[C@@H]2C2CC2)c1 ZINC000291629465 386559835 /nfs/dbraw/zinc/55/98/35/386559835.db2.gz SHEZYFCECNAOLW-ZDUSSCGKSA-N 1 1 233.380 3.513 20 0 BHADMO Cc1ccoc1C[NH2+]C(C)(C)c1ccccc1F ZINC000291663551 386567372 /nfs/dbraw/zinc/56/73/72/386567372.db2.gz FJNKBECXTJPYBF-UHFFFAOYSA-N 1 1 247.313 3.752 20 0 BHADMO Fc1cc(C2CC2)ccc1C[NH2+]Cc1ccco1 ZINC000291750037 386577918 /nfs/dbraw/zinc/57/79/18/386577918.db2.gz QCBVCFRSVRRPKA-UHFFFAOYSA-N 1 1 245.297 3.586 20 0 BHADMO Cc1ccc(C[NH2+]C(C)(C)c2ccccc2F)o1 ZINC000291753938 386578619 /nfs/dbraw/zinc/57/86/19/386578619.db2.gz QNYHNDCPMMFBBW-UHFFFAOYSA-N 1 1 247.313 3.752 20 0 BHADMO Cc1ccoc1C[NH2+]Cc1sccc1Cl ZINC000291804174 385723779 /nfs/dbraw/zinc/72/37/79/385723779.db2.gz XOYOKIGDJTZLQF-UHFFFAOYSA-N 1 1 241.743 3.593 20 0 BHADMO CC(C)[N@@H+](Cc1ccno1)[C@H](C)c1ccccc1 ZINC000292113872 188212350 /nfs/dbraw/zinc/21/23/50/188212350.db2.gz HKOPDKFMXVACNI-CYBMUJFWSA-N 1 1 244.338 3.646 20 0 BHADMO CC(C)[N@@H+](Cc1ccno1)[C@@H](C)c1ccccc1 ZINC000292113873 386621405 /nfs/dbraw/zinc/62/14/05/386621405.db2.gz HKOPDKFMXVACNI-ZDUSSCGKSA-N 1 1 244.338 3.646 20 0 BHADMO Cc1c2ccsc2nc2c1[C@@H](C)[N@H+](C)C[C@H]2C ZINC000292114565 386620275 /nfs/dbraw/zinc/62/02/75/386620275.db2.gz QTYNRGQZVZCTGA-PSASIEDQSA-N 1 1 246.379 3.715 20 0 BHADMO Cc1c2ccsc2nc2c1[C@@H](C)[N@@H+](C)C[C@H]2C ZINC000292114565 386620269 /nfs/dbraw/zinc/62/02/69/386620269.db2.gz QTYNRGQZVZCTGA-PSASIEDQSA-N 1 1 246.379 3.715 20 0 BHADMO Cc1c2ccsc2nc2c1[C@H](C)[N@H+](C)C[C@H]2C ZINC000292114569 386619912 /nfs/dbraw/zinc/61/99/12/386619912.db2.gz QTYNRGQZVZCTGA-SCZZXKLOSA-N 1 1 246.379 3.715 20 0 BHADMO Cc1c2ccsc2nc2c1[C@H](C)[N@@H+](C)C[C@H]2C ZINC000292114569 386619907 /nfs/dbraw/zinc/61/99/07/386619907.db2.gz QTYNRGQZVZCTGA-SCZZXKLOSA-N 1 1 246.379 3.715 20 0 BHADMO Cc1c2ccsc2nc2c1[C@@H](C)[N@H+](C)C[C@@H]2C ZINC000292114573 386619033 /nfs/dbraw/zinc/61/90/33/386619033.db2.gz QTYNRGQZVZCTGA-WCBMZHEXSA-N 1 1 246.379 3.715 20 0 BHADMO Cc1c2ccsc2nc2c1[C@@H](C)[N@@H+](C)C[C@@H]2C ZINC000292114573 386619030 /nfs/dbraw/zinc/61/90/30/386619030.db2.gz QTYNRGQZVZCTGA-WCBMZHEXSA-N 1 1 246.379 3.715 20 0 BHADMO Cc1c2ccsc2nc2c1[C@H](C)[N@H+](C)C[C@@H]2C ZINC000292114577 386621092 /nfs/dbraw/zinc/62/10/92/386621092.db2.gz QTYNRGQZVZCTGA-WPRPVWTQSA-N 1 1 246.379 3.715 20 0 BHADMO Cc1c2ccsc2nc2c1[C@H](C)[N@@H+](C)C[C@@H]2C ZINC000292114577 386621088 /nfs/dbraw/zinc/62/10/88/386621088.db2.gz QTYNRGQZVZCTGA-WPRPVWTQSA-N 1 1 246.379 3.715 20 0 BHADMO CC(C)[N@@H+](Cc1ccon1)[C@H](C)c1ccccc1 ZINC000292118416 386620011 /nfs/dbraw/zinc/62/00/11/386620011.db2.gz HTZDJCUDGMUUQP-CYBMUJFWSA-N 1 1 244.338 3.646 20 0 BHADMO CC(C)[N@H+](Cc1ccon1)[C@H](C)c1ccccc1 ZINC000292118416 386620002 /nfs/dbraw/zinc/62/00/02/386620002.db2.gz HTZDJCUDGMUUQP-CYBMUJFWSA-N 1 1 244.338 3.646 20 0 BHADMO CC(C)[N@@H+](Cc1ccon1)[C@@H](C)c1ccccc1 ZINC000292118418 188212343 /nfs/dbraw/zinc/21/23/43/188212343.db2.gz HTZDJCUDGMUUQP-ZDUSSCGKSA-N 1 1 244.338 3.646 20 0 BHADMO CC(C)[N@H+](Cc1ccon1)[C@@H](C)c1ccccc1 ZINC000292118418 188212342 /nfs/dbraw/zinc/21/23/42/188212342.db2.gz HTZDJCUDGMUUQP-ZDUSSCGKSA-N 1 1 244.338 3.646 20 0 BHADMO Cc1ccoc1C[N@@H+](C)CCCCC(F)(F)F ZINC000292133153 386623308 /nfs/dbraw/zinc/62/33/08/386623308.db2.gz IPSOMZMWCJDACZ-UHFFFAOYSA-N 1 1 249.276 3.752 20 0 BHADMO COCCCC[N@@H+](C(C)C)[C@@H](C)c1ccccc1 ZINC000292208663 174187810 /nfs/dbraw/zinc/18/78/10/174187810.db2.gz OFTWMTAYMFBTFS-HNNXBMFYSA-N 1 1 249.398 3.885 20 0 BHADMO COCCCC[N@@H+](C(C)C)[C@H](C)c1ccccc1 ZINC000292208667 174188781 /nfs/dbraw/zinc/18/87/81/174188781.db2.gz OFTWMTAYMFBTFS-OAHLLOKOSA-N 1 1 249.398 3.885 20 0 BHADMO CC[C@@H]1CC[N@H+]1Cc1cc(C)nc2ccccc12 ZINC000292333317 171024165 /nfs/dbraw/zinc/02/41/65/171024165.db2.gz GGFMEWANIKKVRJ-CQSZACIVSA-N 1 1 240.350 3.528 20 0 BHADMO CC[C@H](C)C[N@H+]1CC(C)(C)[C@H]1c1cccnc1 ZINC000292681889 171279106 /nfs/dbraw/zinc/27/91/06/171279106.db2.gz ASCAPRVQMKHTBR-GXTWGEPZSA-N 1 1 232.371 3.511 20 0 BHADMO CC[C@H](C)C[N@H+]1CC(C)(C)[C@@H]1c1cccnc1 ZINC000292681892 171279718 /nfs/dbraw/zinc/27/97/18/171279718.db2.gz ASCAPRVQMKHTBR-JSGCOSHPSA-N 1 1 232.371 3.511 20 0 BHADMO CC[C@@H](C)C[N@H+]1CC(C)(C)[C@@H]1c1cccnc1 ZINC000292681893 386709623 /nfs/dbraw/zinc/70/96/23/386709623.db2.gz ASCAPRVQMKHTBR-OCCSQVGLSA-N 1 1 232.371 3.511 20 0 BHADMO CC[C@@H](C)C[N@H+]1CC(C)(C)[C@H]1c1cccnc1 ZINC000292681895 386710678 /nfs/dbraw/zinc/71/06/78/386710678.db2.gz ASCAPRVQMKHTBR-TZMCWYRMSA-N 1 1 232.371 3.511 20 0 BHADMO CC(C)[N@@H+](Cc1cocn1)[C@H](C)c1ccccc1 ZINC000292715566 188037771 /nfs/dbraw/zinc/03/77/71/188037771.db2.gz DQYWWYZICUXCPZ-CYBMUJFWSA-N 1 1 244.338 3.646 20 0 BHADMO CC(C)[N@H+](Cc1cocn1)[C@H](C)c1ccccc1 ZINC000292715566 188037769 /nfs/dbraw/zinc/03/77/69/188037769.db2.gz DQYWWYZICUXCPZ-CYBMUJFWSA-N 1 1 244.338 3.646 20 0 BHADMO CC(C)[N@@H+](Cc1cocn1)[C@@H](C)c1ccccc1 ZINC000292715568 352327789 /nfs/dbraw/zinc/32/77/89/352327789.db2.gz DQYWWYZICUXCPZ-ZDUSSCGKSA-N 1 1 244.338 3.646 20 0 BHADMO CC(C)[N@H+](Cc1cocn1)[C@@H](C)c1ccccc1 ZINC000292715568 352327783 /nfs/dbraw/zinc/32/77/83/352327783.db2.gz DQYWWYZICUXCPZ-ZDUSSCGKSA-N 1 1 244.338 3.646 20 0 BHADMO CC(C)CC[N@H+]1CC(C)(C)[C@@H]1c1cccnc1 ZINC000292767130 386721981 /nfs/dbraw/zinc/72/19/81/386721981.db2.gz JYHPXQLIXHTDAR-AWEZNQCLSA-N 1 1 232.371 3.511 20 0 BHADMO CC(C)CC[N@H+]1CC(C)(C)[C@H]1c1cccnc1 ZINC000292767134 386722202 /nfs/dbraw/zinc/72/22/02/386722202.db2.gz JYHPXQLIXHTDAR-CQSZACIVSA-N 1 1 232.371 3.511 20 0 BHADMO CC[C@H]1CC[N@H+]1Cc1ccc2nc(C)ccc2c1 ZINC000292811465 398109180 /nfs/dbraw/zinc/10/91/80/398109180.db2.gz OTAVBEZUGMSFQS-HNNXBMFYSA-N 1 1 240.350 3.528 20 0 BHADMO CC[C@@H]1CC[N@H+]1Cc1ccc2nc(C)ccc2c1 ZINC000292811468 171024858 /nfs/dbraw/zinc/02/48/58/171024858.db2.gz OTAVBEZUGMSFQS-OAHLLOKOSA-N 1 1 240.350 3.528 20 0 BHADMO c1csc(CNc2cccc(C3CC3)[nH+]2)c1 ZINC000292938913 183356589 /nfs/dbraw/zinc/35/65/89/183356589.db2.gz JRAYONYFXDZGQI-UHFFFAOYSA-N 1 1 230.336 3.633 20 0 BHADMO FC[C@H]1CCC[N@H+]1Cc1ccc(C(F)F)cc1 ZINC000292994943 386760062 /nfs/dbraw/zinc/76/00/62/386760062.db2.gz INONBMSIZBJVHD-GFCCVEGCSA-N 1 1 243.272 3.558 20 0 BHADMO FC[C@@H]1CCC[N@H+]1Cc1ccc(C(F)F)cc1 ZINC000292994947 386761230 /nfs/dbraw/zinc/76/12/30/386761230.db2.gz INONBMSIZBJVHD-LBPRGKRZSA-N 1 1 243.272 3.558 20 0 BHADMO c1cc(NC[C@H]2CCSC2)[nH+]cc1C1CCC1 ZINC000293017720 183356980 /nfs/dbraw/zinc/35/69/80/183356980.db2.gz OPKRRHIZQNIVFF-LLVKDONJSA-N 1 1 248.395 3.514 20 0 BHADMO c1cc(NC[C@@H]2CCSC2)[nH+]cc1C1CCC1 ZINC000293017727 183357668 /nfs/dbraw/zinc/35/76/68/183357668.db2.gz OPKRRHIZQNIVFF-NSHDSACASA-N 1 1 248.395 3.514 20 0 BHADMO c1cc(CNc2cccc(C3CC3)[nH+]2)cs1 ZINC000293060428 183357194 /nfs/dbraw/zinc/35/71/94/183357194.db2.gz UQPLNPXNUJPPSA-UHFFFAOYSA-N 1 1 230.336 3.633 20 0 BHADMO CC[C@H]([NH2+]Cc1occc1C)c1ccccc1F ZINC000293360999 388388445 /nfs/dbraw/zinc/38/84/45/388388445.db2.gz HJJKKIHDOZXEBH-AWEZNQCLSA-N 1 1 247.313 3.968 20 0 BHADMO CC[C@@H]([NH2+]Cc1occc1C)c1ccccc1F ZINC000293361002 388387808 /nfs/dbraw/zinc/38/78/08/388387808.db2.gz HJJKKIHDOZXEBH-CQSZACIVSA-N 1 1 247.313 3.968 20 0 BHADMO Cc1sccc1C[N@H+](C)[C@H](C)c1ccncc1 ZINC000293552986 386835841 /nfs/dbraw/zinc/83/58/41/386835841.db2.gz HGOULUJQOXGVLS-LLVKDONJSA-N 1 1 246.379 3.645 20 0 BHADMO Cc1sccc1C[N@H+](C)[C@@H](C)c1ccncc1 ZINC000293552988 386836734 /nfs/dbraw/zinc/83/67/34/386836734.db2.gz HGOULUJQOXGVLS-NSHDSACASA-N 1 1 246.379 3.645 20 0 BHADMO Cc1sccc1C[N@H+](C)[C@H](C)c1ccccn1 ZINC000293709967 386867107 /nfs/dbraw/zinc/86/71/07/386867107.db2.gz UPACRMINNZPHEH-LLVKDONJSA-N 1 1 246.379 3.645 20 0 BHADMO Cc1sccc1C[N@H+](C)[C@@H](C)c1ccccn1 ZINC000293709972 386867519 /nfs/dbraw/zinc/86/75/19/386867519.db2.gz UPACRMINNZPHEH-NSHDSACASA-N 1 1 246.379 3.645 20 0 BHADMO Cc1sccc1C[N@H+](C)[C@H](C)c1cccnc1 ZINC000293760615 386875536 /nfs/dbraw/zinc/87/55/36/386875536.db2.gz YZMOGUBCDXNYRE-LLVKDONJSA-N 1 1 246.379 3.645 20 0 BHADMO Cc1sccc1C[N@H+](C)[C@@H](C)c1cccnc1 ZINC000293760617 386874025 /nfs/dbraw/zinc/87/40/25/386874025.db2.gz YZMOGUBCDXNYRE-NSHDSACASA-N 1 1 246.379 3.645 20 0 BHADMO Cc1ccoc1C[NH2+][C@H](C)c1cc(C)c(C)o1 ZINC000293872255 178228733 /nfs/dbraw/zinc/22/87/33/178228733.db2.gz YHPRCGMLUQOEQZ-LLVKDONJSA-N 1 1 233.311 3.649 20 0 BHADMO Cc1ccoc1C[NH2+][C@@H](C)c1cc(C)c(C)o1 ZINC000293872259 178252725 /nfs/dbraw/zinc/25/27/25/178252725.db2.gz YHPRCGMLUQOEQZ-NSHDSACASA-N 1 1 233.311 3.649 20 0 BHADMO Cc1ccoc1C[N@H+](C)Cc1ccsc1C ZINC000293989754 385780846 /nfs/dbraw/zinc/78/08/46/385780846.db2.gz RZPFOTUFYUWMTC-UHFFFAOYSA-N 1 1 235.352 3.590 20 0 BHADMO Cc1sccc1C[N@H+]1CCC(F)(F)[C@H](C)C1 ZINC000294059747 398121893 /nfs/dbraw/zinc/12/18/93/398121893.db2.gz XSGMZPICEJIMCZ-SECBINFHSA-N 1 1 245.338 3.534 20 0 BHADMO Cc1sccc1C[N@H+]1CCC(F)(F)[C@@H](C)C1 ZINC000294059752 398122056 /nfs/dbraw/zinc/12/20/56/398122056.db2.gz XSGMZPICEJIMCZ-VIFPVBQESA-N 1 1 245.338 3.534 20 0 BHADMO c1cc(NC2CCSCC2)[nH+]cc1C1CCC1 ZINC000294062744 183357339 /nfs/dbraw/zinc/35/73/39/183357339.db2.gz QCXKUYQQWQITAS-UHFFFAOYSA-N 1 1 248.395 3.657 20 0 BHADMO CC[C@H](C)C[N@H+]1CC(C)(C)[C@H]1c1ccncc1 ZINC000294067260 171280038 /nfs/dbraw/zinc/28/00/38/171280038.db2.gz YHCPMZLHAKOKEC-GXTWGEPZSA-N 1 1 232.371 3.511 20 0 BHADMO CC[C@H](C)C[N@H+]1CC(C)(C)[C@@H]1c1ccncc1 ZINC000294067261 171279496 /nfs/dbraw/zinc/27/94/96/171279496.db2.gz YHCPMZLHAKOKEC-JSGCOSHPSA-N 1 1 232.371 3.511 20 0 BHADMO CC[C@@H](C)C[N@H+]1CC(C)(C)[C@@H]1c1ccncc1 ZINC000294067262 385797069 /nfs/dbraw/zinc/79/70/69/385797069.db2.gz YHCPMZLHAKOKEC-OCCSQVGLSA-N 1 1 232.371 3.511 20 0 BHADMO CC[C@@H](C)C[N@H+]1CC(C)(C)[C@H]1c1ccncc1 ZINC000294067263 385798285 /nfs/dbraw/zinc/79/82/85/385798285.db2.gz YHCPMZLHAKOKEC-TZMCWYRMSA-N 1 1 232.371 3.511 20 0 BHADMO CC[N@@H+](Cc1ccncc1C)C1CCCCC1 ZINC000294527631 169927393 /nfs/dbraw/zinc/92/73/93/169927393.db2.gz GTSXDWHQKUSCDV-UHFFFAOYSA-N 1 1 232.371 3.545 20 0 BHADMO Cc1cc(C[N@H+](C)[C@H](C)c2ccco2)cs1 ZINC000294573506 385869076 /nfs/dbraw/zinc/86/90/76/385869076.db2.gz PBDOXAZYLMVGCZ-LLVKDONJSA-N 1 1 235.352 3.843 20 0 BHADMO Cc1cc(C[N@H+](C)[C@@H](C)c2ccco2)cs1 ZINC000294573509 385869273 /nfs/dbraw/zinc/86/92/73/385869273.db2.gz PBDOXAZYLMVGCZ-NSHDSACASA-N 1 1 235.352 3.843 20 0 BHADMO Cc1cnccc1C[N@H+](C)[C@@H](C)c1ccccc1 ZINC000294578079 385870783 /nfs/dbraw/zinc/87/07/83/385870783.db2.gz PQLGMCHTGNKLAA-AWEZNQCLSA-N 1 1 240.350 3.583 20 0 BHADMO Cc1cnccc1C[N@H+](C)[C@H](C)c1ccccc1 ZINC000294578082 385870311 /nfs/dbraw/zinc/87/03/11/385870311.db2.gz PQLGMCHTGNKLAA-CQSZACIVSA-N 1 1 240.350 3.583 20 0 BHADMO Cc1cc(C[N@H+]2CCC[C@H]2c2ccc[nH]2)cs1 ZINC000294614244 385873681 /nfs/dbraw/zinc/87/36/81/385873681.db2.gz XBLGTKHQXWFHJZ-AWEZNQCLSA-N 1 1 246.379 3.722 20 0 BHADMO Cc1cc(C[N@H+]2CCC[C@@H]2c2ccc[nH]2)cs1 ZINC000294614247 385874469 /nfs/dbraw/zinc/87/44/69/385874469.db2.gz XBLGTKHQXWFHJZ-CQSZACIVSA-N 1 1 246.379 3.722 20 0 BHADMO CC[N@@H+](Cc1csc(Cl)n1)C1CCCC1 ZINC000294776301 566322031 /nfs/dbraw/zinc/32/20/31/566322031.db2.gz ACTIWCLXTRZMGJ-UHFFFAOYSA-N 1 1 244.791 3.561 20 0 BHADMO CC(=O)c1ccc(C[N@@H+]2CCC[C@H]2C(C)C)cc1 ZINC000294789988 385896006 /nfs/dbraw/zinc/89/60/06/385896006.db2.gz BHKVIGIXMSVXCF-INIZCTEOSA-N 1 1 245.366 3.510 20 0 BHADMO CC(=O)c1ccc(C[N@@H+]2CCC[C@@H]2C(C)C)cc1 ZINC000294789991 188214325 /nfs/dbraw/zinc/21/43/25/188214325.db2.gz BHKVIGIXMSVXCF-MRXNPFEDSA-N 1 1 245.366 3.510 20 0 BHADMO CC(=O)c1cccc(C[N@H+](C)[C@H](C)C2(C)CC2)c1 ZINC000294841640 385903880 /nfs/dbraw/zinc/90/38/80/385903880.db2.gz BMKJXIWFTXHAIB-CYBMUJFWSA-N 1 1 245.366 3.510 20 0 BHADMO CC(=O)c1cccc(C[N@H+](C)[C@@H](C)C2(C)CC2)c1 ZINC000294841642 385903328 /nfs/dbraw/zinc/90/33/28/385903328.db2.gz BMKJXIWFTXHAIB-ZDUSSCGKSA-N 1 1 245.366 3.510 20 0 BHADMO CC(F)(F)CCNc1cc[nH+]c2ccsc21 ZINC000294899257 385912180 /nfs/dbraw/zinc/91/21/80/385912180.db2.gz IAJSPSANSIJMTR-UHFFFAOYSA-N 1 1 242.294 3.754 20 0 BHADMO CC(F)(F)CCCNc1cc[nH+]cc1Cl ZINC000294924276 385312727 /nfs/dbraw/zinc/31/27/27/385312727.db2.gz KDIFKNKBTJXQPN-UHFFFAOYSA-N 1 1 234.677 3.582 20 0 BHADMO CCC(=O)CCC[N@@H+]([C@H](C)c1ccco1)C1CC1 ZINC000294956374 168198674 /nfs/dbraw/zinc/19/86/74/168198674.db2.gz MWYYEQDZRMJEET-GFCCVEGCSA-N 1 1 249.354 3.564 20 0 BHADMO CCC(=O)CCC[N@@H+]([C@@H](C)c1ccco1)C1CC1 ZINC000294956379 168199398 /nfs/dbraw/zinc/19/93/98/168199398.db2.gz MWYYEQDZRMJEET-LBPRGKRZSA-N 1 1 249.354 3.564 20 0 BHADMO Cc1cc(C[N@H+](C)[C@H](C)c2cccnc2)cs1 ZINC000294969412 385931720 /nfs/dbraw/zinc/93/17/20/385931720.db2.gz FKJJMUGDFURAIT-GFCCVEGCSA-N 1 1 246.379 3.645 20 0 BHADMO Cc1cc(C[N@H+](C)[C@@H](C)c2cccnc2)cs1 ZINC000294969413 385931868 /nfs/dbraw/zinc/93/18/68/385931868.db2.gz FKJJMUGDFURAIT-LBPRGKRZSA-N 1 1 246.379 3.645 20 0 BHADMO CCC(C)(C)[N@@H+](C)Cc1cccc(C(C)=O)c1 ZINC000294970741 168287014 /nfs/dbraw/zinc/28/70/14/168287014.db2.gz OGWFWNYEIAGHEL-UHFFFAOYSA-N 1 1 233.355 3.510 20 0 BHADMO Cc1cnccc1C[N@H+](C)[C@H](C)c1cccs1 ZINC000295017449 385943653 /nfs/dbraw/zinc/94/36/53/385943653.db2.gz ZSXSEOHTRRANBE-GFCCVEGCSA-N 1 1 246.379 3.645 20 0 BHADMO Cc1cnccc1C[N@H+](C)[C@@H](C)c1cccs1 ZINC000295017451 385945371 /nfs/dbraw/zinc/94/53/71/385945371.db2.gz ZSXSEOHTRRANBE-LBPRGKRZSA-N 1 1 246.379 3.645 20 0 BHADMO CCC(C)(C)[N@@H+](C)Cc1ccc(C(C)=O)cc1 ZINC000295027696 168286713 /nfs/dbraw/zinc/28/67/13/168286713.db2.gz VPGSJEOIVOTQRF-UHFFFAOYSA-N 1 1 233.355 3.510 20 0 BHADMO Fc1ccc(C2CC2)cc1C[NH2+]Cc1ccco1 ZINC000295088291 385962387 /nfs/dbraw/zinc/96/23/87/385962387.db2.gz JASLWQVYXGGFNO-UHFFFAOYSA-N 1 1 245.297 3.586 20 0 BHADMO CC(=O)c1ccc(C[N@H+](C)[C@H](C)C2(C)CC2)cc1 ZINC000295110206 188394023 /nfs/dbraw/zinc/39/40/23/188394023.db2.gz VHPPBWNPLPIFKD-CYBMUJFWSA-N 1 1 245.366 3.510 20 0 BHADMO CC(=O)c1ccc(C[N@H+](C)[C@@H](C)C2(C)CC2)cc1 ZINC000295110208 385970702 /nfs/dbraw/zinc/97/07/02/385970702.db2.gz VHPPBWNPLPIFKD-ZDUSSCGKSA-N 1 1 245.366 3.510 20 0 BHADMO CC[N@@H+](Cc1csc(Cl)n1)CC(C)(C)C ZINC000295265270 346385159 /nfs/dbraw/zinc/38/51/59/346385159.db2.gz YMVXCHMGRFDAED-UHFFFAOYSA-N 1 1 246.807 3.665 20 0 BHADMO CC[N@H+](Cc1csc(Cl)n1)CC(C)(C)C ZINC000295265270 346385155 /nfs/dbraw/zinc/38/51/55/346385155.db2.gz YMVXCHMGRFDAED-UHFFFAOYSA-N 1 1 246.807 3.665 20 0 BHADMO Cc1cc(C[N@H+](C)[C@@H](C)c2ccccn2)cs1 ZINC000295345317 188214063 /nfs/dbraw/zinc/21/40/63/188214063.db2.gz IEYMYNUVPXBIMP-LBPRGKRZSA-N 1 1 246.379 3.645 20 0 BHADMO Cc1sccc1C[N@H+](C)[C@@H](C)c1ccco1 ZINC000295351477 386016612 /nfs/dbraw/zinc/01/66/12/386016612.db2.gz NHEIVSDBOFLCEJ-JTQLQIEISA-N 1 1 235.352 3.843 20 0 BHADMO Cc1sccc1C[N@H+](C)[C@H](C)c1ccco1 ZINC000295351483 386017917 /nfs/dbraw/zinc/01/79/17/386017917.db2.gz NHEIVSDBOFLCEJ-SNVBAGLBSA-N 1 1 235.352 3.843 20 0 BHADMO CC(C)C[N@@H+](Cc1csc(Cl)n1)C(C)C ZINC000295417274 346405451 /nfs/dbraw/zinc/40/54/51/346405451.db2.gz DRIALPFPZNDDFZ-UHFFFAOYSA-N 1 1 246.807 3.663 20 0 BHADMO CCCC[N@@H+](Cc1csc(Cl)n1)C1CC1 ZINC000295455826 384489449 /nfs/dbraw/zinc/48/94/49/384489449.db2.gz HKWINLQOOKEEBD-UHFFFAOYSA-N 1 1 244.791 3.561 20 0 BHADMO CCCC[N@H+](Cc1csc(Cl)n1)C1CC1 ZINC000295455826 384489430 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ZINC000303578959 388858697 /nfs/dbraw/zinc/85/86/97/388858697.db2.gz DFFHXHMWEPCVIH-INIZCTEOSA-N 1 1 249.398 3.622 20 0 BHADMO CCCC[N@@H+](CCCO)[C@H](CC)c1ccccc1 ZINC000303578961 388858794 /nfs/dbraw/zinc/85/87/94/388858794.db2.gz DFFHXHMWEPCVIH-MRXNPFEDSA-N 1 1 249.398 3.622 20 0 BHADMO CCCC[N@@H+](CCC)CCc1cccc(F)c1 ZINC000303580856 528398040 /nfs/dbraw/zinc/39/80/40/528398040.db2.gz KJKNHPXEONVHPU-UHFFFAOYSA-N 1 1 237.362 3.880 20 0 BHADMO COCCCCC[N@H+]1CCC[C@H](C(C)C)CC1 ZINC000303604413 323159747 /nfs/dbraw/zinc/15/97/47/323159747.db2.gz KJZFHBXFXWHIIA-HNNXBMFYSA-N 1 1 241.419 3.561 20 0 BHADMO COCCCCC[N@H+]1CCC[C@@H](C(C)C)CC1 ZINC000303604415 323159795 /nfs/dbraw/zinc/15/97/95/323159795.db2.gz KJZFHBXFXWHIIA-OAHLLOKOSA-N 1 1 241.419 3.561 20 0 BHADMO CC(C)CC[N@H+]1CCC[C@@]2(CC=CCC2)C1 ZINC000303618862 388860094 /nfs/dbraw/zinc/86/00/94/388860094.db2.gz WPXVFUAPILMNPK-HNNXBMFYSA-N 1 1 221.388 3.855 20 0 BHADMO CC(C)CC[N@H+]1CCC[C@]2(CC=CCC2)C1 ZINC000303618863 388859184 /nfs/dbraw/zinc/85/91/84/388859184.db2.gz WPXVFUAPILMNPK-OAHLLOKOSA-N 1 1 221.388 3.855 20 0 BHADMO C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@H+]1Cc1cccc(F)c1 ZINC000303651775 323159934 /nfs/dbraw/zinc/15/99/34/323159934.db2.gz BGGYXKIYONQQKB-INWMFGNUSA-N 1 1 247.357 3.979 20 0 BHADMO C[C@@H]1C[C@@H]2CCCC[C@H]2[N@H+]1Cc1cccc(F)c1 ZINC000303651779 323159837 /nfs/dbraw/zinc/15/98/37/323159837.db2.gz BGGYXKIYONQQKB-IVMMDQJWSA-N 1 1 247.357 3.979 20 0 BHADMO C[C@@H]1C[C@H]2CCCC[C@H]2[N@H+]1Cc1cccc(F)c1 ZINC000303651783 323159874 /nfs/dbraw/zinc/15/98/74/323159874.db2.gz BGGYXKIYONQQKB-XNRPHZJLSA-N 1 1 247.357 3.979 20 0 BHADMO C[C@@H]1C[C@H]2CCCC[C@@H]2[N@H+]1Cc1cccc(F)c1 ZINC000303651787 323159833 /nfs/dbraw/zinc/15/98/33/323159833.db2.gz BGGYXKIYONQQKB-XPKDYRNWSA-N 1 1 247.357 3.979 20 0 BHADMO CCCCC[N@H+]1CCSC[C@H]1c1ccccc1 ZINC000303655224 369430189 /nfs/dbraw/zinc/43/01/89/369430189.db2.gz CCZYOCBKLMEACO-HNNXBMFYSA-N 1 1 249.423 3.967 20 0 BHADMO CCCCC[N@H+]1CCSC[C@@H]1c1ccccc1 ZINC000303655226 369430176 /nfs/dbraw/zinc/43/01/76/369430176.db2.gz CCZYOCBKLMEACO-OAHLLOKOSA-N 1 1 249.423 3.967 20 0 BHADMO COc1cccc(C[N@H+]2CCCC[C@H]2C(C)C)c1 ZINC000303659333 369430755 /nfs/dbraw/zinc/43/07/55/369430755.db2.gz HBDHNPAGOITVQH-INIZCTEOSA-N 1 1 247.382 3.706 20 0 BHADMO COc1cccc(C[N@H+]2CCCC[C@@H]2C(C)C)c1 ZINC000303659334 369430731 /nfs/dbraw/zinc/43/07/31/369430731.db2.gz HBDHNPAGOITVQH-MRXNPFEDSA-N 1 1 247.382 3.706 20 0 BHADMO CC(C)[C@@H]1CCCC[N@H+]1Cc1ccccc1F ZINC000303669477 388859687 /nfs/dbraw/zinc/85/96/87/388859687.db2.gz JIGOEVLCGJHIDI-HNNXBMFYSA-N 1 1 235.346 3.836 20 0 BHADMO CC(C)[C@H]1CCCC[N@H+]1Cc1ccccc1F ZINC000303669478 388858751 /nfs/dbraw/zinc/85/87/51/388858751.db2.gz JIGOEVLCGJHIDI-OAHLLOKOSA-N 1 1 235.346 3.836 20 0 BHADMO C[C@@]1(c2ccccc2)CCC[N@@H+](C/C=C/Cl)C1 ZINC000303675887 644834560 /nfs/dbraw/zinc/83/45/60/644834560.db2.gz XYAJKLKZIVRVMC-WCLQSUPFSA-N 1 1 249.785 3.793 20 0 BHADMO C[C@]1(c2ccccc2)CCC[N@@H+](C/C=C/Cl)C1 ZINC000303675888 644835556 /nfs/dbraw/zinc/83/55/56/644835556.db2.gz XYAJKLKZIVRVMC-WGPYJDKQSA-N 1 1 249.785 3.793 20 0 BHADMO CC(C)CC[N@H+]1[C@H](C)C[C@@H]2CCCC[C@H]21 ZINC000303688495 323160239 /nfs/dbraw/zinc/16/02/39/323160239.db2.gz LEJUMLUDTIDREH-HZSPNIEDSA-N 1 1 209.377 3.686 20 0 BHADMO CC(C)CC[N@H+]1[C@H](C)C[C@H]2CCCC[C@@H]21 ZINC000303688496 323160147 /nfs/dbraw/zinc/16/01/47/323160147.db2.gz LEJUMLUDTIDREH-MCIONIFRSA-N 1 1 209.377 3.686 20 0 BHADMO CC(C)CC[N@H+]1[C@H](C)C[C@H]2CCCC[C@H]21 ZINC000303688497 323160104 /nfs/dbraw/zinc/16/01/04/323160104.db2.gz LEJUMLUDTIDREH-MGPQQGTHSA-N 1 1 209.377 3.686 20 0 BHADMO CC(C)CC[N@H+]1[C@H](C)C[C@@H]2CCCC[C@@H]21 ZINC000303688498 323160194 /nfs/dbraw/zinc/16/01/94/323160194.db2.gz LEJUMLUDTIDREH-RDBSUJKOSA-N 1 1 209.377 3.686 20 0 BHADMO CCCC[N@H+]1CCSC[C@H]1c1ccccc1 ZINC000303690049 356662003 /nfs/dbraw/zinc/66/20/03/356662003.db2.gz MKDHGQJOLAPTAB-AWEZNQCLSA-N 1 1 235.396 3.577 20 0 BHADMO CCCC[N@H+]1CCSC[C@@H]1c1ccccc1 ZINC000303690052 350125859 /nfs/dbraw/zinc/12/58/59/350125859.db2.gz MKDHGQJOLAPTAB-CQSZACIVSA-N 1 1 235.396 3.577 20 0 BHADMO C[C@@H]1SCC[N@@H+](C/C=C/c2ccccc2)[C@H]1C ZINC000303701640 323328713 /nfs/dbraw/zinc/32/87/13/323328713.db2.gz ODCYVCSUMKKUAC-HXUSNMGPSA-N 1 1 247.407 3.526 20 0 BHADMO C[C@@H]1[C@H](C)SCC[N@H+]1C/C=C/c1ccccc1 ZINC000303701642 323328307 /nfs/dbraw/zinc/32/83/07/323328307.db2.gz ODCYVCSUMKKUAC-VVYAQTJFSA-N 1 1 247.407 3.526 20 0 BHADMO CCC[N@H+]1CCS[C@@H](C)[C@@H]1c1ccccc1 ZINC000303724382 323160269 /nfs/dbraw/zinc/16/02/69/323160269.db2.gz SJECGILBUBHFCJ-GXTWGEPZSA-N 1 1 235.396 3.575 20 0 BHADMO CCC[N@H+]1CCS[C@@H](C)[C@H]1c1ccccc1 ZINC000303724385 323160198 /nfs/dbraw/zinc/16/01/98/323160198.db2.gz SJECGILBUBHFCJ-JSGCOSHPSA-N 1 1 235.396 3.575 20 0 BHADMO CCC[N@H+]1CCS[C@H](C)[C@H]1c1ccccc1 ZINC000303724388 323160118 /nfs/dbraw/zinc/16/01/18/323160118.db2.gz SJECGILBUBHFCJ-OCCSQVGLSA-N 1 1 235.396 3.575 20 0 BHADMO CCC[N@H+]1CCS[C@H](C)[C@@H]1c1ccccc1 ZINC000303724390 323160244 /nfs/dbraw/zinc/16/02/44/323160244.db2.gz SJECGILBUBHFCJ-TZMCWYRMSA-N 1 1 235.396 3.575 20 0 BHADMO C[C@@H]1C[C@@H]2CCCC[C@H]2[N@H+]1Cc1ccccc1F ZINC000303727893 323160210 /nfs/dbraw/zinc/16/02/10/323160210.db2.gz UHPAZEIJPVQMBN-DVOMOZLQSA-N 1 1 247.357 3.979 20 0 BHADMO C[C@@H]1C[C@H]2CCCC[C@@H]2[N@H+]1Cc1ccccc1F ZINC000303727894 323160183 /nfs/dbraw/zinc/16/01/83/323160183.db2.gz UHPAZEIJPVQMBN-IOASZLSFSA-N 1 1 247.357 3.979 20 0 BHADMO C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@H+]1Cc1ccccc1F ZINC000303727896 323160142 /nfs/dbraw/zinc/16/01/42/323160142.db2.gz UHPAZEIJPVQMBN-WWGRRREGSA-N 1 1 247.357 3.979 20 0 BHADMO C[C@@H]1C[C@H]2CCCC[C@H]2[N@H+]1Cc1ccccc1F ZINC000303727898 323160102 /nfs/dbraw/zinc/16/01/02/323160102.db2.gz UHPAZEIJPVQMBN-XJKCOSOUSA-N 1 1 247.357 3.979 20 0 BHADMO CC(C)[C@@H]1CCCC[N@H+]1CCOc1ccccc1 ZINC000303730564 369433219 /nfs/dbraw/zinc/43/32/19/369433219.db2.gz ZBGISXSMXICECW-INIZCTEOSA-N 1 1 247.382 3.576 20 0 BHADMO CC(C)[C@H]1CCCC[N@H+]1CCOc1ccccc1 ZINC000303730565 369433161 /nfs/dbraw/zinc/43/31/61/369433161.db2.gz ZBGISXSMXICECW-MRXNPFEDSA-N 1 1 247.382 3.576 20 0 BHADMO CC(C)[C@@H]1CCCC[N@H+]1Cc1cccc(F)c1 ZINC000303731088 369433100 /nfs/dbraw/zinc/43/31/00/369433100.db2.gz ZGDODWPSRNVDSX-HNNXBMFYSA-N 1 1 235.346 3.836 20 0 BHADMO CC(C)[C@H]1CCCC[N@H+]1Cc1cccc(F)c1 ZINC000303731089 369433368 /nfs/dbraw/zinc/43/33/68/369433368.db2.gz ZGDODWPSRNVDSX-OAHLLOKOSA-N 1 1 235.346 3.836 20 0 BHADMO CCCC[N@@H+](CC)Cc1c(C)cccc1C ZINC000303734261 259658989 /nfs/dbraw/zinc/65/89/89/259658989.db2.gz FXLPKTOCIBIXNF-UHFFFAOYSA-N 1 1 219.372 3.925 20 0 BHADMO Cc1ccc(CC[N@H+]([C@@H](C)C2CC2)C2CC2)cc1 ZINC000303744023 323160237 /nfs/dbraw/zinc/16/02/37/323160237.db2.gz FJUHUJBBOFKBKF-AWEZNQCLSA-N 1 1 243.394 3.800 20 0 BHADMO Cc1ccc(CC[N@H+]([C@H](C)C2CC2)C2CC2)cc1 ZINC000303744024 323160202 /nfs/dbraw/zinc/16/02/02/323160202.db2.gz FJUHUJBBOFKBKF-CQSZACIVSA-N 1 1 243.394 3.800 20 0 BHADMO Cc1ccc(C[C@H](C)[N@H+](C)CCC(C)C)cc1 ZINC000303754731 369434438 /nfs/dbraw/zinc/43/44/38/369434438.db2.gz MSOIUBFWGXYDCV-HNNXBMFYSA-N 1 1 233.399 3.904 20 0 BHADMO Cc1ccc(C[C@@H](C)[N@H+](C)CCC(C)C)cc1 ZINC000303754733 369434541 /nfs/dbraw/zinc/43/45/41/369434541.db2.gz MSOIUBFWGXYDCV-OAHLLOKOSA-N 1 1 233.399 3.904 20 0 BHADMO CSCC[C@@H](C)[N@@H+](C)C/C=C/c1ccccc1 ZINC000303756505 323160242 /nfs/dbraw/zinc/16/02/42/323160242.db2.gz JPNOXWVFJUHVFE-DNGMOHDESA-N 1 1 249.423 3.773 20 0 BHADMO CSCC[C@H](C)[N@@H+](C)C/C=C/c1ccccc1 ZINC000303756506 323160271 /nfs/dbraw/zinc/16/02/71/323160271.db2.gz JPNOXWVFJUHVFE-RNVIBTMRSA-N 1 1 249.423 3.773 20 0 BHADMO CCCCCC[N@H+]1CCC[C@H](OCCC)CC1 ZINC000303766134 644845116 /nfs/dbraw/zinc/84/51/16/644845116.db2.gz AXHOFMGFXYDZRQ-HNNXBMFYSA-N 1 1 241.419 3.848 20 0 BHADMO CCCCCC[N@H+]1CCC[C@@H](OCCC)CC1 ZINC000303766137 644844930 /nfs/dbraw/zinc/84/49/30/644844930.db2.gz AXHOFMGFXYDZRQ-OAHLLOKOSA-N 1 1 241.419 3.848 20 0 BHADMO CCC[N@H+]1CCCCC[C@@H]1c1ccc(C)o1 ZINC000303767076 350126917 /nfs/dbraw/zinc/12/69/17/350126917.db2.gz PYJDVVTUPQLRJH-CYBMUJFWSA-N 1 1 221.344 3.915 20 0 BHADMO CCC[N@H+]1CCCCC[C@H]1c1ccc(C)o1 ZINC000303767078 350126978 /nfs/dbraw/zinc/12/69/78/350126978.db2.gz PYJDVVTUPQLRJH-ZDUSSCGKSA-N 1 1 221.344 3.915 20 0 BHADMO CCCCCC[N@@H+](C)CCc1ccccc1OC ZINC000303773863 644844295 /nfs/dbraw/zinc/84/42/95/644844295.db2.gz CAARJSOFJYKWTO-UHFFFAOYSA-N 1 1 249.398 3.750 20 0 BHADMO Cc1ccc(C[C@H](C)[N@H+](C)CC(C)C)cc1 ZINC000303787391 369435870 /nfs/dbraw/zinc/43/58/70/369435870.db2.gz UJASECOQYFLCSU-AWEZNQCLSA-N 1 1 219.372 3.514 20 0 BHADMO Cc1ccc(C[C@@H](C)[N@H+](C)CC(C)C)cc1 ZINC000303787392 369436341 /nfs/dbraw/zinc/43/63/41/369436341.db2.gz UJASECOQYFLCSU-CQSZACIVSA-N 1 1 219.372 3.514 20 0 BHADMO Cc1ccc(C[C@H](C)[N@@H+](C)C/C=C/Cl)cc1 ZINC000303806655 644849204 /nfs/dbraw/zinc/84/92/04/644849204.db2.gz MQLUWHYRMSRMPA-FAFAAHBOSA-N 1 1 237.774 3.610 20 0 BHADMO Cc1ccc(C[C@@H](C)[N@@H+](C)C/C=C/Cl)cc1 ZINC000303806656 644849327 /nfs/dbraw/zinc/84/93/27/644849327.db2.gz MQLUWHYRMSRMPA-QGQQYVBWSA-N 1 1 237.774 3.610 20 0 BHADMO CC[C@H]1CCCC[N@H+]1Cc1ccccc1N(C)C ZINC000303811554 529202522 /nfs/dbraw/zinc/20/25/22/529202522.db2.gz CRTMDTWILIUUAB-HNNXBMFYSA-N 1 1 246.398 3.517 20 0 BHADMO CC[C@@H]1CCCC[N@H+]1Cc1ccccc1N(C)C ZINC000303811556 529274037 /nfs/dbraw/zinc/27/40/37/529274037.db2.gz CRTMDTWILIUUAB-OAHLLOKOSA-N 1 1 246.398 3.517 20 0 BHADMO CC[C@@H](C)C[N@@H+](C)Cc1c(C)cccc1C ZINC000303812016 369437647 /nfs/dbraw/zinc/43/76/47/369437647.db2.gz ZDWIDYCVEOHUMN-GFCCVEGCSA-N 1 1 219.372 3.781 20 0 BHADMO CC[C@H](C)C[N@@H+](C)Cc1c(C)cccc1C ZINC000303812017 369436878 /nfs/dbraw/zinc/43/68/78/369436878.db2.gz ZDWIDYCVEOHUMN-LBPRGKRZSA-N 1 1 219.372 3.781 20 0 BHADMO Fc1ccc(C[N@H+]2CCC3(C2)CCCCC3)cc1 ZINC000303835640 323160498 /nfs/dbraw/zinc/16/04/98/323160498.db2.gz AQJJRTXNLQDWIZ-UHFFFAOYSA-N 1 1 247.357 3.982 20 0 BHADMO CC1(C)CCC[N@@H+](Cc2ccccc2)CC1 ZINC000303836295 369439181 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GTROAKSIUPFGPT-UHFFFAOYSA-N 1 1 235.346 3.838 20 0 BHADMO CCCCCC[N@@H+]([C@H](C)C1CC1)C1CC1 ZINC000303868732 644851176 /nfs/dbraw/zinc/85/11/76/644851176.db2.gz QGXUZYQUMDOPGF-GFCCVEGCSA-N 1 1 209.377 3.830 20 0 BHADMO CCCCCC[N@@H+]([C@@H](C)C1CC1)C1CC1 ZINC000303868733 644850836 /nfs/dbraw/zinc/85/08/36/644850836.db2.gz QGXUZYQUMDOPGF-LBPRGKRZSA-N 1 1 209.377 3.830 20 0 BHADMO C[N@@H+](CCC1CCCC1)Cc1ccc(F)cc1 ZINC000303877612 323160940 /nfs/dbraw/zinc/16/09/40/323160940.db2.gz IPPFYXJNSWEYNG-UHFFFAOYSA-N 1 1 235.346 3.838 20 0 BHADMO C(C[N@H+]1CCC[C@H]1C1CCC1)C1CCCC1 ZINC000303884549 369441635 /nfs/dbraw/zinc/44/16/35/369441635.db2.gz JMCOEXIJPHPKTM-HNNXBMFYSA-N 1 1 221.388 3.831 20 0 BHADMO C(C[N@H+]1CCC[C@@H]1C1CCC1)C1CCCC1 ZINC000303884552 369440994 /nfs/dbraw/zinc/44/09/94/369440994.db2.gz JMCOEXIJPHPKTM-OAHLLOKOSA-N 1 1 221.388 3.831 20 0 BHADMO CC1(C)CCC[N@@H+](CCOc2ccccc2)CC1 ZINC000303885717 323161481 /nfs/dbraw/zinc/16/14/81/323161481.db2.gz JPTPFYPNGRCSLK-UHFFFAOYSA-N 1 1 247.382 3.578 20 0 BHADMO CCC[N@@H+](Cc1ccoc1)C1CCCCC1 ZINC000303917769 169179621 /nfs/dbraw/zinc/17/96/21/169179621.db2.gz OARCFRIYNDNHFU-UHFFFAOYSA-N 1 1 221.344 3.824 20 0 BHADMO CCC[N@H+]1CCCC[C@H]1c1ccc(C)cc1 ZINC000303918470 323161681 /nfs/dbraw/zinc/16/16/81/323161681.db2.gz OCDZKNFAGPWWMP-HNNXBMFYSA-N 1 1 217.356 3.932 20 0 BHADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(C)cc1 ZINC000303918472 323161719 /nfs/dbraw/zinc/16/17/19/323161719.db2.gz OCDZKNFAGPWWMP-OAHLLOKOSA-N 1 1 217.356 3.932 20 0 BHADMO C[N@@H+](CCC1CCCC1)Cc1ccccc1 ZINC000303925161 323162001 /nfs/dbraw/zinc/16/20/01/323162001.db2.gz PMFKBQGDHGNGGJ-UHFFFAOYSA-N 1 1 217.356 3.699 20 0 BHADMO C[N@@H+](CCC1CCCC1)C1CCCCC1 ZINC000303926654 369444464 /nfs/dbraw/zinc/44/44/64/369444464.db2.gz PURPFTJYGQUJKW-UHFFFAOYSA-N 1 1 209.377 3.831 20 0 BHADMO C[C@H](C1CC1)[N@@H+](CCC1CCCC1)C1CC1 ZINC000303930302 369444651 /nfs/dbraw/zinc/44/46/51/369444651.db2.gz QKNGNEWLQFAKFC-GFCCVEGCSA-N 1 1 221.388 3.830 20 0 BHADMO C[C@@H](C1CC1)[N@@H+](CCC1CCCC1)C1CC1 ZINC000303930306 369444841 /nfs/dbraw/zinc/44/48/41/369444841.db2.gz QKNGNEWLQFAKFC-LBPRGKRZSA-N 1 1 221.388 3.830 20 0 BHADMO CCSCC[N@H+]1CCC[C@@]2(CC=CCC2)C1 ZINC000303931842 387413158 /nfs/dbraw/zinc/41/31/58/387413158.db2.gz QSIUOTVEFPUQBM-AWEZNQCLSA-N 1 1 239.428 3.562 20 0 BHADMO CCSCC[N@H+]1CCC[C@]2(CC=CCC2)C1 ZINC000303931844 387412273 /nfs/dbraw/zinc/41/22/73/387412273.db2.gz QSIUOTVEFPUQBM-CQSZACIVSA-N 1 1 239.428 3.562 20 0 BHADMO CCC[N@@H+](CCC1CCCC1)CC1CC1 ZINC000303935949 323161894 /nfs/dbraw/zinc/16/18/94/323161894.db2.gz ROCQBDKGCKRVCQ-UHFFFAOYSA-N 1 1 209.377 3.689 20 0 BHADMO CC[C@@H](Cc1ccccc1)[N@@H+](C)CCC(C)C ZINC000303939187 369445096 /nfs/dbraw/zinc/44/50/96/369445096.db2.gz SHQIBRQJZKPFKB-INIZCTEOSA-N 1 1 233.399 3.986 20 0 BHADMO CC[C@H](Cc1ccccc1)[N@@H+](C)CCC(C)C ZINC000303939192 369445061 /nfs/dbraw/zinc/44/50/61/369445061.db2.gz SHQIBRQJZKPFKB-MRXNPFEDSA-N 1 1 233.399 3.986 20 0 BHADMO CCC[N@@H+](C)[C@H](C)Cc1ccc(Cl)cc1 ZINC000303939254 369445112 /nfs/dbraw/zinc/44/51/12/369445112.db2.gz YNAMEPUKBIOPTR-LLVKDONJSA-N 1 1 225.763 3.613 20 0 BHADMO CCC[N@@H+](C)[C@@H](C)Cc1ccc(Cl)cc1 ZINC000303939938 352711603 /nfs/dbraw/zinc/71/16/03/352711603.db2.gz YNAMEPUKBIOPTR-NSHDSACASA-N 1 1 225.763 3.613 20 0 BHADMO CCCCC[N@@H+](CCSCC)C(C)C ZINC000303942980 323162098 /nfs/dbraw/zinc/16/20/98/323162098.db2.gz TXGLMHRPOGTEOZ-UHFFFAOYSA-N 1 1 217.422 3.640 20 0 BHADMO CC(C)CC[N@H+]1CCC2(C1)CCCCC2 ZINC000303947916 388637888 /nfs/dbraw/zinc/63/78/88/388637888.db2.gz UXUZXUZXMZJRRN-UHFFFAOYSA-N 1 1 209.377 3.689 20 0 BHADMO CCC[N@H+]1CCC[C@H]1c1cccc(C)c1C ZINC000303947982 323162343 /nfs/dbraw/zinc/16/23/43/323162343.db2.gz UYPNNIMXKDKOQZ-HNNXBMFYSA-N 1 1 217.356 3.850 20 0 BHADMO CCC[N@H+]1CCC[C@@H]1c1cccc(C)c1C ZINC000303947985 323162278 /nfs/dbraw/zinc/16/22/78/323162278.db2.gz UYPNNIMXKDKOQZ-OAHLLOKOSA-N 1 1 217.356 3.850 20 0 BHADMO CCCCCC[N@@H+](C)[C@H](C)CCSC ZINC000303948391 644859561 /nfs/dbraw/zinc/85/95/61/644859561.db2.gz ZORXNZMOCOSSOD-GFCCVEGCSA-N 1 1 217.422 3.640 20 0 BHADMO CCCCCC[N@@H+](C)[C@@H](C)CCSC ZINC000303948392 644859805 /nfs/dbraw/zinc/85/98/05/644859805.db2.gz ZORXNZMOCOSSOD-LBPRGKRZSA-N 1 1 217.422 3.640 20 0 BHADMO C[N@@H+](CCC1CCCC1)Cc1ccccc1F ZINC000303948507 411312969 /nfs/dbraw/zinc/31/29/69/411312969.db2.gz VBHCBWPBLPWZRS-UHFFFAOYSA-N 1 1 235.346 3.838 20 0 BHADMO COc1cccc(CCC[N@H+]2CCCC[C@@H]2C)c1 ZINC000303954106 323162039 /nfs/dbraw/zinc/16/20/39/323162039.db2.gz WOZUJGNAYHLWGC-AWEZNQCLSA-N 1 1 247.382 3.502 20 0 BHADMO COc1cccc(CCC[N@H+]2CCCC[C@H]2C)c1 ZINC000303954109 323161990 /nfs/dbraw/zinc/16/19/90/323161990.db2.gz WOZUJGNAYHLWGC-CQSZACIVSA-N 1 1 247.382 3.502 20 0 BHADMO COc1ccc(C[N@@H+](C)CCC2CCCC2)cc1 ZINC000303957048 323162035 /nfs/dbraw/zinc/16/20/35/323162035.db2.gz XTKYXKZXGJSXQY-UHFFFAOYSA-N 1 1 247.382 3.707 20 0 BHADMO CSCC[C@@H](C)[N@@H+](C)CCC1CCCC1 ZINC000303959912 323162488 /nfs/dbraw/zinc/16/24/88/323162488.db2.gz YZMDNZWMVJCMCA-GFCCVEGCSA-N 1 1 229.433 3.640 20 0 BHADMO CSCC[C@H](C)[N@@H+](C)CCC1CCCC1 ZINC000303959914 323162410 /nfs/dbraw/zinc/16/24/10/323162410.db2.gz YZMDNZWMVJCMCA-LBPRGKRZSA-N 1 1 229.433 3.640 20 0 BHADMO CCC[N@@H+](CCC1CCCC1)CC(F)F ZINC000303961273 369446729 /nfs/dbraw/zinc/44/67/29/369446729.db2.gz ZPVZOMMSJMVSDM-UHFFFAOYSA-N 1 1 219.319 3.544 20 0 BHADMO CCC[N@H+](CCC1CCCC1)CC(F)F ZINC000303961273 369446726 /nfs/dbraw/zinc/44/67/26/369446726.db2.gz ZPVZOMMSJMVSDM-UHFFFAOYSA-N 1 1 219.319 3.544 20 0 BHADMO CC(C)C[C@@H](C)[NH2+]c1ccc2c(c1)CCN2 ZINC000304334847 528268668 /nfs/dbraw/zinc/26/86/68/528268668.db2.gz AVPJRVBIGNJORP-LLVKDONJSA-N 1 1 218.344 3.501 20 0 BHADMO CC(C)C[C@H](C)[NH2+]c1ccc2c(c1)CCN2 ZINC000304334850 528476495 /nfs/dbraw/zinc/47/64/95/528476495.db2.gz AVPJRVBIGNJORP-NSHDSACASA-N 1 1 218.344 3.501 20 0 BHADMO CC(C)c1[nH+]ccn1C[C@@H]1CCCC(F)(F)C1 ZINC000306041295 384498179 /nfs/dbraw/zinc/49/81/79/384498179.db2.gz UDOJSRALHPCTDQ-LLVKDONJSA-N 1 1 242.313 3.832 20 0 BHADMO CC(C)c1[nH+]ccn1C[C@H]1CCCC(F)(F)C1 ZINC000306041298 384497783 /nfs/dbraw/zinc/49/77/83/384497783.db2.gz UDOJSRALHPCTDQ-NSHDSACASA-N 1 1 242.313 3.832 20 0 BHADMO C[N@@H+](C/C(Cl)=C/Cl)C1CCCCC1 ZINC000306292139 635963208 /nfs/dbraw/zinc/96/32/08/635963208.db2.gz UUMHDHFESAADNC-CLFYSBASSA-N 1 1 222.159 3.570 20 0 BHADMO CC[N@@H+](C)Cc1csc(Cl)c1Cl ZINC000306339700 520258621 /nfs/dbraw/zinc/25/86/21/520258621.db2.gz VYFCEHIYGSYZBU-UHFFFAOYSA-N 1 1 224.156 3.507 20 0 BHADMO CC[N@H+](C)Cc1csc(Cl)c1Cl ZINC000306339700 520258614 /nfs/dbraw/zinc/25/86/14/520258614.db2.gz VYFCEHIYGSYZBU-UHFFFAOYSA-N 1 1 224.156 3.507 20 0 BHADMO Clc1ccc(Cl)c(C[NH+]2CCCC2)c1 ZINC000306418114 180581784 /nfs/dbraw/zinc/58/17/84/180581784.db2.gz ZNYLTJRNDPKJPF-UHFFFAOYSA-N 1 1 230.138 3.589 20 0 BHADMO CC[C@@H]1CC[C@H](C)[N@H+]1C/C(Cl)=C/Cl ZINC000306456449 635965496 /nfs/dbraw/zinc/96/54/96/635965496.db2.gz SJYZYGLINMMFMG-PKKHPGAQSA-N 1 1 222.159 3.568 20 0 BHADMO CC[C@@H]1CC[C@@H](C)[N@H+]1C/C(Cl)=C/Cl ZINC000306456450 635965716 /nfs/dbraw/zinc/96/57/16/635965716.db2.gz SJYZYGLINMMFMG-VGEVTBTPSA-N 1 1 222.159 3.568 20 0 BHADMO C[N@@H+](Cc1nc(Cl)ccc1Cl)C(C)(C)C ZINC000306555693 360430006 /nfs/dbraw/zinc/43/00/06/360430006.db2.gz HXBWLPFDAGEXIC-UHFFFAOYSA-N 1 1 247.169 3.619 20 0 BHADMO C[N@H+](Cc1nc(Cl)ccc1Cl)C(C)(C)C ZINC000306555693 360430005 /nfs/dbraw/zinc/43/00/05/360430005.db2.gz HXBWLPFDAGEXIC-UHFFFAOYSA-N 1 1 247.169 3.619 20 0 BHADMO C[N@@H+](C/C(Cl)=C/Cl)C1(C)CCCC1 ZINC000306707560 711460765 /nfs/dbraw/zinc/46/07/65/711460765.db2.gz MZOADUCPFKROTM-CLFYSBASSA-N 1 1 222.159 3.570 20 0 BHADMO C[N@@H+](Cc1ccc(Cl)nc1Cl)C(C)(C)C ZINC000307419122 635986766 /nfs/dbraw/zinc/98/67/66/635986766.db2.gz GUPVMIWRUYCILS-UHFFFAOYSA-N 1 1 247.169 3.619 20 0 BHADMO C[C@H]1CCCCC[N@H+]1C/C(Cl)=C/Cl ZINC000307653425 643566395 /nfs/dbraw/zinc/56/63/95/643566395.db2.gz UJNNOIOBPHOZKP-CBFJXKFUSA-N 1 1 222.159 3.570 20 0 BHADMO C[C@@H]1CCCCC[N@H+]1C/C(Cl)=C/Cl ZINC000307653426 643565921 /nfs/dbraw/zinc/56/59/21/643565921.db2.gz UJNNOIOBPHOZKP-SBMLRHLQSA-N 1 1 222.159 3.570 20 0 BHADMO CC[C@H]1CCCC[N@H+]1C/C(Cl)=C/Cl ZINC000307659732 635992696 /nfs/dbraw/zinc/99/26/96/635992696.db2.gz BEAKUXVAEZDDBR-RNKPRXRFSA-N 1 1 222.159 3.570 20 0 BHADMO CC[C@H]1CCCC[N@@H+]1C/C(Cl)=C/Cl ZINC000307659732 635992693 /nfs/dbraw/zinc/99/26/93/635992693.db2.gz BEAKUXVAEZDDBR-RNKPRXRFSA-N 1 1 222.159 3.570 20 0 BHADMO CC[C@@H]1CCCC[N@H+]1C/C(Cl)=C/Cl ZINC000307659734 635991969 /nfs/dbraw/zinc/99/19/69/635991969.db2.gz BEAKUXVAEZDDBR-UJICNMFASA-N 1 1 222.159 3.570 20 0 BHADMO CC[C@@H]1CCCC[N@@H+]1C/C(Cl)=C/Cl ZINC000307659734 635991966 /nfs/dbraw/zinc/99/19/66/635991966.db2.gz BEAKUXVAEZDDBR-UJICNMFASA-N 1 1 222.159 3.570 20 0 BHADMO CC(C)[N@@H+](C)Cc1csc(Cl)c1Cl ZINC000307720560 385817128 /nfs/dbraw/zinc/81/71/28/385817128.db2.gz OXAFPIIYSISHFK-UHFFFAOYSA-N 1 1 238.183 3.895 20 0 BHADMO CC(C)[N@H+](C)Cc1csc(Cl)c1Cl ZINC000307720560 385817124 /nfs/dbraw/zinc/81/71/24/385817124.db2.gz OXAFPIIYSISHFK-UHFFFAOYSA-N 1 1 238.183 3.895 20 0 BHADMO CCC(=O)CCC[N@H+]1CC[C@H](CC(C)(C)C)C1 ZINC000307783943 528287139 /nfs/dbraw/zinc/28/71/39/528287139.db2.gz WYSJKRLXTJDHFZ-CYBMUJFWSA-N 1 1 239.403 3.504 20 0 BHADMO CCC(=O)CCC[N@H+]1CC[C@@H](CC(C)(C)C)C1 ZINC000307783947 528288134 /nfs/dbraw/zinc/28/81/34/528288134.db2.gz WYSJKRLXTJDHFZ-ZDUSSCGKSA-N 1 1 239.403 3.504 20 0 BHADMO CC(C)(C)C[C@@H]1CC[N@@H+](Cc2cccc(N)c2)C1 ZINC000307807962 490354824 /nfs/dbraw/zinc/35/48/24/490354824.db2.gz ILYAOBMJHYNHPJ-AWEZNQCLSA-N 1 1 246.398 3.527 20 0 BHADMO CC(C)(C)C[C@H]1CC[N@@H+](Cc2cccc(N)c2)C1 ZINC000307807963 490354871 /nfs/dbraw/zinc/35/48/71/490354871.db2.gz ILYAOBMJHYNHPJ-CQSZACIVSA-N 1 1 246.398 3.527 20 0 BHADMO CCC[N@@H+](CC)Cc1sccc1Cl ZINC000308153185 388432453 /nfs/dbraw/zinc/43/24/53/388432453.db2.gz AGGOVAQHRCKOAX-UHFFFAOYSA-N 1 1 217.765 3.633 20 0 BHADMO CCC[N@@H+](CC)Cc1cscc1Cl ZINC000308208491 491135213 /nfs/dbraw/zinc/13/52/13/491135213.db2.gz DXTRKAICPOEHLI-UHFFFAOYSA-N 1 1 217.765 3.633 20 0 BHADMO CCC(CC)[N@@H+](CC)C/C(Cl)=C/Cl ZINC000308216857 642502734 /nfs/dbraw/zinc/50/27/34/642502734.db2.gz JSCGJVQCDXPJPU-CLFYSBASSA-N 1 1 224.175 3.816 20 0 BHADMO CCC(CC)[N@@H+](CC)C/C(Cl)=C\Cl ZINC000308216859 642506457 /nfs/dbraw/zinc/50/64/57/642506457.db2.gz JSCGJVQCDXPJPU-VQHVLOKHSA-N 1 1 224.175 3.816 20 0 BHADMO CCCC[N@@H+](C)Cc1ccsc1Cl ZINC000308217465 388433657 /nfs/dbraw/zinc/43/36/57/388433657.db2.gz JXGQQHISYHKTIS-UHFFFAOYSA-N 1 1 217.765 3.633 20 0 BHADMO CC[N@@H+](C/C(Cl)=C\Cl)C1CCCC1 ZINC000308246379 631217082 /nfs/dbraw/zinc/21/70/82/631217082.db2.gz WHBLBQCUVRFWNU-VQHVLOKHSA-N 1 1 222.159 3.570 20 0 BHADMO C[C@H](CF)[NH2+]Cc1csc(Cl)c1Cl ZINC000308256585 385552011 /nfs/dbraw/zinc/55/20/11/385552011.db2.gz KZWBVCLYQHRKFW-RXMQYKEDSA-N 1 1 242.146 3.503 20 0 BHADMO C[C@@H](CF)[NH2+]Cc1csc(Cl)c1Cl ZINC000308256586 385762768 /nfs/dbraw/zinc/76/27/68/385762768.db2.gz KZWBVCLYQHRKFW-YFKPBYRVSA-N 1 1 242.146 3.503 20 0 BHADMO CC[C@H](C)[N@@H+](C/C=C/Cl)C/C=C\Cl ZINC000308301596 631273307 /nfs/dbraw/zinc/27/33/07/631273307.db2.gz MHIHXARDTDGOGB-LSJSYMQGSA-N 1 1 222.159 3.592 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1ccsc1Cl ZINC000308313883 171309386 /nfs/dbraw/zinc/30/93/86/171309386.db2.gz TZCVYYJZWDCTII-QMMMGPOBSA-N 1 1 217.765 3.632 20 0 BHADMO CC[C@@H](C)[N@@H+](C)Cc1cscc1Cl ZINC000308314975 491136040 /nfs/dbraw/zinc/13/60/40/491136040.db2.gz UVBIMMFRWXDKMI-MRVPVSSYSA-N 1 1 217.765 3.632 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1cscc1Cl ZINC000308314976 491136052 /nfs/dbraw/zinc/13/60/52/491136052.db2.gz UVBIMMFRWXDKMI-QMMMGPOBSA-N 1 1 217.765 3.632 20 0 BHADMO CCCC[N@@H+](C/C(Cl)=C/Cl)C1CC1 ZINC000308414825 631329544 /nfs/dbraw/zinc/32/95/44/631329544.db2.gz MXWJSBXNPONULC-CLFYSBASSA-N 1 1 222.159 3.570 20 0 BHADMO CCCC[N@H+](C/C(Cl)=C/Cl)C1CC1 ZINC000308414825 631329540 /nfs/dbraw/zinc/32/95/40/631329540.db2.gz MXWJSBXNPONULC-CLFYSBASSA-N 1 1 222.159 3.570 20 0 BHADMO CCCC[N@@H+](C/C(Cl)=C\Cl)C1CC1 ZINC000308414827 631328721 /nfs/dbraw/zinc/32/87/21/631328721.db2.gz MXWJSBXNPONULC-VQHVLOKHSA-N 1 1 222.159 3.570 20 0 BHADMO CCCC[N@H+](C/C(Cl)=C\Cl)C1CC1 ZINC000308414827 631328716 /nfs/dbraw/zinc/32/87/16/631328716.db2.gz MXWJSBXNPONULC-VQHVLOKHSA-N 1 1 222.159 3.570 20 0 BHADMO C[N@@H+](C/C(Cl)=C\Cl)C1(C)CCCC1 ZINC000308415339 631328773 /nfs/dbraw/zinc/32/87/73/631328773.db2.gz MZOADUCPFKROTM-VQHVLOKHSA-N 1 1 222.159 3.570 20 0 BHADMO C[N@@H+](C/C(Cl)=C\Cl)C1CCCCC1 ZINC000308433277 631331644 /nfs/dbraw/zinc/33/16/44/631331644.db2.gz UUMHDHFESAADNC-VQHVLOKHSA-N 1 1 222.159 3.570 20 0 BHADMO CC[NH+](CC)Cc1csc(Cl)c1Cl ZINC000308441402 386215760 /nfs/dbraw/zinc/21/57/60/386215760.db2.gz YYPZRUVDZVQMNJ-UHFFFAOYSA-N 1 1 238.183 3.897 20 0 BHADMO C[N@@H+](C/C=C\Cl)Cc1ccc(Cl)s1 ZINC000308469836 631301694 /nfs/dbraw/zinc/30/16/94/631301694.db2.gz KBQUURPSLCZKGB-DJWKRKHSSA-N 1 1 236.167 3.586 20 0 BHADMO C[N@H+](C/C=C\Cl)Cc1ccc(Cl)s1 ZINC000308469836 631301689 /nfs/dbraw/zinc/30/16/89/631301689.db2.gz KBQUURPSLCZKGB-DJWKRKHSSA-N 1 1 236.167 3.586 20 0 BHADMO CC[C@@H]1CC[C@@H](C)[N@H+]1C/C(Cl)=C\Cl ZINC000308493607 631402271 /nfs/dbraw/zinc/40/22/71/631402271.db2.gz SJYZYGLINMMFMG-GCWOIFJASA-N 1 1 222.159 3.568 20 0 BHADMO CC[C@@H]1CC[C@H](C)[N@H+]1C/C(Cl)=C\Cl ZINC000308493608 631403596 /nfs/dbraw/zinc/40/35/96/631403596.db2.gz SJYZYGLINMMFMG-YSPXFBHJSA-N 1 1 222.159 3.568 20 0 BHADMO Clc1sccc1C[NH2+]Cc1ccsc1 ZINC000308524306 384780480 /nfs/dbraw/zinc/78/04/80/384780480.db2.gz WKEWKBWZPPUWOV-UHFFFAOYSA-N 1 1 243.784 3.753 20 0 BHADMO C[C@@H]([NH2+]CCc1ccc(Cl)cc1)C(C)(F)F ZINC000308527110 388441665 /nfs/dbraw/zinc/44/16/65/388441665.db2.gz PMWSYMYDLWTQKH-SECBINFHSA-N 1 1 247.716 3.516 20 0 BHADMO C[C@H]([NH2+]CCc1ccc(Cl)cc1)C(C)(F)F ZINC000308527111 388441359 /nfs/dbraw/zinc/44/13/59/388441359.db2.gz PMWSYMYDLWTQKH-VIFPVBQESA-N 1 1 247.716 3.516 20 0 BHADMO CC(C)c1[nH+]ccn1CCc1ccc(Cl)cc1 ZINC000308596259 528372532 /nfs/dbraw/zinc/37/25/32/528372532.db2.gz MPUYXKLWFOBCKN-UHFFFAOYSA-N 1 1 248.757 3.903 20 0 BHADMO CC(C)c1[nH+]ccn1CCCC(C)(C)C ZINC000308731827 167692759 /nfs/dbraw/zinc/69/27/59/167692759.db2.gz AKGZQJBLGOSPRO-UHFFFAOYSA-N 1 1 208.349 3.833 20 0 BHADMO CCCc1[nH+]ccn1CCCC(C)(C)C ZINC000308737406 187994399 /nfs/dbraw/zinc/99/43/99/187994399.db2.gz KKYXETVAKMVBHK-UHFFFAOYSA-N 1 1 208.349 3.662 20 0 BHADMO CCCc1[nH+]ccn1C[C@H](C)CC(C)C ZINC000308743277 388448890 /nfs/dbraw/zinc/44/88/90/388448890.db2.gz NMAUYODTLHFRHJ-GFCCVEGCSA-N 1 1 208.349 3.518 20 0 BHADMO CCCc1[nH+]ccn1C[C@@H](C)CC(C)C ZINC000308743278 388448873 /nfs/dbraw/zinc/44/88/73/388448873.db2.gz NMAUYODTLHFRHJ-LBPRGKRZSA-N 1 1 208.349 3.518 20 0 BHADMO CC(C)c1[nH+]ccn1CCSC(C)(C)C ZINC000308798824 633816963 /nfs/dbraw/zinc/81/69/63/633816963.db2.gz LRFPTMRODQWMGQ-UHFFFAOYSA-N 1 1 226.389 3.538 20 0 BHADMO C[C@@H]([N@@H+](C)Cc1csc(Cl)n1)C(C)(C)C ZINC000308803978 631667154 /nfs/dbraw/zinc/66/71/54/631667154.db2.gz LUPPFARVGANSOR-MRVPVSSYSA-N 1 1 246.807 3.663 20 0 BHADMO C[C@@H]([N@H+](C)Cc1csc(Cl)n1)C(C)(C)C ZINC000308803978 631667152 /nfs/dbraw/zinc/66/71/52/631667152.db2.gz LUPPFARVGANSOR-MRVPVSSYSA-N 1 1 246.807 3.663 20 0 BHADMO C[C@H]([N@@H+](C)Cc1csc(Cl)n1)C(C)(C)C ZINC000308803983 631667933 /nfs/dbraw/zinc/66/79/33/631667933.db2.gz LUPPFARVGANSOR-QMMMGPOBSA-N 1 1 246.807 3.663 20 0 BHADMO C[C@H]([N@H+](C)Cc1csc(Cl)n1)C(C)(C)C ZINC000308803983 631667931 /nfs/dbraw/zinc/66/79/31/631667931.db2.gz LUPPFARVGANSOR-QMMMGPOBSA-N 1 1 246.807 3.663 20 0 BHADMO CC(C)(C)SCCNc1cc[nH+]cc1Cl ZINC000308843762 631689384 /nfs/dbraw/zinc/68/93/84/631689384.db2.gz LDLYSBZIHNGGQZ-UHFFFAOYSA-N 1 1 244.791 3.679 20 0 BHADMO FC1(C[NH2+]Cc2ccc(Cl)cc2Cl)CC1 ZINC000308864692 323180450 /nfs/dbraw/zinc/18/04/50/323180450.db2.gz DPNFYPIPGHKMKO-UHFFFAOYSA-N 1 1 248.128 3.585 20 0 BHADMO CCCC[C@@H](C)[N@@H+](C)Cc1cnc(Cl)s1 ZINC000308868087 632013963 /nfs/dbraw/zinc/01/39/63/632013963.db2.gz RJCWBMDOASWXGP-SECBINFHSA-N 1 1 246.807 3.807 20 0 BHADMO CCCC[C@H](C)[N@@H+](C)Cc1cnc(Cl)s1 ZINC000308868388 631697869 /nfs/dbraw/zinc/69/78/69/631697869.db2.gz RJCWBMDOASWXGP-VIFPVBQESA-N 1 1 246.807 3.807 20 0 BHADMO Cc1ccc(C[NH2+]Cc2sccc2Cl)o1 ZINC000308909771 385909350 /nfs/dbraw/zinc/90/93/50/385909350.db2.gz WKGNZQYFCZLBDS-UHFFFAOYSA-N 1 1 241.743 3.593 20 0 BHADMO CCC[C@@H](C)Nc1cc[nH+]c2ccsc21 ZINC000308916557 346938829 /nfs/dbraw/zinc/93/88/29/346938829.db2.gz GBZUXKFGXUACAL-SECBINFHSA-N 1 1 220.341 3.897 20 0 BHADMO CCC[C@H](C)Nc1cc[nH+]c2ccsc21 ZINC000308916560 346939328 /nfs/dbraw/zinc/93/93/28/346939328.db2.gz GBZUXKFGXUACAL-VIFPVBQESA-N 1 1 220.341 3.897 20 0 BHADMO FCC[NH2+][C@H]1CCc2cc(Cl)cc(Cl)c21 ZINC000308954630 229263735 /nfs/dbraw/zinc/26/37/35/229263735.db2.gz WRYOJWZJNCTSNR-JTQLQIEISA-N 1 1 248.128 3.540 20 0 BHADMO FCC[NH2+][C@@H]1CCc2cc(Cl)cc(Cl)c21 ZINC000308954632 229263434 /nfs/dbraw/zinc/26/34/34/229263434.db2.gz WRYOJWZJNCTSNR-SNVBAGLBSA-N 1 1 248.128 3.540 20 0 BHADMO CCC(CC)Nc1cc(C2CC2)cc[nH+]1 ZINC000308963983 168393516 /nfs/dbraw/zinc/39/35/16/168393516.db2.gz UBODDQCQCATUMC-UHFFFAOYSA-N 1 1 204.317 3.560 20 0 BHADMO CC(C)CCNc1cc[nH+]c2ccsc21 ZINC000308995090 397844467 /nfs/dbraw/zinc/84/44/67/397844467.db2.gz MGRLMVSYTROQEE-UHFFFAOYSA-N 1 1 220.341 3.754 20 0 BHADMO C[C@H]([NH2+]C/C=C\Cl)c1c(F)cccc1Cl ZINC000309000659 631801097 /nfs/dbraw/zinc/80/10/97/631801097.db2.gz NZRJFYHPYSKBFH-LBLVLHIFSA-N 1 1 248.128 3.882 20 0 BHADMO C[C@@H]([NH2+]C/C=C\Cl)c1c(F)cccc1Cl ZINC000309000660 631801742 /nfs/dbraw/zinc/80/17/42/631801742.db2.gz NZRJFYHPYSKBFH-WAXIIBMWSA-N 1 1 248.128 3.882 20 0 BHADMO C[C@H](CSC(C)(C)C)[NH2+]C(C)(C)C(F)F ZINC000309017448 631801907 /nfs/dbraw/zinc/80/19/07/631801907.db2.gz VDDOWTJBNXRUAD-MRVPVSSYSA-N 1 1 239.375 3.540 20 0 BHADMO C[C@@H](CSC(C)(C)C)[NH2+]C(C)(C)C(F)F ZINC000309017449 631800920 /nfs/dbraw/zinc/80/09/20/631800920.db2.gz VDDOWTJBNXRUAD-QMMMGPOBSA-N 1 1 239.375 3.540 20 0 BHADMO CC(C)=CCNc1cc[nH+]c2ccsc21 ZINC000309026193 385369423 /nfs/dbraw/zinc/36/94/23/385369423.db2.gz APGSOHWNAIZFMP-UHFFFAOYSA-N 1 1 218.325 3.674 20 0 BHADMO Clc1ccc(Cl)c(C[NH+]2CCCCC2)c1 ZINC000309052381 349407707 /nfs/dbraw/zinc/40/77/07/349407707.db2.gz QLWRLYHXGGKSLL-UHFFFAOYSA-N 1 1 244.165 3.979 20 0 BHADMO Clc1cccc(C[NH+]2CCCCC2)c1Cl ZINC000309064391 229318451 /nfs/dbraw/zinc/31/84/51/229318451.db2.gz YGRKZEDXSSRIJU-UHFFFAOYSA-N 1 1 244.165 3.979 20 0 BHADMO Cc1ccc(NCc2ccsc2Cl)[nH+]c1 ZINC000309069908 385402020 /nfs/dbraw/zinc/40/20/20/385402020.db2.gz AYQPLUUNNJREKG-UHFFFAOYSA-N 1 1 238.743 3.717 20 0 BHADMO CC(C)CCC[C@H](C)[NH2+]C1(C(F)F)CC1 ZINC000309076261 527706275 /nfs/dbraw/zinc/70/62/75/527706275.db2.gz KSUXDTPQBCPAMC-JTQLQIEISA-N 1 1 219.319 3.589 20 0 BHADMO CC(C)CCC[C@@H](C)[NH2+]C1(C(F)F)CC1 ZINC000309076262 527705619 /nfs/dbraw/zinc/70/56/19/527705619.db2.gz KSUXDTPQBCPAMC-SNVBAGLBSA-N 1 1 219.319 3.589 20 0 BHADMO Cc1occc1C[NH2+]Cc1cscc1Cl ZINC000309078361 491144225 /nfs/dbraw/zinc/14/42/25/491144225.db2.gz NCQMEGVXVQEULA-UHFFFAOYSA-N 1 1 241.743 3.593 20 0 BHADMO c1cc2[nH+]ccc(NC3CCCC3)c2s1 ZINC000309082007 534479534 /nfs/dbraw/zinc/47/95/34/534479534.db2.gz RBEPYWJRZGJTQU-UHFFFAOYSA-N 1 1 218.325 3.651 20 0 BHADMO Cc1occc1C[NH2+]Cc1sccc1Cl ZINC000309083719 491144440 /nfs/dbraw/zinc/14/44/40/491144440.db2.gz UGSTYGKCBDBTCJ-UHFFFAOYSA-N 1 1 241.743 3.593 20 0 BHADMO Cc1occc1C[NH2+]Cc1ccsc1Cl ZINC000309087353 491144303 /nfs/dbraw/zinc/14/43/03/491144303.db2.gz ZKDKSDRLYTUGQQ-UHFFFAOYSA-N 1 1 241.743 3.593 20 0 BHADMO CCC[N@H+](Cc1csc(Cl)n1)CC(C)C ZINC000309090659 631875151 /nfs/dbraw/zinc/87/51/51/631875151.db2.gz DJFDOCXTWPCWTR-UHFFFAOYSA-N 1 1 246.807 3.665 20 0 BHADMO C[C@@H]([NH2+]Cc1cscc1Cl)c1ccco1 ZINC000309110635 631888708 /nfs/dbraw/zinc/88/87/08/631888708.db2.gz JNPJJUGUBMGQDO-MRVPVSSYSA-N 1 1 241.743 3.845 20 0 BHADMO C[C@H]([NH2+]Cc1cscc1Cl)c1ccco1 ZINC000309110636 631888930 /nfs/dbraw/zinc/88/89/30/631888930.db2.gz JNPJJUGUBMGQDO-QMMMGPOBSA-N 1 1 241.743 3.845 20 0 BHADMO C[C@@H]1CC[C@@H]1Nc1cc[nH+]c2ccsc21 ZINC000309128033 534201718 /nfs/dbraw/zinc/20/17/18/534201718.db2.gz QJIVVGNTLWNQGJ-BDAKNGLRSA-N 1 1 218.325 3.507 20 0 BHADMO C[C@H]1CC[C@H]1Nc1cc[nH+]c2ccsc21 ZINC000309128035 533772229 /nfs/dbraw/zinc/77/22/29/533772229.db2.gz QJIVVGNTLWNQGJ-DTWKUNHWSA-N 1 1 218.325 3.507 20 0 BHADMO C[C@H]1CC[C@@H]1Nc1cc[nH+]c2ccsc21 ZINC000309128038 533725798 /nfs/dbraw/zinc/72/57/98/533725798.db2.gz QJIVVGNTLWNQGJ-IUCAKERBSA-N 1 1 218.325 3.507 20 0 BHADMO C[C@@H]1CC[C@H]1Nc1cc[nH+]c2ccsc21 ZINC000309128040 534263508 /nfs/dbraw/zinc/26/35/08/534263508.db2.gz QJIVVGNTLWNQGJ-RKDXNWHRSA-N 1 1 218.325 3.507 20 0 BHADMO CC[C@@H](Nc1cccc(C)[nH+]1)C(C)(C)C ZINC000309138853 385102402 /nfs/dbraw/zinc/10/24/02/385102402.db2.gz GPQKJGGOWQQLSU-LLVKDONJSA-N 1 1 206.333 3.627 20 0 BHADMO CC[C@H](Nc1cccc(C)[nH+]1)C(C)(C)C ZINC000309138855 385432589 /nfs/dbraw/zinc/43/25/89/385432589.db2.gz GPQKJGGOWQQLSU-NSHDSACASA-N 1 1 206.333 3.627 20 0 BHADMO C[C@@H]([NH2+]Cc1ccsc1Cl)c1ccc[nH]1 ZINC000309153138 631909772 /nfs/dbraw/zinc/90/97/72/631909772.db2.gz WUIUSWHGBLHTRF-MRVPVSSYSA-N 1 1 240.759 3.580 20 0 BHADMO C[C@H]([NH2+]Cc1ccsc1Cl)c1ccc[nH]1 ZINC000309153142 631909884 /nfs/dbraw/zinc/90/98/84/631909884.db2.gz WUIUSWHGBLHTRF-QMMMGPOBSA-N 1 1 240.759 3.580 20 0 BHADMO Cc1ccoc1C[NH2+]Cc1ccsc1Cl ZINC000309171085 385448590 /nfs/dbraw/zinc/44/85/90/385448590.db2.gz LJOBQUMGUWYODQ-UHFFFAOYSA-N 1 1 241.743 3.593 20 0 BHADMO Cc1cc[nH+]c(NCc2ccsc2Cl)c1 ZINC000309182473 385453664 /nfs/dbraw/zinc/45/36/64/385453664.db2.gz NZMPXFDIYXCQQT-UHFFFAOYSA-N 1 1 238.743 3.717 20 0 BHADMO CCC[N@H+](Cc1cccc(Cl)n1)CC(C)C ZINC000309222824 631969140 /nfs/dbraw/zinc/96/91/40/631969140.db2.gz JILJABGJYLWALC-UHFFFAOYSA-N 1 1 240.778 3.603 20 0 BHADMO CCC[N@H+](Cc1ccc(Cl)nc1)CC(C)C ZINC000309230513 632827560 /nfs/dbraw/zinc/82/75/60/632827560.db2.gz KOONSWLTAHIIHY-UHFFFAOYSA-N 1 1 240.778 3.603 20 0 BHADMO Cc1ccoc1C[NH2+]Cc1cscc1Cl ZINC000309234209 410538352 /nfs/dbraw/zinc/53/83/52/410538352.db2.gz XHRHSUSOOSJNOL-UHFFFAOYSA-N 1 1 241.743 3.593 20 0 BHADMO CC[N@@H+](Cc1cccnc1Cl)CC(C)(C)C ZINC000309259930 632853416 /nfs/dbraw/zinc/85/34/16/632853416.db2.gz BPMLRFQQDPQUAT-UHFFFAOYSA-N 1 1 240.778 3.603 20 0 BHADMO CCC[N@H+](Cc1cccnc1Cl)CC(C)C ZINC000309307197 632918212 /nfs/dbraw/zinc/91/82/12/632918212.db2.gz ZNDYZDNUWCBZOX-UHFFFAOYSA-N 1 1 240.778 3.603 20 0 BHADMO CC(C)c1ccc[nH+]c1NCc1cccs1 ZINC000309315030 385527451 /nfs/dbraw/zinc/52/74/51/385527451.db2.gz CUUPHADEHXKMHW-UHFFFAOYSA-N 1 1 232.352 3.879 20 0 BHADMO CC(C)c1ccc[nH+]c1NCc1ccsc1 ZINC000309329600 385534277 /nfs/dbraw/zinc/53/42/77/385534277.db2.gz HLPLDLITYQIEFF-UHFFFAOYSA-N 1 1 232.352 3.879 20 0 BHADMO CC(C)C1CCC([NH2+]C2(C(F)F)CC2)CC1 ZINC000309334546 383880326 /nfs/dbraw/zinc/88/03/26/383880326.db2.gz AGJREYISETVOHF-UHFFFAOYSA-N 1 1 231.330 3.589 20 0 BHADMO CC[N@@H+](Cc1ccnc(Cl)c1)CC(C)(C)C ZINC000309363729 632023083 /nfs/dbraw/zinc/02/30/83/632023083.db2.gz OKUDCSIAYMMZFL-UHFFFAOYSA-N 1 1 240.778 3.603 20 0 BHADMO c1cc2[nH+]ccc(NCC3CCCC3)c2s1 ZINC000309364995 383907685 /nfs/dbraw/zinc/90/76/85/383907685.db2.gz PKRCPPZEPMWCTI-UHFFFAOYSA-N 1 1 232.352 3.898 20 0 BHADMO CCCC[C@@H](C)[N@@H+](C)Cc1ccnc(Cl)c1 ZINC000309384513 632023407 /nfs/dbraw/zinc/02/34/07/632023407.db2.gz GWUKMLJBQJSEPP-LLVKDONJSA-N 1 1 240.778 3.746 20 0 BHADMO CCCC[C@H](C)[N@@H+](C)Cc1ccnc(Cl)c1 ZINC000309384515 633906001 /nfs/dbraw/zinc/90/60/01/633906001.db2.gz GWUKMLJBQJSEPP-NSHDSACASA-N 1 1 240.778 3.746 20 0 BHADMO C[C@H]1CC[C@H](Nc2cc(C3CC3)cc[nH+]2)C1 ZINC000309388321 177205179 /nfs/dbraw/zinc/20/51/79/177205179.db2.gz FIWGDVUTXJPBBW-GWCFXTLKSA-N 1 1 216.328 3.560 20 0 BHADMO C[C@H]1CC[C@@H](Nc2cc(C3CC3)cc[nH+]2)C1 ZINC000309388330 177194002 /nfs/dbraw/zinc/19/40/02/177194002.db2.gz FIWGDVUTXJPBBW-GXFFZTMASA-N 1 1 216.328 3.560 20 0 BHADMO C[C@@H]1CC[C@H](Nc2cc(C3CC3)cc[nH+]2)C1 ZINC000309388337 176235073 /nfs/dbraw/zinc/23/50/73/176235073.db2.gz FIWGDVUTXJPBBW-MFKMUULPSA-N 1 1 216.328 3.560 20 0 BHADMO C[C@@H]1CC[C@@H](Nc2cc(C3CC3)cc[nH+]2)C1 ZINC000309388344 176214401 /nfs/dbraw/zinc/21/44/01/176214401.db2.gz FIWGDVUTXJPBBW-ZWNOBZJWSA-N 1 1 216.328 3.560 20 0 BHADMO Cc1[nH+]cn(CC2CCC(C)(C)CC2)c1C ZINC000309400376 180285497 /nfs/dbraw/zinc/28/54/97/180285497.db2.gz DKCFCIKOZQNNCD-UHFFFAOYSA-N 1 1 220.360 3.716 20 0 BHADMO CC(C)c1[nH+]ccn1C[C@@H]1CCC[C@@H](C)C1 ZINC000309401921 385571545 /nfs/dbraw/zinc/57/15/45/385571545.db2.gz DROJXTHCWFPXCD-CHWSQXEVSA-N 1 1 220.360 3.833 20 0 BHADMO CC(C)c1[nH+]ccn1C[C@H]1CCC[C@@H](C)C1 ZINC000309401922 167693941 /nfs/dbraw/zinc/69/39/41/167693941.db2.gz DROJXTHCWFPXCD-OLZOCXBDSA-N 1 1 220.360 3.833 20 0 BHADMO CC(C)c1[nH+]ccn1C[C@@H]1CCC[C@H](C)C1 ZINC000309401923 385570976 /nfs/dbraw/zinc/57/09/76/385570976.db2.gz DROJXTHCWFPXCD-QWHCGFSZSA-N 1 1 220.360 3.833 20 0 BHADMO CC(C)c1[nH+]ccn1C[C@H]1CCC[C@H](C)C1 ZINC000309401924 167694230 /nfs/dbraw/zinc/69/42/30/167694230.db2.gz DROJXTHCWFPXCD-STQMWFEESA-N 1 1 220.360 3.833 20 0 BHADMO CCc1[nH+]ccn1CC1CCC(C)(C)CC1 ZINC000309402705 172025457 /nfs/dbraw/zinc/02/54/57/172025457.db2.gz DVBQPZCPLDFGAM-UHFFFAOYSA-N 1 1 220.360 3.662 20 0 BHADMO CCCC[C@@H](C)[N@@H+](C)CCC(=O)C(C)(C)C ZINC000309409482 633029111 /nfs/dbraw/zinc/02/91/11/633029111.db2.gz JZCFLEMSCAPDGT-GFCCVEGCSA-N 1 1 227.392 3.502 20 0 BHADMO CCCC[C@H](C)[N@@H+](C)CCC(=O)C(C)(C)C ZINC000309409483 632048848 /nfs/dbraw/zinc/04/88/48/632048848.db2.gz JZCFLEMSCAPDGT-LBPRGKRZSA-N 1 1 227.392 3.502 20 0 BHADMO CC[C@H](CC(F)(F)F)Nc1cccc(C)[nH+]1 ZINC000309409861 385572625 /nfs/dbraw/zinc/57/26/25/385572625.db2.gz BOCFUNSNKRXVCG-SECBINFHSA-N 1 1 232.249 3.533 20 0 BHADMO CC[C@@H](CC(F)(F)F)Nc1cccc(C)[nH+]1 ZINC000309409862 385572263 /nfs/dbraw/zinc/57/22/63/385572263.db2.gz BOCFUNSNKRXVCG-VIFPVBQESA-N 1 1 232.249 3.533 20 0 BHADMO CC[C@H](F)C[NH2+][C@H](C)c1c(F)cccc1Cl ZINC000309438649 384076006 /nfs/dbraw/zinc/07/60/06/384076006.db2.gz HWJUSHOESZQKSK-BDAKNGLRSA-N 1 1 247.716 3.878 20 0 BHADMO CC[C@@H](F)C[NH2+][C@@H](C)c1c(F)cccc1Cl ZINC000309438651 384075578 /nfs/dbraw/zinc/07/55/78/384075578.db2.gz HWJUSHOESZQKSK-DTWKUNHWSA-N 1 1 247.716 3.878 20 0 BHADMO CC[C@H](F)C[NH2+][C@@H](C)c1c(F)cccc1Cl ZINC000309438653 384075756 /nfs/dbraw/zinc/07/57/56/384075756.db2.gz HWJUSHOESZQKSK-IUCAKERBSA-N 1 1 247.716 3.878 20 0 BHADMO CC[C@@H](F)C[NH2+][C@H](C)c1c(F)cccc1Cl ZINC000309438655 384075560 /nfs/dbraw/zinc/07/55/60/384075560.db2.gz HWJUSHOESZQKSK-RKDXNWHRSA-N 1 1 247.716 3.878 20 0 BHADMO CC(C)c1[nH+]ccn1CC1CCC(C)CC1 ZINC000309456206 358708754 /nfs/dbraw/zinc/70/87/54/358708754.db2.gz PORBXDDQFWHCNV-UHFFFAOYSA-N 1 1 220.360 3.833 20 0 BHADMO CCCc1[nH+]ccn1C[C@@H]1CCC[C@@H](C)C1 ZINC000309478524 385606373 /nfs/dbraw/zinc/60/63/73/385606373.db2.gz WCKVPGBCCXSBNB-CHWSQXEVSA-N 1 1 220.360 3.662 20 0 BHADMO CCCc1[nH+]ccn1C[C@H]1CCC[C@@H](C)C1 ZINC000309478525 385605863 /nfs/dbraw/zinc/60/58/63/385605863.db2.gz WCKVPGBCCXSBNB-OLZOCXBDSA-N 1 1 220.360 3.662 20 0 BHADMO CCCc1[nH+]ccn1C[C@@H]1CCC[C@H](C)C1 ZINC000309478526 385605435 /nfs/dbraw/zinc/60/54/35/385605435.db2.gz WCKVPGBCCXSBNB-QWHCGFSZSA-N 1 1 220.360 3.662 20 0 BHADMO CCCc1[nH+]ccn1C[C@H]1CCC[C@H](C)C1 ZINC000309478527 385605301 /nfs/dbraw/zinc/60/53/01/385605301.db2.gz WCKVPGBCCXSBNB-STQMWFEESA-N 1 1 220.360 3.662 20 0 BHADMO Clc1c[nH+]ccc1NCC1(C2CC2)CCC1 ZINC000309493544 385616596 /nfs/dbraw/zinc/61/65/96/385616596.db2.gz JKLWRMUXAGQPQX-UHFFFAOYSA-N 1 1 236.746 3.727 20 0 BHADMO CCc1ccc[nH+]c1N[C@H](C)CCC1CC1 ZINC000309501778 384114135 /nfs/dbraw/zinc/11/41/35/384114135.db2.gz AAGCYOYFNSWADB-LLVKDONJSA-N 1 1 218.344 3.635 20 0 BHADMO CCc1ccc[nH+]c1N[C@@H](C)CCC1CC1 ZINC000309501781 322905696 /nfs/dbraw/zinc/90/56/96/322905696.db2.gz AAGCYOYFNSWADB-NSHDSACASA-N 1 1 218.344 3.635 20 0 BHADMO Cc1ccsc1[C@@H](C)[NH2+][C@@H]1CCCC1(F)F ZINC000309562746 491151641 /nfs/dbraw/zinc/15/16/41/491151641.db2.gz LNHUXHACCHGRIC-NXEZZACHSA-N 1 1 245.338 3.895 20 0 BHADMO Cc1ccsc1[C@H](C)[NH2+][C@H]1CCCC1(F)F ZINC000309562748 491151685 /nfs/dbraw/zinc/15/16/85/491151685.db2.gz LNHUXHACCHGRIC-UWVGGRQHSA-N 1 1 245.338 3.895 20 0 BHADMO Cc1ccsc1[C@H](C)[NH2+][C@@H]1CCCC1(F)F ZINC000309562749 491151668 /nfs/dbraw/zinc/15/16/68/491151668.db2.gz LNHUXHACCHGRIC-VHSXEESVSA-N 1 1 245.338 3.895 20 0 BHADMO Cc1ccsc1[C@@H](C)[NH2+][C@H]1CCCC1(F)F ZINC000309562751 491151653 /nfs/dbraw/zinc/15/16/53/491151653.db2.gz LNHUXHACCHGRIC-ZJUUUORDSA-N 1 1 245.338 3.895 20 0 BHADMO c1cc2[nH+]ccc(NCCCC3CC3)c2s1 ZINC000309564463 326160772 /nfs/dbraw/zinc/16/07/72/326160772.db2.gz QDFQVAZCSUZCAM-UHFFFAOYSA-N 1 1 232.352 3.898 20 0 BHADMO C[C@H](CNc1cc[nH+]c2ccsc21)C1CC1 ZINC000309567414 370231063 /nfs/dbraw/zinc/23/10/63/370231063.db2.gz MPHUAUYWAGOIHG-SECBINFHSA-N 1 1 232.352 3.754 20 0 BHADMO C[C@@H](CNc1cc[nH+]c2ccsc21)C1CC1 ZINC000309567416 370230359 /nfs/dbraw/zinc/23/03/59/370230359.db2.gz MPHUAUYWAGOIHG-VIFPVBQESA-N 1 1 232.352 3.754 20 0 BHADMO CC(C)C[C@@H](C)Nc1cc(C2CC2)cc[nH+]1 ZINC000309596737 385725201 /nfs/dbraw/zinc/72/52/01/385725201.db2.gz IMEHRMPKRWMCJL-LLVKDONJSA-N 1 1 218.344 3.806 20 0 BHADMO CC(C)C[C@H](C)Nc1cc(C2CC2)cc[nH+]1 ZINC000309596738 191127773 /nfs/dbraw/zinc/12/77/73/191127773.db2.gz IMEHRMPKRWMCJL-NSHDSACASA-N 1 1 218.344 3.806 20 0 BHADMO CC[C@H]1CC[C@@H]1Nc1cc(C2CC2)cc[nH+]1 ZINC000309620038 385751255 /nfs/dbraw/zinc/75/12/55/385751255.db2.gz DASYBBWLUISCRD-GWCFXTLKSA-N 1 1 216.328 3.560 20 0 BHADMO CC[C@H]1CC[C@H]1Nc1cc(C2CC2)cc[nH+]1 ZINC000309620039 171648903 /nfs/dbraw/zinc/64/89/03/171648903.db2.gz DASYBBWLUISCRD-GXFFZTMASA-N 1 1 216.328 3.560 20 0 BHADMO CC[C@@H]1CC[C@@H]1Nc1cc(C2CC2)cc[nH+]1 ZINC000309620040 171044780 /nfs/dbraw/zinc/04/47/80/171044780.db2.gz DASYBBWLUISCRD-MFKMUULPSA-N 1 1 216.328 3.560 20 0 BHADMO CC[C@@H]1CC[C@H]1Nc1cc(C2CC2)cc[nH+]1 ZINC000309620041 171060120 /nfs/dbraw/zinc/06/01/20/171060120.db2.gz DASYBBWLUISCRD-ZWNOBZJWSA-N 1 1 216.328 3.560 20 0 BHADMO F[C@@H]1CC[C@H](Nc2cc[nH+]c3ccsc32)C1 ZINC000309645623 385768504 /nfs/dbraw/zinc/76/85/04/385768504.db2.gz QFHBDTUHDRAZGZ-BDAKNGLRSA-N 1 1 236.315 3.599 20 0 BHADMO F[C@H]1CC[C@@H](Nc2cc[nH+]c3ccsc32)C1 ZINC000309645627 385767766 /nfs/dbraw/zinc/76/77/66/385767766.db2.gz QFHBDTUHDRAZGZ-DTWKUNHWSA-N 1 1 236.315 3.599 20 0 BHADMO F[C@H]1CC[C@H](Nc2cc[nH+]c3ccsc32)C1 ZINC000309645630 385767165 /nfs/dbraw/zinc/76/71/65/385767165.db2.gz QFHBDTUHDRAZGZ-IUCAKERBSA-N 1 1 236.315 3.599 20 0 BHADMO F[C@@H]1CC[C@@H](Nc2cc[nH+]c3ccsc32)C1 ZINC000309645633 385767584 /nfs/dbraw/zinc/76/75/84/385767584.db2.gz QFHBDTUHDRAZGZ-RKDXNWHRSA-N 1 1 236.315 3.599 20 0 BHADMO Cc1cccc(N[C@@H]2CC23CCCCC3)[nH+]1 ZINC000309700755 179155297 /nfs/dbraw/zinc/15/52/97/179155297.db2.gz MNTBRTQSRVCQAI-GFCCVEGCSA-N 1 1 216.328 3.525 20 0 BHADMO Cc1cccc(N[C@H]2CC23CCCCC3)[nH+]1 ZINC000309700757 179157708 /nfs/dbraw/zinc/15/77/08/179157708.db2.gz MNTBRTQSRVCQAI-LBPRGKRZSA-N 1 1 216.328 3.525 20 0 BHADMO c1cc(C2CC2)cc(NC2CCCCC2)[nH+]1 ZINC000309705469 183334784 /nfs/dbraw/zinc/33/47/84/183334784.db2.gz VDEKTHQMODXCRC-UHFFFAOYSA-N 1 1 216.328 3.704 20 0 BHADMO Cc1ccsc1C[NH2+]C1(C(F)F)CCCC1 ZINC000309713218 491154811 /nfs/dbraw/zinc/15/48/11/491154811.db2.gz RQQPEVGJCRDSMP-UHFFFAOYSA-N 1 1 245.338 3.724 20 0 BHADMO C[C@@H](CC1CC1)Nc1cc(C2CC2)cc[nH+]1 ZINC000309728010 384559358 /nfs/dbraw/zinc/55/93/58/384559358.db2.gz DPADROVORSDDJG-JTQLQIEISA-N 1 1 216.328 3.560 20 0 BHADMO C[C@H](CC1CC1)Nc1cc(C2CC2)cc[nH+]1 ZINC000309728011 176613907 /nfs/dbraw/zinc/61/39/07/176613907.db2.gz DPADROVORSDDJG-SNVBAGLBSA-N 1 1 216.328 3.560 20 0 BHADMO Cc1cc[nH+]c(N[C@@H]2CC23CCCCC3)c1 ZINC000309729367 384560450 /nfs/dbraw/zinc/56/04/50/384560450.db2.gz ZEFRBLOVQFFWLD-GFCCVEGCSA-N 1 1 216.328 3.525 20 0 BHADMO Cc1cc[nH+]c(N[C@H]2CC23CCCCC3)c1 ZINC000309729368 384559428 /nfs/dbraw/zinc/55/94/28/384559428.db2.gz ZEFRBLOVQFFWLD-LBPRGKRZSA-N 1 1 216.328 3.525 20 0 BHADMO C[C@H]1CCC[C@@H]1Nc1cc(C2CC2)cc[nH+]1 ZINC000309742746 177126773 /nfs/dbraw/zinc/12/67/73/177126773.db2.gz DRTLVWQIGVWNAC-GWCFXTLKSA-N 1 1 216.328 3.560 20 0 BHADMO C[C@H]1CCC[C@H]1Nc1cc(C2CC2)cc[nH+]1 ZINC000309742747 177142666 /nfs/dbraw/zinc/14/26/66/177142666.db2.gz DRTLVWQIGVWNAC-GXFFZTMASA-N 1 1 216.328 3.560 20 0 BHADMO C[C@@H]1CCC[C@@H]1Nc1cc(C2CC2)cc[nH+]1 ZINC000309742748 176132840 /nfs/dbraw/zinc/13/28/40/176132840.db2.gz DRTLVWQIGVWNAC-MFKMUULPSA-N 1 1 216.328 3.560 20 0 BHADMO C[C@@H]1CCC[C@H]1Nc1cc(C2CC2)cc[nH+]1 ZINC000309742749 176151587 /nfs/dbraw/zinc/15/15/87/176151587.db2.gz DRTLVWQIGVWNAC-ZWNOBZJWSA-N 1 1 216.328 3.560 20 0 BHADMO CC1(C)C[C@@H]1CNc1cc[nH+]c2ccsc21 ZINC000309784166 347162965 /nfs/dbraw/zinc/16/29/65/347162965.db2.gz NPTSMVSFDAMBAI-SECBINFHSA-N 1 1 232.352 3.754 20 0 BHADMO CC1(C)C[C@H]1CNc1cc[nH+]c2ccsc21 ZINC000309784167 384607334 /nfs/dbraw/zinc/60/73/34/384607334.db2.gz NPTSMVSFDAMBAI-VIFPVBQESA-N 1 1 232.352 3.754 20 0 BHADMO CC1(CNc2cc(C3CC3)cc[nH+]2)CCC1 ZINC000309792097 633745733 /nfs/dbraw/zinc/74/57/33/633745733.db2.gz PJYUZWBLZIHGRV-UHFFFAOYSA-N 1 1 216.328 3.561 20 0 BHADMO Cc1ccc(N[C@H](C)CCC2CC2)c(C)[nH+]1 ZINC000309799336 384619573 /nfs/dbraw/zinc/61/95/73/384619573.db2.gz WCWHJSINSBPSOW-LLVKDONJSA-N 1 1 218.344 3.689 20 0 BHADMO Cc1ccc(N[C@@H](C)CCC2CC2)c(C)[nH+]1 ZINC000309799338 384839308 /nfs/dbraw/zinc/83/93/08/384839308.db2.gz WCWHJSINSBPSOW-NSHDSACASA-N 1 1 218.344 3.689 20 0 BHADMO C[C@H](Nc1cc(C2CC2)cc[nH+]1)C1CCC1 ZINC000309808627 176931415 /nfs/dbraw/zinc/93/14/15/176931415.db2.gz SWCZZLHHGHSAAW-JTQLQIEISA-N 1 1 216.328 3.560 20 0 BHADMO C[C@@H](Nc1cc(C2CC2)cc[nH+]1)C1CCC1 ZINC000309808631 384635960 /nfs/dbraw/zinc/63/59/60/384635960.db2.gz SWCZZLHHGHSAAW-SNVBAGLBSA-N 1 1 216.328 3.560 20 0 BHADMO C[C@H](CCc1ccsc1)[NH2+]C(C)(C)C(F)F ZINC000309812148 491157089 /nfs/dbraw/zinc/15/70/89/491157089.db2.gz ZLQFYCPZBPIKQG-SECBINFHSA-N 1 1 247.354 3.703 20 0 BHADMO C[C@@H](CCc1ccsc1)[NH2+]C(C)(C)C(F)F ZINC000309812149 491157062 /nfs/dbraw/zinc/15/70/62/491157062.db2.gz ZLQFYCPZBPIKQG-VIFPVBQESA-N 1 1 247.354 3.703 20 0 BHADMO C[C@H](Nc1cc(C2CC2)cc[nH+]1)C(C)(C)C ZINC000309816527 384643324 /nfs/dbraw/zinc/64/33/24/384643324.db2.gz VIZZVLRJIOHZTE-JTQLQIEISA-N 1 1 218.344 3.806 20 0 BHADMO C[C@@H](Nc1cc(C2CC2)cc[nH+]1)C(C)(C)C ZINC000309816529 384644150 /nfs/dbraw/zinc/64/41/50/384644150.db2.gz VIZZVLRJIOHZTE-SNVBAGLBSA-N 1 1 218.344 3.806 20 0 BHADMO CC[C@@H]1CCC[C@@H](C[NH2+]C2(C(F)F)CC2)C1 ZINC000309837990 384434811 /nfs/dbraw/zinc/43/48/11/384434811.db2.gz BUWIAJXIGQFCFA-GHMZBOCLSA-N 1 1 231.330 3.590 20 0 BHADMO CC[C@@H]1CCC[C@H](C[NH2+]C2(C(F)F)CC2)C1 ZINC000309837992 384436337 /nfs/dbraw/zinc/43/63/37/384436337.db2.gz BUWIAJXIGQFCFA-MNOVXSKESA-N 1 1 231.330 3.590 20 0 BHADMO CC[C@H]1CCC[C@H](C[NH2+]C2(C(F)F)CC2)C1 ZINC000309837994 384435451 /nfs/dbraw/zinc/43/54/51/384435451.db2.gz BUWIAJXIGQFCFA-QWRGUYRKSA-N 1 1 231.330 3.590 20 0 BHADMO CC[C@H]1CCC[C@@H](C[NH2+]C2(C(F)F)CC2)C1 ZINC000309837999 384434840 /nfs/dbraw/zinc/43/48/40/384434840.db2.gz BUWIAJXIGQFCFA-WDEREUQCSA-N 1 1 231.330 3.590 20 0 BHADMO CC[C@H](Cc1cccs1)[NH2+]C(C)(C)C(F)F ZINC000309846250 491157001 /nfs/dbraw/zinc/15/70/01/491157001.db2.gz GSPNAFYBYZWVJP-SECBINFHSA-N 1 1 247.354 3.703 20 0 BHADMO CC[C@@H](Cc1cccs1)[NH2+]C(C)(C)C(F)F ZINC000309846251 491157003 /nfs/dbraw/zinc/15/70/03/491157003.db2.gz GSPNAFYBYZWVJP-VIFPVBQESA-N 1 1 247.354 3.703 20 0 BHADMO CS[C@H](CNc1cccc(C)[nH+]1)C(C)(C)C ZINC000309855839 384674209 /nfs/dbraw/zinc/67/42/09/384674209.db2.gz KIRRKGBDSVBZMM-LLVKDONJSA-N 1 1 238.400 3.580 20 0 BHADMO CS[C@@H](CNc1cccc(C)[nH+]1)C(C)(C)C ZINC000309855840 384673662 /nfs/dbraw/zinc/67/36/62/384673662.db2.gz KIRRKGBDSVBZMM-NSHDSACASA-N 1 1 238.400 3.580 20 0 BHADMO Cc1cc(CNc2[nH+]cccc2C)c(C)s1 ZINC000309861187 326172663 /nfs/dbraw/zinc/17/26/63/326172663.db2.gz MPBFTTYWSMSFTF-UHFFFAOYSA-N 1 1 232.352 3.680 20 0 BHADMO Cc1ccc(NC2CCC3(CC3)CC2)[nH+]c1 ZINC000309874828 384684704 /nfs/dbraw/zinc/68/47/04/384684704.db2.gz SCHPXZFSDVIIIS-UHFFFAOYSA-N 1 1 216.328 3.525 20 0 BHADMO Cc1cc(CNc2ccc(C)c[nH+]2)c(C)s1 ZINC000309885835 633904355 /nfs/dbraw/zinc/90/43/55/633904355.db2.gz YEDJQXHRJWNXHO-UHFFFAOYSA-N 1 1 232.352 3.680 20 0 BHADMO CCCc1[nH+]ccn1C[C@@H]1CCCC(F)(F)C1 ZINC000309897643 169596331 /nfs/dbraw/zinc/59/63/31/169596331.db2.gz NIIRDFZYDVGONZ-LLVKDONJSA-N 1 1 242.313 3.661 20 0 BHADMO CCCc1[nH+]ccn1C[C@H]1CCCC(F)(F)C1 ZINC000309897645 384896012 /nfs/dbraw/zinc/89/60/12/384896012.db2.gz NIIRDFZYDVGONZ-NSHDSACASA-N 1 1 242.313 3.661 20 0 BHADMO CCc1ccc[nH+]c1N[C@@H]1CC=C(C)CC1 ZINC000309940882 323122247 /nfs/dbraw/zinc/12/22/47/323122247.db2.gz BOCZLUNNFJRFMG-CYBMUJFWSA-N 1 1 216.328 3.555 20 0 BHADMO CCc1ccc[nH+]c1N[C@H]1CC=C(C)CC1 ZINC000309940884 323122249 /nfs/dbraw/zinc/12/22/49/323122249.db2.gz BOCZLUNNFJRFMG-ZDUSSCGKSA-N 1 1 216.328 3.555 20 0 BHADMO CC[C@@H](C)C[NH2+]c1ccc(N(C)C)c(C)c1 ZINC000309991532 634047485 /nfs/dbraw/zinc/04/74/85/634047485.db2.gz BFLVGNYAYBZPGE-LLVKDONJSA-N 1 1 220.360 3.519 20 0 BHADMO CC[C@H](C)C[NH2+]c1ccc(N(C)C)c(C)c1 ZINC000309991533 634046268 /nfs/dbraw/zinc/04/62/68/634046268.db2.gz BFLVGNYAYBZPGE-NSHDSACASA-N 1 1 220.360 3.519 20 0 BHADMO CCCCNc1c(C)cc([NH+](C)C)cc1C ZINC000310023582 711702328 /nfs/dbraw/zinc/70/23/28/711702328.db2.gz OJWUBCBVQYDMBN-UHFFFAOYSA-N 1 1 220.360 3.581 20 0 BHADMO CC1(CNc2cc[nH+]c3ccsc32)CC1 ZINC000310042233 168047834 /nfs/dbraw/zinc/04/78/34/168047834.db2.gz ZHQLVAIPLWWZAQ-UHFFFAOYSA-N 1 1 218.325 3.508 20 0 BHADMO Cc1ccoc1C[NH2+]Cc1ccc(C)cc1Cl ZINC000310115083 411214258 /nfs/dbraw/zinc/21/42/58/411214258.db2.gz GVNZVPMRWNVBNY-UHFFFAOYSA-N 1 1 249.741 3.840 20 0 BHADMO CC(C)SCCNc1[nH+]ccc2ccccc21 ZINC000310126408 343297670 /nfs/dbraw/zinc/29/76/70/343297670.db2.gz GABXXTHVIMSLSJ-UHFFFAOYSA-N 1 1 246.379 3.788 20 0 BHADMO Cc1ccoc1C[NH2+][C@@H]1CSc2ccccc21 ZINC000310223176 384912844 /nfs/dbraw/zinc/91/28/44/384912844.db2.gz HPDPSWAUGPGMNP-GFCCVEGCSA-N 1 1 245.347 3.525 20 0 BHADMO Cc1ccoc1C[NH2+][C@H]1CSc2ccccc21 ZINC000310223180 384913725 /nfs/dbraw/zinc/91/37/25/384913725.db2.gz HPDPSWAUGPGMNP-LBPRGKRZSA-N 1 1 245.347 3.525 20 0 BHADMO CCc1[nH+]ccn1C[C@@H](C)C1CCCCC1 ZINC000310374643 384802798 /nfs/dbraw/zinc/80/27/98/384802798.db2.gz ZBDOUBKCNNZDBM-GFCCVEGCSA-N 1 1 220.360 3.662 20 0 BHADMO CCc1[nH+]ccn1C[C@H](C)C1CCCCC1 ZINC000310374644 384804886 /nfs/dbraw/zinc/80/48/86/384804886.db2.gz ZBDOUBKCNNZDBM-LBPRGKRZSA-N 1 1 220.360 3.662 20 0 BHADMO CCCC[C@@H](C)[N@@H+](C)Cc1cc(O)cc(F)c1 ZINC000310411264 259327330 /nfs/dbraw/zinc/32/73/30/259327330.db2.gz OZABKRAVABGEPA-LLVKDONJSA-N 1 1 239.334 3.542 20 0 BHADMO CCCC[C@H](C)[N@@H+](C)Cc1cc(O)cc(F)c1 ZINC000310411269 385044906 /nfs/dbraw/zinc/04/49/06/385044906.db2.gz OZABKRAVABGEPA-NSHDSACASA-N 1 1 239.334 3.542 20 0 BHADMO C[C@@H]1C[C@H](Nc2cccc3cc[nH+]cc32)[C@@H]1C ZINC000310474134 411238340 /nfs/dbraw/zinc/23/83/40/411238340.db2.gz CETSVWKTNSMWLZ-HFAKWTLXSA-N 1 1 226.323 3.691 20 0 BHADMO C[C@@H]1C[C@@H](Nc2cccc3cc[nH+]cc32)[C@H]1C ZINC000310474138 411238311 /nfs/dbraw/zinc/23/83/11/411238311.db2.gz CETSVWKTNSMWLZ-JRPNMDOOSA-N 1 1 226.323 3.691 20 0 BHADMO C[C@@H]1C[C@@H](Nc2cccc3cc[nH+]cc32)[C@@H]1C ZINC000310474141 411237686 /nfs/dbraw/zinc/23/76/86/411237686.db2.gz CETSVWKTNSMWLZ-UEKVPHQBSA-N 1 1 226.323 3.691 20 0 BHADMO C[C@@H]1C[C@H](Nc2cccc3cc[nH+]cc32)[C@H]1C ZINC000310474144 411238318 /nfs/dbraw/zinc/23/83/18/411238318.db2.gz CETSVWKTNSMWLZ-ZETOZRRWSA-N 1 1 226.323 3.691 20 0 BHADMO C[C@@H]1Cc2[nH+]cn([C@H]3C=CCCC3)c2C[C@@H]1C ZINC000310571454 388485981 /nfs/dbraw/zinc/48/59/81/388485981.db2.gz OCCCFNRVHMFSHC-AGIUHOORSA-N 1 1 230.355 3.535 20 0 BHADMO C[C@@H]1Cc2[nH+]cn([C@@H]3C=CCCC3)c2C[C@@H]1C ZINC000310571455 388485786 /nfs/dbraw/zinc/48/57/86/388485786.db2.gz OCCCFNRVHMFSHC-FRRDWIJNSA-N 1 1 230.355 3.535 20 0 BHADMO C[C@@H]1Cc2[nH+]cn([C@@H]3C=CCCC3)c2C[C@H]1C ZINC000310571456 534089810 /nfs/dbraw/zinc/08/98/10/534089810.db2.gz OCCCFNRVHMFSHC-JHJVBQTASA-N 1 1 230.355 3.535 20 0 BHADMO C[C@@H]1Cc2[nH+]cn([C@H]3C=CCCC3)c2C[C@H]1C ZINC000310571457 534089698 /nfs/dbraw/zinc/08/96/98/534089698.db2.gz OCCCFNRVHMFSHC-UPJWGTAASA-N 1 1 230.355 3.535 20 0 BHADMO CCc1nc(N[C@H](C)c2ccccc2)cc(C)[nH+]1 ZINC000310710317 358445405 /nfs/dbraw/zinc/44/54/05/358445405.db2.gz KIOPVIGBFKNRJT-GFCCVEGCSA-N 1 1 241.338 3.521 20 0 BHADMO CCc1nc(N[C@@H](C)c2ccccc2)cc(C)[nH+]1 ZINC000310710318 358445306 /nfs/dbraw/zinc/44/53/06/358445306.db2.gz KIOPVIGBFKNRJT-LBPRGKRZSA-N 1 1 241.338 3.521 20 0 BHADMO c1cc2cc[nH+]cc2c(N[C@@H]2CCC[C@H]3C[C@H]32)c1 ZINC000310756759 388376416 /nfs/dbraw/zinc/37/64/16/388376416.db2.gz NTLMPZAZZQMZJH-GZBFAFLISA-N 1 1 238.334 3.835 20 0 BHADMO Cc1ccc(OCC[C@@H]2CCCC[N@@H+]2C)cc1C ZINC000310888403 636685428 /nfs/dbraw/zinc/68/54/28/636685428.db2.gz JXBFGZGNADXFBU-HNNXBMFYSA-N 1 1 247.382 3.557 20 0 BHADMO Cc1ccc(OCC[C@H]2CCCC[N@@H+]2C)cc1C ZINC000310888404 636684720 /nfs/dbraw/zinc/68/47/20/636684720.db2.gz JXBFGZGNADXFBU-OAHLLOKOSA-N 1 1 247.382 3.557 20 0 BHADMO C[C@H]1CC[C@@H]1Nc1ccc([NH+]2CCCCC2)cc1 ZINC000310898042 633015039 /nfs/dbraw/zinc/01/50/39/633015039.db2.gz DSFOZRNQCWYTOB-BBRMVZONSA-N 1 1 244.382 3.887 20 0 BHADMO C[C@@H]1CC[C@@H]1Nc1ccc([NH+]2CCCCC2)cc1 ZINC000310898043 633016321 /nfs/dbraw/zinc/01/63/21/633016321.db2.gz DSFOZRNQCWYTOB-CJNGLKHVSA-N 1 1 244.382 3.887 20 0 BHADMO C[C@@H]1CC[C@H]1Nc1ccc([NH+]2CCCCC2)cc1 ZINC000310898044 633015891 /nfs/dbraw/zinc/01/58/91/633015891.db2.gz DSFOZRNQCWYTOB-CZUORRHYSA-N 1 1 244.382 3.887 20 0 BHADMO C[C@H]1CC[C@H]1Nc1ccc([NH+]2CCCCC2)cc1 ZINC000310898046 633015764 /nfs/dbraw/zinc/01/57/64/633015764.db2.gz DSFOZRNQCWYTOB-XJKSGUPXSA-N 1 1 244.382 3.887 20 0 BHADMO FC1(F)CC[C@@H](Nc2[nH+]ccc3ccccc32)C1 ZINC000310906743 326206458 /nfs/dbraw/zinc/20/64/58/326206458.db2.gz CCQBHGRAMNELNM-LLVKDONJSA-N 1 1 248.276 3.835 20 0 BHADMO FC1(F)CC[C@H](Nc2[nH+]ccc3ccccc32)C1 ZINC000310906745 326206343 /nfs/dbraw/zinc/20/63/43/326206343.db2.gz CCQBHGRAMNELNM-NSHDSACASA-N 1 1 248.276 3.835 20 0 BHADMO CCC[N@@H+](CCC(=O)c1ccccc1)CC(C)C ZINC000310926716 385119363 /nfs/dbraw/zinc/11/93/63/385119363.db2.gz IDYULPXRVQZJQG-UHFFFAOYSA-N 1 1 247.382 3.627 20 0 BHADMO Oc1ccc(C[N@H+]2CCC3(C2)CCCCC3)cc1 ZINC000311016843 538112207 /nfs/dbraw/zinc/11/22/07/538112207.db2.gz STVAKMHCDNTISU-UHFFFAOYSA-N 1 1 245.366 3.548 20 0 BHADMO Cc1ccoc1C[NH2+]Cc1cc2ccccc2o1 ZINC000311089653 397889739 /nfs/dbraw/zinc/88/97/39/397889739.db2.gz HVTGKRPGHFMZMX-UHFFFAOYSA-N 1 1 241.290 3.624 20 0 BHADMO CCCC[C@H](C)[N@@H+](C)CC[C@@H](O)c1ccccc1 ZINC000311230661 711683050 /nfs/dbraw/zinc/68/30/50/711683050.db2.gz QZCIIHOMQCCWMI-GOEBONIOSA-N 1 1 249.398 3.621 20 0 BHADMO CCCC[C@H](C)[N@@H+](C)CC[C@H](O)c1ccccc1 ZINC000311230662 711683059 /nfs/dbraw/zinc/68/30/59/711683059.db2.gz QZCIIHOMQCCWMI-HOCLYGCPSA-N 1 1 249.398 3.621 20 0 BHADMO CCCC[C@@H](C)[N@@H+](C)CC[C@H](O)c1ccccc1 ZINC000311230663 711682941 /nfs/dbraw/zinc/68/29/41/711682941.db2.gz QZCIIHOMQCCWMI-ZBFHGGJFSA-N 1 1 249.398 3.621 20 0 BHADMO Cc1ccc(C[NH2+]Cc2ccsc2Cl)o1 ZINC000312534089 385070403 /nfs/dbraw/zinc/07/04/03/385070403.db2.gz BTWAXYADZWQNLY-UHFFFAOYSA-N 1 1 241.743 3.593 20 0 BHADMO CC(C)(C)CCC[NH2+][C@H]1C[C@@H](N)c2ccccc21 ZINC000313269616 370575570 /nfs/dbraw/zinc/57/55/70/370575570.db2.gz ZAXMLQAIAFIWBU-CABCVRRESA-N 1 1 246.398 3.547 20 0 BHADMO CC(C)(C)CCC[NH2+][C@H]1C[C@H](N)c2ccccc21 ZINC000313269617 490296242 /nfs/dbraw/zinc/29/62/42/490296242.db2.gz ZAXMLQAIAFIWBU-GJZGRUSLSA-N 1 1 246.398 3.547 20 0 BHADMO CC(C)(C)CCC[NH2+][C@@H]1C[C@@H](N)c2ccccc21 ZINC000313269619 490296833 /nfs/dbraw/zinc/29/68/33/490296833.db2.gz ZAXMLQAIAFIWBU-HUUCEWRRSA-N 1 1 246.398 3.547 20 0 BHADMO CC(C)(C)CCC[NH2+][C@@H]1C[C@H](N)c2ccccc21 ZINC000313269620 490296775 /nfs/dbraw/zinc/29/67/75/490296775.db2.gz ZAXMLQAIAFIWBU-LSDHHAIUSA-N 1 1 246.398 3.547 20 0 BHADMO CC[C@@H](C)[C@@H](C)[NH2+]c1ccc2c(c1)CCN2 ZINC000318746812 259378144 /nfs/dbraw/zinc/37/81/44/259378144.db2.gz ADWXHCBEBXBKAA-GHMZBOCLSA-N 1 1 218.344 3.501 20 0 BHADMO CC[C@@H](C)[C@H](C)[NH2+]c1ccc2c(c1)CCN2 ZINC000318746814 259378279 /nfs/dbraw/zinc/37/82/79/259378279.db2.gz ADWXHCBEBXBKAA-MNOVXSKESA-N 1 1 218.344 3.501 20 0 BHADMO CC[C@H](C)[C@H](C)[NH2+]c1ccc2c(c1)CCN2 ZINC000318746817 259378226 /nfs/dbraw/zinc/37/82/26/259378226.db2.gz ADWXHCBEBXBKAA-QWRGUYRKSA-N 1 1 218.344 3.501 20 0 BHADMO CC[C@H](C)[C@@H](C)[NH2+]c1ccc2c(c1)CCN2 ZINC000318746820 259378097 /nfs/dbraw/zinc/37/80/97/259378097.db2.gz ADWXHCBEBXBKAA-WDEREUQCSA-N 1 1 218.344 3.501 20 0 BHADMO CC[C@@H](C)[C@@H](C)[N@@H+](Cc1cccc(N)c1)C1CC1 ZINC000318981035 384983605 /nfs/dbraw/zinc/98/36/05/384983605.db2.gz INWNURPRXFNIJK-CHWSQXEVSA-N 1 1 246.398 3.668 20 0 BHADMO CC[C@@H](C)[C@H](C)[N@@H+](Cc1cccc(N)c1)C1CC1 ZINC000318981036 384983589 /nfs/dbraw/zinc/98/35/89/384983589.db2.gz INWNURPRXFNIJK-OLZOCXBDSA-N 1 1 246.398 3.668 20 0 BHADMO CC[C@H](C)[C@@H](C)[N@@H+](Cc1cccc(N)c1)C1CC1 ZINC000318981038 171361929 /nfs/dbraw/zinc/36/19/29/171361929.db2.gz INWNURPRXFNIJK-QWHCGFSZSA-N 1 1 246.398 3.668 20 0 BHADMO CC[C@H](C)[C@H](C)[N@@H+](Cc1cccc(N)c1)C1CC1 ZINC000318981040 171386325 /nfs/dbraw/zinc/38/63/25/171386325.db2.gz INWNURPRXFNIJK-STQMWFEESA-N 1 1 246.398 3.668 20 0 BHADMO CC[C@@H](C)[N@@H+](CC)Cc1cc(C)nc(Cl)c1 ZINC000320365447 711782663 /nfs/dbraw/zinc/78/26/63/711782663.db2.gz DNODVAOQSSMPJC-LLVKDONJSA-N 1 1 240.778 3.664 20 0 BHADMO CC[C@H](C)[N@@H+](CC)Cc1cc(C)nc(Cl)c1 ZINC000320365448 711782602 /nfs/dbraw/zinc/78/26/02/711782602.db2.gz DNODVAOQSSMPJC-NSHDSACASA-N 1 1 240.778 3.664 20 0 BHADMO CCC[N@@H+](Cc1cc(C)nc(Cl)c1)C(C)C ZINC000320372119 643709063 /nfs/dbraw/zinc/70/90/63/643709063.db2.gz FLFLECZKZKRSMO-UHFFFAOYSA-N 1 1 240.778 3.664 20 0 BHADMO Cc1cc(C[N@H+](C)CC(C)(C)C)cc(Cl)n1 ZINC000320573165 711935909 /nfs/dbraw/zinc/93/59/09/711935909.db2.gz NQEPNIOCDDYVIX-UHFFFAOYSA-N 1 1 240.778 3.521 20 0 BHADMO Cc1cc(C[N@H+](C)CCC(C)C)cc(Cl)n1 ZINC000320648167 711785928 /nfs/dbraw/zinc/78/59/28/711785928.db2.gz VFTKQUINXONAHS-UHFFFAOYSA-N 1 1 240.778 3.521 20 0 BHADMO CCC(C)(C)[N@@H+](C)Cc1cc(C)nc(Cl)c1 ZINC000320655158 636326107 /nfs/dbraw/zinc/32/61/07/636326107.db2.gz WADUYFXWGXQBEH-UHFFFAOYSA-N 1 1 240.778 3.664 20 0 BHADMO Cc1cc(C[N@H+](C)[C@H](C)C(C)C)cc(Cl)n1 ZINC000321299379 644122915 /nfs/dbraw/zinc/12/29/15/644122915.db2.gz KEGFJIMRMZOIQQ-LLVKDONJSA-N 1 1 240.778 3.520 20 0 BHADMO Cc1cc(C[N@H+](C)[C@@H](C)C(C)C)cc(Cl)n1 ZINC000321299381 636619846 /nfs/dbraw/zinc/61/98/46/636619846.db2.gz KEGFJIMRMZOIQQ-NSHDSACASA-N 1 1 240.778 3.520 20 0 BHADMO CCCC[N@@H+](CC)Cc1cc(C)nc(Cl)c1 ZINC000321332142 636636893 /nfs/dbraw/zinc/63/68/93/636636893.db2.gz PQVDBZUWRWVYMS-UHFFFAOYSA-N 1 1 240.778 3.665 20 0 BHADMO CC[C@H](C)C[N@@H+](C)Cc1cc(C)nc(Cl)c1 ZINC000321347752 636635719 /nfs/dbraw/zinc/63/57/19/636635719.db2.gz RSUFELTYMADAEN-JTQLQIEISA-N 1 1 240.778 3.521 20 0 BHADMO CC[C@@H](C)C[N@@H+](C)Cc1cc(C)nc(Cl)c1 ZINC000321347756 636635637 /nfs/dbraw/zinc/63/56/37/636635637.db2.gz RSUFELTYMADAEN-SNVBAGLBSA-N 1 1 240.778 3.521 20 0 BHADMO Cc1occc1C[NH2+][C@@H](C)c1ccccc1F ZINC000321475248 635251314 /nfs/dbraw/zinc/25/13/14/635251314.db2.gz IGPJCESJIXDQNY-JTQLQIEISA-N 1 1 233.286 3.578 20 0 BHADMO Cc1occc1C[NH2+][C@H](C)c1ccccc1F ZINC000321475249 635249686 /nfs/dbraw/zinc/24/96/86/635249686.db2.gz IGPJCESJIXDQNY-SNVBAGLBSA-N 1 1 233.286 3.578 20 0 BHADMO CCc1[nH+]ccn1CC/C=C\c1ccccc1 ZINC000322919344 388450286 /nfs/dbraw/zinc/45/02/86/388450286.db2.gz KKCQNZLOJFZCLI-POHAHGRESA-N 1 1 226.323 3.549 20 0 BHADMO CCc1[nH+]ccn1CC/C=C/c1ccccc1 ZINC000322919345 388449981 /nfs/dbraw/zinc/44/99/81/388449981.db2.gz KKCQNZLOJFZCLI-UXBLZVDNSA-N 1 1 226.323 3.549 20 0 BHADMO Cc1[nH+]cn(CC/C=C\c2ccccc2)c1C ZINC000323736398 386576109 /nfs/dbraw/zinc/57/61/09/386576109.db2.gz RMFXRWLPMZZJGA-POHAHGRESA-N 1 1 226.323 3.603 20 0 BHADMO Cc1[nH+]cn(CC/C=C/c2ccccc2)c1C ZINC000323736399 386576962 /nfs/dbraw/zinc/57/69/62/386576962.db2.gz RMFXRWLPMZZJGA-UXBLZVDNSA-N 1 1 226.323 3.603 20 0 BHADMO CC[C@@H]([NH2+]CC(F)(F)c1ccccc1)C1CC1 ZINC000323920485 326412009 /nfs/dbraw/zinc/41/20/09/326412009.db2.gz UXNVAEPHHFCERE-CYBMUJFWSA-N 1 1 239.309 3.557 20 0 BHADMO CC[C@H]([NH2+]CC(F)(F)c1ccccc1)C1CC1 ZINC000323920487 326411913 /nfs/dbraw/zinc/41/19/13/326411913.db2.gz UXNVAEPHHFCERE-ZDUSSCGKSA-N 1 1 239.309 3.557 20 0 BHADMO Cc1cc[nH+]c(NC(C2CCC2)C2CCC2)c1 ZINC000324730386 387515269 /nfs/dbraw/zinc/51/52/69/387515269.db2.gz JFFATQAZBSOLJW-UHFFFAOYSA-N 1 1 230.355 3.771 20 0 BHADMO Cc1cccc(NC(C2CCC2)C2CCC2)[nH+]1 ZINC000324732197 188081615 /nfs/dbraw/zinc/08/16/15/188081615.db2.gz JYSFFIUQVINBOV-UHFFFAOYSA-N 1 1 230.355 3.771 20 0 BHADMO CCC(C)(C)[N@@H+](C)Cc1cccc(O)c1Cl ZINC000328268949 324367548 /nfs/dbraw/zinc/36/75/48/324367548.db2.gz WPNUOIUWOMCAKI-UHFFFAOYSA-N 1 1 241.762 3.666 20 0 BHADMO CC(C)CC[N@@H+](C)Cc1cccc(O)c1Cl ZINC000328468197 388415554 /nfs/dbraw/zinc/41/55/54/388415554.db2.gz MGARYTKWJYNRFL-UHFFFAOYSA-N 1 1 241.762 3.524 20 0 BHADMO C[N@@H+](Cc1cccc(O)c1Cl)CC(C)(C)C ZINC000328476057 388643635 /nfs/dbraw/zinc/64/36/35/388643635.db2.gz ONSGIUFUBPPMRW-UHFFFAOYSA-N 1 1 241.762 3.524 20 0 BHADMO C[C@H](c1ccccn1)[N@H+]1Cc2ccccc2[C@H]1C ZINC000334188859 352778594 /nfs/dbraw/zinc/77/85/94/352778594.db2.gz HJVCAEIFSQEMJZ-CHWSQXEVSA-N 1 1 238.334 3.719 20 0 BHADMO C[C@H](c1ccccn1)[N@@H+]1Cc2ccccc2[C@H]1C ZINC000334188859 352778592 /nfs/dbraw/zinc/77/85/92/352778592.db2.gz HJVCAEIFSQEMJZ-CHWSQXEVSA-N 1 1 238.334 3.719 20 0 BHADMO C[C@@H](c1ccccn1)[N@H+]1Cc2ccccc2[C@H]1C ZINC000334188886 352778553 /nfs/dbraw/zinc/77/85/53/352778553.db2.gz HJVCAEIFSQEMJZ-OLZOCXBDSA-N 1 1 238.334 3.719 20 0 BHADMO C[C@@H](c1ccccn1)[N@@H+]1Cc2ccccc2[C@H]1C ZINC000334188886 352778551 /nfs/dbraw/zinc/77/85/51/352778551.db2.gz HJVCAEIFSQEMJZ-OLZOCXBDSA-N 1 1 238.334 3.719 20 0 BHADMO C[C@H](c1ccccn1)[N@H+]1Cc2ccccc2[C@@H]1C ZINC000334188891 352778977 /nfs/dbraw/zinc/77/89/77/352778977.db2.gz HJVCAEIFSQEMJZ-QWHCGFSZSA-N 1 1 238.334 3.719 20 0 BHADMO C[C@H](c1ccccn1)[N@@H+]1Cc2ccccc2[C@@H]1C ZINC000334188891 352778975 /nfs/dbraw/zinc/77/89/75/352778975.db2.gz HJVCAEIFSQEMJZ-QWHCGFSZSA-N 1 1 238.334 3.719 20 0 BHADMO C[C@@H](c1ccccn1)[N@H+]1Cc2ccccc2[C@@H]1C ZINC000334188892 352778957 /nfs/dbraw/zinc/77/89/57/352778957.db2.gz HJVCAEIFSQEMJZ-STQMWFEESA-N 1 1 238.334 3.719 20 0 BHADMO C[C@@H](c1ccccn1)[N@@H+]1Cc2ccccc2[C@@H]1C ZINC000334188892 352778953 /nfs/dbraw/zinc/77/89/53/352778953.db2.gz HJVCAEIFSQEMJZ-STQMWFEESA-N 1 1 238.334 3.719 20 0 BHADMO CC[C@]1(C)CCC[N@H+]([C@@H](C)c2ncc(C)o2)C1 ZINC000334220185 352821869 /nfs/dbraw/zinc/82/18/69/352821869.db2.gz GPPRQQWGDDYOMY-GXTWGEPZSA-N 1 1 236.359 3.556 20 0 BHADMO CC[C@@]1(C)CCC[N@H+]([C@@H](C)c2ncc(C)o2)C1 ZINC000334220186 352821980 /nfs/dbraw/zinc/82/19/80/352821980.db2.gz GPPRQQWGDDYOMY-JSGCOSHPSA-N 1 1 236.359 3.556 20 0 BHADMO CC[C@@]1(C)CCC[N@H+]([C@H](C)c2ncc(C)o2)C1 ZINC000334220187 352821926 /nfs/dbraw/zinc/82/19/26/352821926.db2.gz GPPRQQWGDDYOMY-OCCSQVGLSA-N 1 1 236.359 3.556 20 0 BHADMO CC[C@]1(C)CCC[N@H+]([C@H](C)c2ncc(C)o2)C1 ZINC000334220189 352822077 /nfs/dbraw/zinc/82/20/77/352822077.db2.gz GPPRQQWGDDYOMY-TZMCWYRMSA-N 1 1 236.359 3.556 20 0 BHADMO Cc1occc1C[NH2+][C@@H]1CSc2ccccc21 ZINC000334257970 352869102 /nfs/dbraw/zinc/86/91/02/352869102.db2.gz QZGGFSPJDACSNS-CYBMUJFWSA-N 1 1 245.347 3.525 20 0 BHADMO Cc1occc1C[NH2+][C@H]1CSc2ccccc21 ZINC000334257971 352868729 /nfs/dbraw/zinc/86/87/29/352868729.db2.gz QZGGFSPJDACSNS-ZDUSSCGKSA-N 1 1 245.347 3.525 20 0 BHADMO Cc1ncsc1C[N@H+]1Cc2ccccc2[C@H]1C ZINC000334263265 352897103 /nfs/dbraw/zinc/89/71/03/352897103.db2.gz JKLNVFXUIIDMDL-LLVKDONJSA-N 1 1 244.363 3.528 20 0 BHADMO Cc1ncsc1C[N@@H+]1Cc2ccccc2[C@H]1C ZINC000334263265 352897102 /nfs/dbraw/zinc/89/71/02/352897102.db2.gz JKLNVFXUIIDMDL-LLVKDONJSA-N 1 1 244.363 3.528 20 0 BHADMO Cc1ncsc1C[N@H+]1Cc2ccccc2[C@@H]1C ZINC000334263271 352897340 /nfs/dbraw/zinc/89/73/40/352897340.db2.gz JKLNVFXUIIDMDL-NSHDSACASA-N 1 1 244.363 3.528 20 0 BHADMO Cc1ncsc1C[N@@H+]1Cc2ccccc2[C@@H]1C ZINC000334263271 352897337 /nfs/dbraw/zinc/89/73/37/352897337.db2.gz JKLNVFXUIIDMDL-NSHDSACASA-N 1 1 244.363 3.528 20 0 BHADMO C[C@H](c1cccnc1)[N@H+]1Cc2ccccc2[C@H]1C ZINC000334278036 135333189 /nfs/dbraw/zinc/33/31/89/135333189.db2.gz TZQGESJNSRWYNS-CHWSQXEVSA-N 1 1 238.334 3.719 20 0 BHADMO C[C@H](c1cccnc1)[N@@H+]1Cc2ccccc2[C@H]1C ZINC000334278036 135333187 /nfs/dbraw/zinc/33/31/87/135333187.db2.gz TZQGESJNSRWYNS-CHWSQXEVSA-N 1 1 238.334 3.719 20 0 BHADMO C[C@H](c1cccnc1)[N@H+]1Cc2ccccc2[C@@H]1C ZINC000334278039 135333214 /nfs/dbraw/zinc/33/32/14/135333214.db2.gz TZQGESJNSRWYNS-OLZOCXBDSA-N 1 1 238.334 3.719 20 0 BHADMO C[C@H](c1cccnc1)[N@@H+]1Cc2ccccc2[C@@H]1C ZINC000334278039 135333213 /nfs/dbraw/zinc/33/32/13/135333213.db2.gz TZQGESJNSRWYNS-OLZOCXBDSA-N 1 1 238.334 3.719 20 0 BHADMO C[C@@H](c1cccnc1)[N@H+]1Cc2ccccc2[C@H]1C ZINC000334278041 135333245 /nfs/dbraw/zinc/33/32/45/135333245.db2.gz TZQGESJNSRWYNS-QWHCGFSZSA-N 1 1 238.334 3.719 20 0 BHADMO C[C@@H](c1cccnc1)[N@@H+]1Cc2ccccc2[C@H]1C ZINC000334278041 135333244 /nfs/dbraw/zinc/33/32/44/135333244.db2.gz TZQGESJNSRWYNS-QWHCGFSZSA-N 1 1 238.334 3.719 20 0 BHADMO C[C@@H](c1cccnc1)[N@H+]1Cc2ccccc2[C@@H]1C ZINC000334278044 135333090 /nfs/dbraw/zinc/33/30/90/135333090.db2.gz TZQGESJNSRWYNS-STQMWFEESA-N 1 1 238.334 3.719 20 0 BHADMO C[C@@H](c1cccnc1)[N@@H+]1Cc2ccccc2[C@@H]1C ZINC000334278044 135333089 /nfs/dbraw/zinc/33/30/89/135333089.db2.gz TZQGESJNSRWYNS-STQMWFEESA-N 1 1 238.334 3.719 20 0 BHADMO Cc1cnc([C@H](C)[N@H+]2CC[C@H](C)C3(CCC3)C2)o1 ZINC000334442784 386062679 /nfs/dbraw/zinc/06/26/79/386062679.db2.gz CQGVJJLBVUSMMY-AAEUAGOBSA-N 1 1 248.370 3.556 20 0 BHADMO Cc1cnc([C@@H](C)[N@H+]2CC[C@@H](C)C3(CCC3)C2)o1 ZINC000334442786 386062692 /nfs/dbraw/zinc/06/26/92/386062692.db2.gz CQGVJJLBVUSMMY-DGCLKSJQSA-N 1 1 248.370 3.556 20 0 BHADMO Cc1cnc([C@@H](C)[N@H+]2CC[C@H](C)C3(CCC3)C2)o1 ZINC000334442789 386063672 /nfs/dbraw/zinc/06/36/72/386063672.db2.gz CQGVJJLBVUSMMY-WCQYABFASA-N 1 1 248.370 3.556 20 0 BHADMO Cc1cnc([C@H](C)[N@H+]2CC[C@@H](C)C3(CCC3)C2)o1 ZINC000334442792 386062957 /nfs/dbraw/zinc/06/29/57/386062957.db2.gz CQGVJJLBVUSMMY-YPMHNXCESA-N 1 1 248.370 3.556 20 0 BHADMO c1nc(C2CCC2)sc1C[N@H+]1CCC12CCC2 ZINC000334483234 386324131 /nfs/dbraw/zinc/32/41/31/386324131.db2.gz XYFYCVRZYIYHBR-UHFFFAOYSA-N 1 1 248.395 3.539 20 0 BHADMO C[C@@H](c1ccccn1)[N@H+]1CC[C@H]1c1ccccc1 ZINC000334552165 353993386 /nfs/dbraw/zinc/99/33/86/353993386.db2.gz SKFFYKUSBKRHKR-BBRMVZONSA-N 1 1 238.334 3.590 20 0 BHADMO C[C@H](c1ccccn1)[N@H+]1CC[C@H]1c1ccccc1 ZINC000334552166 353993424 /nfs/dbraw/zinc/99/34/24/353993424.db2.gz SKFFYKUSBKRHKR-CJNGLKHVSA-N 1 1 238.334 3.590 20 0 BHADMO C[C@H](c1ccccn1)[N@H+]1CC[C@@H]1c1ccccc1 ZINC000334552167 353993623 /nfs/dbraw/zinc/99/36/23/353993623.db2.gz SKFFYKUSBKRHKR-CZUORRHYSA-N 1 1 238.334 3.590 20 0 BHADMO C[C@@H](c1ccccn1)[N@H+]1CC[C@@H]1c1ccccc1 ZINC000334552168 353993119 /nfs/dbraw/zinc/99/31/19/353993119.db2.gz SKFFYKUSBKRHKR-XJKSGUPXSA-N 1 1 238.334 3.590 20 0 BHADMO C[C@@H]1c2ccccc2C[N@@H+]1CCC(F)(F)F ZINC000334603277 354283468 /nfs/dbraw/zinc/28/34/68/354283468.db2.gz MGHHAMXVWRSBOY-SECBINFHSA-N 1 1 229.245 3.516 20 0 BHADMO C[C@@H]1c2ccccc2C[N@H+]1CCC(F)(F)F ZINC000334603277 354283466 /nfs/dbraw/zinc/28/34/66/354283466.db2.gz MGHHAMXVWRSBOY-SECBINFHSA-N 1 1 229.245 3.516 20 0 BHADMO C[C@H]1c2ccccc2C[N@@H+]1CCC(F)(F)F ZINC000334603293 354283313 /nfs/dbraw/zinc/28/33/13/354283313.db2.gz MGHHAMXVWRSBOY-VIFPVBQESA-N 1 1 229.245 3.516 20 0 BHADMO C[C@H]1c2ccccc2C[N@H+]1CCC(F)(F)F ZINC000334603293 354283310 /nfs/dbraw/zinc/28/33/10/354283310.db2.gz MGHHAMXVWRSBOY-VIFPVBQESA-N 1 1 229.245 3.516 20 0 BHADMO c1sc(C[N@H+]2CCCC23CCC3)nc1C1CC1 ZINC000335243919 355181161 /nfs/dbraw/zinc/18/11/61/355181161.db2.gz XQFJVSACXRABST-UHFFFAOYSA-N 1 1 248.395 3.539 20 0 BHADMO c1sc(C2CC2)nc1C[N@H+]1CCCC12CCC2 ZINC000335335271 136055471 /nfs/dbraw/zinc/05/54/71/136055471.db2.gz AHBNQHLLNKUNFY-UHFFFAOYSA-N 1 1 248.395 3.539 20 0 BHADMO c1nc(C2CC2)c(C[N@H+]2CCCC23CCC3)s1 ZINC000335411622 636123824 /nfs/dbraw/zinc/12/38/24/636123824.db2.gz GCEOZKDKAIIVMI-UHFFFAOYSA-N 1 1 248.395 3.539 20 0 BHADMO Cc1cnc([C@H](C)[N@H+]2CC[C@@H](C3CCCC3)C2)o1 ZINC000335501520 386630219 /nfs/dbraw/zinc/63/02/19/386630219.db2.gz CNPQRKFOXXYADW-GXTWGEPZSA-N 1 1 248.370 3.556 20 0 BHADMO Cc1cnc([C@H](C)[N@H+]2CC[C@H](C3CCCC3)C2)o1 ZINC000335501521 386630699 /nfs/dbraw/zinc/63/06/99/386630699.db2.gz CNPQRKFOXXYADW-JSGCOSHPSA-N 1 1 248.370 3.556 20 0 BHADMO Cc1cnc([C@@H](C)[N@H+]2CC[C@H](C3CCCC3)C2)o1 ZINC000335501522 386630053 /nfs/dbraw/zinc/63/00/53/386630053.db2.gz CNPQRKFOXXYADW-OCCSQVGLSA-N 1 1 248.370 3.556 20 0 BHADMO Cc1cnc([C@@H](C)[N@H+]2CC[C@@H](C3CCCC3)C2)o1 ZINC000335501523 386630245 /nfs/dbraw/zinc/63/02/45/386630245.db2.gz CNPQRKFOXXYADW-TZMCWYRMSA-N 1 1 248.370 3.556 20 0 BHADMO O=C1CCC(C[N@H+]2CCCC23CCCCC3)CC1 ZINC000335576752 136110975 /nfs/dbraw/zinc/11/09/75/136110975.db2.gz LQXISOJPAJLBQG-UHFFFAOYSA-N 1 1 249.398 3.544 20 0 BHADMO Cc1ncc(C[N@H+]2Cc3ccccc3[C@@H]2C)s1 ZINC000335679753 136320051 /nfs/dbraw/zinc/32/00/51/136320051.db2.gz PFYLMWCCUASHQE-JTQLQIEISA-N 1 1 244.363 3.528 20 0 BHADMO Cc1ncc(C[N@@H+]2Cc3ccccc3[C@@H]2C)s1 ZINC000335679753 136320050 /nfs/dbraw/zinc/32/00/50/136320050.db2.gz PFYLMWCCUASHQE-JTQLQIEISA-N 1 1 244.363 3.528 20 0 BHADMO Cc1ncc(C[N@H+]2Cc3ccccc3[C@H]2C)s1 ZINC000335679754 136319705 /nfs/dbraw/zinc/31/97/05/136319705.db2.gz PFYLMWCCUASHQE-SNVBAGLBSA-N 1 1 244.363 3.528 20 0 BHADMO Cc1ncc(C[N@@H+]2Cc3ccccc3[C@H]2C)s1 ZINC000335679754 136319704 /nfs/dbraw/zinc/31/97/04/136319704.db2.gz PFYLMWCCUASHQE-SNVBAGLBSA-N 1 1 244.363 3.528 20 0 BHADMO Cc1cc[nH+]c(N[C@@H](C)c2ccc(Cl)cn2)c1 ZINC000335754635 386881280 /nfs/dbraw/zinc/88/12/80/386881280.db2.gz DEITXVACBTUICN-JTQLQIEISA-N 1 1 247.729 3.612 20 0 BHADMO Cc1cc[nH+]c(N[C@H](C)c2ccc(Cl)cn2)c1 ZINC000335754642 386880944 /nfs/dbraw/zinc/88/09/44/386880944.db2.gz DEITXVACBTUICN-SNVBAGLBSA-N 1 1 247.729 3.612 20 0 BHADMO Cc1nc(C[N@H+]2CCCC23CCCCC3)oc1C ZINC000335798398 355456555 /nfs/dbraw/zinc/45/65/55/355456555.db2.gz SPKZFBDMGHCIEW-UHFFFAOYSA-N 1 1 248.370 3.590 20 0 BHADMO C[C@@H](c1cccnc1)[N@H+]1CC[C@H]1c1ccccc1 ZINC000336086776 134076865 /nfs/dbraw/zinc/07/68/65/134076865.db2.gz ZEQXPSJSDWZEQY-BBRMVZONSA-N 1 1 238.334 3.590 20 0 BHADMO C[C@H](c1cccnc1)[N@H+]1CC[C@H]1c1ccccc1 ZINC000336086777 134077161 /nfs/dbraw/zinc/07/71/61/134077161.db2.gz ZEQXPSJSDWZEQY-CJNGLKHVSA-N 1 1 238.334 3.590 20 0 BHADMO C[C@H](c1cccnc1)[N@H+]1CC[C@@H]1c1ccccc1 ZINC000336086778 134077179 /nfs/dbraw/zinc/07/71/79/134077179.db2.gz ZEQXPSJSDWZEQY-CZUORRHYSA-N 1 1 238.334 3.590 20 0 BHADMO C[C@@H](c1cccnc1)[N@H+]1CC[C@@H]1c1ccccc1 ZINC000336086779 134077108 /nfs/dbraw/zinc/07/71/08/134077108.db2.gz ZEQXPSJSDWZEQY-XJKSGUPXSA-N 1 1 238.334 3.590 20 0 BHADMO Cc1nc(C(C)C)oc1C[N@H+]1CCCC12CCC2 ZINC000336124897 134092486 /nfs/dbraw/zinc/09/24/86/134092486.db2.gz GQMLIXQTBUSVRJ-UHFFFAOYSA-N 1 1 248.370 3.625 20 0 BHADMO Cc1cnc([C@@H](C)[N@H+]2CCCC3(CCCC3)C2)o1 ZINC000336181362 134119844 /nfs/dbraw/zinc/11/98/44/134119844.db2.gz YMMGXYGHSCNHGF-CYBMUJFWSA-N 1 1 248.370 3.700 20 0 BHADMO Cc1cnc([C@H](C)[N@H+]2CCCC3(CCCC3)C2)o1 ZINC000336181363 134120039 /nfs/dbraw/zinc/12/00/39/134120039.db2.gz YMMGXYGHSCNHGF-ZDUSSCGKSA-N 1 1 248.370 3.700 20 0 BHADMO C[C@H]1c2ccccc2C[N@@H+]1CC1CC(F)(F)C1 ZINC000336199592 134128450 /nfs/dbraw/zinc/12/84/50/134128450.db2.gz MJAXSCDYRNZQEK-JTQLQIEISA-N 1 1 237.293 3.609 20 0 BHADMO C[C@@H]1c2ccccc2C[N@@H+]1CC1CC(F)(F)C1 ZINC000336199593 134128360 /nfs/dbraw/zinc/12/83/60/134128360.db2.gz MJAXSCDYRNZQEK-SNVBAGLBSA-N 1 1 237.293 3.609 20 0 BHADMO Cc1cnc([C@@H](C)[N@H+]2CCC3(C2)CCCCC3)o1 ZINC000336352336 385148512 /nfs/dbraw/zinc/14/85/12/385148512.db2.gz ITODSKPXZZMNMT-CYBMUJFWSA-N 1 1 248.370 3.700 20 0 BHADMO Cc1cnc([C@H](C)[N@H+]2CCC3(C2)CCCCC3)o1 ZINC000336352338 385148284 /nfs/dbraw/zinc/14/82/84/385148284.db2.gz ITODSKPXZZMNMT-ZDUSSCGKSA-N 1 1 248.370 3.700 20 0 BHADMO Cc1cnc([C@@H](C)[N@@H+]2CC=C(C(C)(C)C)CC2)o1 ZINC000336572338 387395553 /nfs/dbraw/zinc/39/55/53/387395553.db2.gz JKILUXWGVHJLEV-GFCCVEGCSA-N 1 1 248.370 3.722 20 0 BHADMO Cc1cnc([C@@H](C)[N@H+]2CC=C(C(C)(C)C)CC2)o1 ZINC000336572338 387395548 /nfs/dbraw/zinc/39/55/48/387395548.db2.gz JKILUXWGVHJLEV-GFCCVEGCSA-N 1 1 248.370 3.722 20 0 BHADMO Cc1cnc([C@H](C)[N@@H+]2CC=C(C(C)(C)C)CC2)o1 ZINC000336572339 387395468 /nfs/dbraw/zinc/39/54/68/387395468.db2.gz JKILUXWGVHJLEV-LBPRGKRZSA-N 1 1 248.370 3.722 20 0 BHADMO Cc1cnc([C@H](C)[N@H+]2CC=C(C(C)(C)C)CC2)o1 ZINC000336572339 387395464 /nfs/dbraw/zinc/39/54/64/387395464.db2.gz JKILUXWGVHJLEV-LBPRGKRZSA-N 1 1 248.370 3.722 20 0 BHADMO CCSCC[N@@H+](Cc1cccs1)C(C)C ZINC000336645808 386254290 /nfs/dbraw/zinc/25/42/90/386254290.db2.gz JADQJGOYCMLWGK-UHFFFAOYSA-N 1 1 243.441 3.712 20 0 BHADMO CSCCC[N@@H+](Cc1cccs1)C(C)C ZINC000336646012 386254932 /nfs/dbraw/zinc/25/49/32/386254932.db2.gz JQEQJGSXUDCTCH-UHFFFAOYSA-N 1 1 243.441 3.712 20 0 BHADMO CC[N@@H+](Cc1nc(C)sc1C)CC(C)(C)C ZINC000336648087 169934754 /nfs/dbraw/zinc/93/47/54/169934754.db2.gz GAXAKGCJSSCHST-UHFFFAOYSA-N 1 1 240.416 3.628 20 0 BHADMO CC[N@@H+](Cc1ccsc1Cl)C(C)C ZINC000336650544 350574747 /nfs/dbraw/zinc/57/47/47/350574747.db2.gz IOAJDVOWLIZLLG-UHFFFAOYSA-N 1 1 217.765 3.632 20 0 BHADMO CC[C@@H](C)C[N@@H+](Cc1ccco1)C(C)C ZINC000336653861 386271777 /nfs/dbraw/zinc/27/17/77/386271777.db2.gz YXFXHOFEEVBXDH-GFCCVEGCSA-N 1 1 209.333 3.536 20 0 BHADMO CC[C@H](C)C[N@@H+](Cc1ccco1)C(C)C ZINC000336653862 171279269 /nfs/dbraw/zinc/27/92/69/171279269.db2.gz YXFXHOFEEVBXDH-LBPRGKRZSA-N 1 1 209.333 3.536 20 0 BHADMO CC[N@@H+](Cc1sc(C)nc1C)CC(C)(C)C ZINC000336653976 350420784 /nfs/dbraw/zinc/42/07/84/350420784.db2.gz JTDXNJOJQFSRJS-UHFFFAOYSA-N 1 1 240.416 3.628 20 0 BHADMO CCC[N@@H+](CC)Cc1ccsc1Cl ZINC000336656473 169129587 /nfs/dbraw/zinc/12/95/87/169129587.db2.gz QLHHCDSQXUPBHH-UHFFFAOYSA-N 1 1 217.765 3.633 20 0 BHADMO CCC[N@H+](Cc1sc(C)nc1C)CC(C)C ZINC000336656501 169181523 /nfs/dbraw/zinc/18/15/23/169181523.db2.gz LIUZXAHERWGFLY-UHFFFAOYSA-N 1 1 240.416 3.628 20 0 BHADMO CC(C)SCC[N@@H+](C)[C@H](C)c1cccs1 ZINC000336656975 167323065 /nfs/dbraw/zinc/32/30/65/167323065.db2.gz AODFYFJYNFGEBA-LLVKDONJSA-N 1 1 243.441 3.883 20 0 BHADMO CC(C)SCC[N@@H+](C)[C@@H](C)c1cccs1 ZINC000336656980 167323313 /nfs/dbraw/zinc/32/33/13/167323313.db2.gz AODFYFJYNFGEBA-NSHDSACASA-N 1 1 243.441 3.883 20 0 BHADMO Cc1[nH+]cn(C[C@@H](C)C2CCCCC2)c1C ZINC000336658917 180287316 /nfs/dbraw/zinc/28/73/16/180287316.db2.gz OZDQNFFOHOWULG-LLVKDONJSA-N 1 1 220.360 3.716 20 0 BHADMO Cc1[nH+]cn(C[C@H](C)C2CCCCC2)c1C ZINC000336658926 180288090 /nfs/dbraw/zinc/28/80/90/180288090.db2.gz OZDQNFFOHOWULG-NSHDSACASA-N 1 1 220.360 3.716 20 0 BHADMO CCC[N@H+](Cc1nc(C)sc1C)CC(C)C ZINC000336659130 169181916 /nfs/dbraw/zinc/18/19/16/169181916.db2.gz MTNCHJFWOZNKDS-UHFFFAOYSA-N 1 1 240.416 3.628 20 0 BHADMO Cc1ncc(C[N@H+](C)C2CCCCCC2)s1 ZINC000336662865 180137043 /nfs/dbraw/zinc/13/70/43/180137043.db2.gz CWORNHIXDWITRM-UHFFFAOYSA-N 1 1 238.400 3.606 20 0 BHADMO CC(C)SCC[N@H+]1Cc2ccccc2[C@H]1C ZINC000336662925 167329369 /nfs/dbraw/zinc/32/93/69/167329369.db2.gz ACUJUCXRGNWRQI-GFCCVEGCSA-N 1 1 235.396 3.705 20 0 BHADMO CC(C)SCC[N@H+]1Cc2ccccc2[C@@H]1C ZINC000336662964 167328934 /nfs/dbraw/zinc/32/89/34/167328934.db2.gz ACUJUCXRGNWRQI-LBPRGKRZSA-N 1 1 235.396 3.705 20 0 BHADMO COC(C)(C)CC[N@@H+](C)[C@H](C)c1cccs1 ZINC000336663089 386283231 /nfs/dbraw/zinc/28/32/31/386283231.db2.gz DYWRNKUQHCLSLF-LLVKDONJSA-N 1 1 241.400 3.556 20 0 BHADMO COC(C)(C)CC[N@@H+](C)[C@@H](C)c1cccs1 ZINC000336663139 173936800 /nfs/dbraw/zinc/93/68/00/173936800.db2.gz DYWRNKUQHCLSLF-NSHDSACASA-N 1 1 241.400 3.556 20 0 BHADMO CC(C)SCC[N@H+]1CC[C@H]1c1ccccc1 ZINC000336663469 167325917 /nfs/dbraw/zinc/32/59/17/167325917.db2.gz CQSBWJYPHNJDNX-AWEZNQCLSA-N 1 1 235.396 3.575 20 0 BHADMO CC(C)SCC[N@H+]1CC[C@@H]1c1ccccc1 ZINC000336663478 167327094 /nfs/dbraw/zinc/32/70/94/167327094.db2.gz CQSBWJYPHNJDNX-CQSZACIVSA-N 1 1 235.396 3.575 20 0 BHADMO CCC[N@H+](Cc1nc(C)c(C)s1)CC(C)C ZINC000336665378 169181451 /nfs/dbraw/zinc/18/14/51/169181451.db2.gz PMFXSQVXNDZQRQ-UHFFFAOYSA-N 1 1 240.416 3.628 20 0 BHADMO CC(C)SCC[N@@H+](Cc1ccco1)C(C)C ZINC000336666852 167323474 /nfs/dbraw/zinc/32/34/74/167323474.db2.gz MGXWFMWJEMQHIT-UHFFFAOYSA-N 1 1 241.400 3.632 20 0 BHADMO Cc1ccccc1C[N@H+](C)CCSC(C)C ZINC000336666951 179270361 /nfs/dbraw/zinc/27/03/61/179270361.db2.gz NYTXPVMAAOOYLN-UHFFFAOYSA-N 1 1 237.412 3.568 20 0 BHADMO C[C@H](c1ccco1)[N@@H+](CCC1CC1)C1CC1 ZINC000336667642 177047277 /nfs/dbraw/zinc/04/72/77/177047277.db2.gz MLVHQVOXDMMNPS-LLVKDONJSA-N 1 1 219.328 3.605 20 0 BHADMO C[C@@H](c1ccco1)[N@@H+](CCC1CC1)C1CC1 ZINC000336667644 176031135 /nfs/dbraw/zinc/03/11/35/176031135.db2.gz MLVHQVOXDMMNPS-NSHDSACASA-N 1 1 219.328 3.605 20 0 BHADMO c1ccc([C@@H]2CCC[N@@H+]2CCC2CC2)cc1 ZINC000336669725 386312953 /nfs/dbraw/zinc/31/29/53/386312953.db2.gz VIMCLGPWWJVVTK-HNNXBMFYSA-N 1 1 215.340 3.624 20 0 BHADMO c1ccc([C@H]2CCC[N@@H+]2CCC2CC2)cc1 ZINC000336669758 386313211 /nfs/dbraw/zinc/31/32/11/386313211.db2.gz VIMCLGPWWJVVTK-OAHLLOKOSA-N 1 1 215.340 3.624 20 0 BHADMO CC[C@H](C)C[N@@H+](C)Cc1ccc(C)s1 ZINC000336670384 171274705 /nfs/dbraw/zinc/27/47/05/171274705.db2.gz GKFXSKIMBJQGJS-JTQLQIEISA-N 1 1 211.374 3.534 20 0 BHADMO CC[C@@H](C)C[N@@H+](C)Cc1ccc(C)s1 ZINC000336670386 386315448 /nfs/dbraw/zinc/31/54/48/386315448.db2.gz GKFXSKIMBJQGJS-SNVBAGLBSA-N 1 1 211.374 3.534 20 0 BHADMO Cc1nc(C)c([C@H](C)[N@@H+](C)CCC2CC2)s1 ZINC000336670850 386315060 /nfs/dbraw/zinc/31/50/60/386315060.db2.gz YBGJQEDUTBGURJ-JTQLQIEISA-N 1 1 238.400 3.553 20 0 BHADMO Cc1nc(C)c([C@@H](C)[N@@H+](C)CCC2CC2)s1 ZINC000336670851 386315929 /nfs/dbraw/zinc/31/59/29/386315929.db2.gz YBGJQEDUTBGURJ-SNVBAGLBSA-N 1 1 238.400 3.553 20 0 BHADMO CC[N@@H+](Cc1nc(C)sc1C)[C@@H](C)C(C)C ZINC000336671146 350435240 /nfs/dbraw/zinc/43/52/40/350435240.db2.gz JCOLTFSEBWIKHT-JTQLQIEISA-N 1 1 240.416 3.626 20 0 BHADMO CC[N@@H+](Cc1nc(C)sc1C)[C@H](C)C(C)C ZINC000336671147 350435029 /nfs/dbraw/zinc/43/50/29/350435029.db2.gz JCOLTFSEBWIKHT-SNVBAGLBSA-N 1 1 240.416 3.626 20 0 BHADMO Cc1occc1C[N@H+](C)C1CCCCCC1 ZINC000336671176 386318260 /nfs/dbraw/zinc/31/82/60/386318260.db2.gz JFJXTTNLVZFGNY-UHFFFAOYSA-N 1 1 221.344 3.743 20 0 BHADMO CCC1CC(Nc2cc(C3CC3)cc[nH+]2)C1 ZINC000336671597 386818894 /nfs/dbraw/zinc/81/88/94/386818894.db2.gz AOPSAGBJYPGICB-UHFFFAOYSA-N 1 1 216.328 3.560 20 0 BHADMO CCCC[C@@H](C)Nc1cc(C2CC2)cc[nH+]1 ZINC000336673222 350869613 /nfs/dbraw/zinc/86/96/13/350869613.db2.gz AZLKZSGVQNYWBN-LLVKDONJSA-N 1 1 218.344 3.950 20 0 BHADMO CCCC[C@H](C)Nc1cc(C2CC2)cc[nH+]1 ZINC000336673225 350870005 /nfs/dbraw/zinc/87/00/05/350870005.db2.gz AZLKZSGVQNYWBN-NSHDSACASA-N 1 1 218.344 3.950 20 0 BHADMO CCC(C)(C)[N@@H+](C)Cc1csc(C2CC2)n1 ZINC000336673286 168287717 /nfs/dbraw/zinc/28/77/17/168287717.db2.gz KORXTZUIACJQOP-UHFFFAOYSA-N 1 1 238.400 3.641 20 0 BHADMO C[C@@H](c1cccs1)[N@@H+](C)CCC1CC1 ZINC000336676150 176032959 /nfs/dbraw/zinc/03/29/59/176032959.db2.gz CHGSHSLLSGZCID-JTQLQIEISA-N 1 1 209.358 3.541 20 0 BHADMO C[C@H](c1cccs1)[N@@H+](C)CCC1CC1 ZINC000336676151 177048954 /nfs/dbraw/zinc/04/89/54/177048954.db2.gz CHGSHSLLSGZCID-SNVBAGLBSA-N 1 1 209.358 3.541 20 0 BHADMO CC[N@@H+](Cc1nc(C)c(C)s1)CC(C)(C)C ZINC000336677237 350438708 /nfs/dbraw/zinc/43/87/08/350438708.db2.gz WBIDEQPTFZEJNC-UHFFFAOYSA-N 1 1 240.416 3.628 20 0 BHADMO CCC[C@H](C)[N@@H+](C)Cc1csc(C2CC2)n1 ZINC000336677312 386327759 /nfs/dbraw/zinc/32/77/59/386327759.db2.gz NPXFYIZRKJZECT-JTQLQIEISA-N 1 1 238.400 3.641 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)Cc1csc(C2CC2)n1 ZINC000336677313 169365323 /nfs/dbraw/zinc/36/53/23/169365323.db2.gz NPXFYIZRKJZECT-SNVBAGLBSA-N 1 1 238.400 3.641 20 0 BHADMO CC(C)(C)CCNc1cc(C2CC2)cc[nH+]1 ZINC000336680230 385629335 /nfs/dbraw/zinc/62/93/35/385629335.db2.gz REIDRPXQOYAVLR-UHFFFAOYSA-N 1 1 218.344 3.807 20 0 BHADMO Cc1nc(C[N@H+](CC(C)C)C(C)C)c(C)s1 ZINC000336682275 386339743 /nfs/dbraw/zinc/33/97/43/386339743.db2.gz RFRYZZDKZBLMPF-UHFFFAOYSA-N 1 1 240.416 3.626 20 0 BHADMO CC[C@H](C)C[N@@H+](CC)Cc1nc(C)sc1C ZINC000336689677 171278281 /nfs/dbraw/zinc/27/82/81/171278281.db2.gz ZWARMXTZQAHOIE-JTQLQIEISA-N 1 1 240.416 3.628 20 0 BHADMO CC[C@@H](C)C[N@@H+](CC)Cc1nc(C)sc1C ZINC000336689858 386354426 /nfs/dbraw/zinc/35/44/26/386354426.db2.gz ZWARMXTZQAHOIE-SNVBAGLBSA-N 1 1 240.416 3.628 20 0 BHADMO Cc1nc(C[N@H+](C)C2CCCCC2)c(C)s1 ZINC000336690262 386371006 /nfs/dbraw/zinc/37/10/06/386371006.db2.gz APZUCQSWXQBTLY-UHFFFAOYSA-N 1 1 238.400 3.524 20 0 BHADMO CC[C@@H]1CCCC[N@H+]1Cc1nc(C)sc1C ZINC000336691472 350448022 /nfs/dbraw/zinc/44/80/22/350448022.db2.gz BLFBEEFWUSVKGM-GFCCVEGCSA-N 1 1 238.400 3.524 20 0 BHADMO CC[C@H]1CCCC[N@H+]1Cc1nc(C)sc1C ZINC000336691475 386360554 /nfs/dbraw/zinc/36/05/54/386360554.db2.gz BLFBEEFWUSVKGM-LBPRGKRZSA-N 1 1 238.400 3.524 20 0 BHADMO C[C@@H](c1ccccc1)[N@@H+](C)C[C@H]1CCC(C)(C)O1 ZINC000336692296 176020351 /nfs/dbraw/zinc/02/03/51/176020351.db2.gz DPAFKXBWGBELQQ-DZGCQCFKSA-N 1 1 247.382 3.637 20 0 BHADMO C[C@H](c1ccccc1)[N@@H+](C)C[C@@H]1CCC(C)(C)O1 ZINC000336692359 177039176 /nfs/dbraw/zinc/03/91/76/177039176.db2.gz DPAFKXBWGBELQQ-HIFRSBDPSA-N 1 1 247.382 3.637 20 0 BHADMO C[C@H](c1ccccc1)[N@@H+](C)C[C@H]1CCC(C)(C)O1 ZINC000336692361 177039445 /nfs/dbraw/zinc/03/94/45/177039445.db2.gz DPAFKXBWGBELQQ-UKRRQHHQSA-N 1 1 247.382 3.637 20 0 BHADMO C[C@@H](c1ccccc1)[N@@H+](C)C[C@@H]1CCC(C)(C)O1 ZINC000336692364 176020476 /nfs/dbraw/zinc/02/04/76/176020476.db2.gz DPAFKXBWGBELQQ-ZFWWWQNUSA-N 1 1 247.382 3.637 20 0 BHADMO CC(C)[N@@H+](CCC1CC1)Cc1cccs1 ZINC000336692884 386366241 /nfs/dbraw/zinc/36/62/41/386366241.db2.gz ANQIEUATVXOBMI-UHFFFAOYSA-N 1 1 223.385 3.759 20 0 BHADMO c1csc(C[N@H+](CCC2CC2)C2CC2)c1 ZINC000336693145 386366289 /nfs/dbraw/zinc/36/62/89/386366289.db2.gz BVDNAQZQQHMWTI-UHFFFAOYSA-N 1 1 221.369 3.513 20 0 BHADMO C[C@H]1c2ccccc2C[N@@H+]1C[C@H]1CCC(C)(C)O1 ZINC000336693352 386365421 /nfs/dbraw/zinc/36/54/21/386365421.db2.gz JFHKHUVGHKAHGO-GXTWGEPZSA-N 1 1 245.366 3.521 20 0 BHADMO C[C@H]1c2ccccc2C[N@@H+]1C[C@@H]1CCC(C)(C)O1 ZINC000336693366 386366961 /nfs/dbraw/zinc/36/69/61/386366961.db2.gz JFHKHUVGHKAHGO-JSGCOSHPSA-N 1 1 245.366 3.521 20 0 BHADMO C[C@@H]1c2ccccc2C[N@@H+]1C[C@@H]1CCC(C)(C)O1 ZINC000336693370 386366334 /nfs/dbraw/zinc/36/63/34/386366334.db2.gz JFHKHUVGHKAHGO-OCCSQVGLSA-N 1 1 245.366 3.521 20 0 BHADMO C[C@@H]1c2ccccc2C[N@@H+]1C[C@H]1CCC(C)(C)O1 ZINC000336693372 386365604 /nfs/dbraw/zinc/36/56/04/386365604.db2.gz JFHKHUVGHKAHGO-TZMCWYRMSA-N 1 1 245.366 3.521 20 0 BHADMO Cc1nc(C[N@H+](C(C)C)C2CCC2)c(C)s1 ZINC000336693426 386366180 /nfs/dbraw/zinc/36/61/80/386366180.db2.gz CVPUQXRRUKVOEC-UHFFFAOYSA-N 1 1 238.400 3.523 20 0 BHADMO CCCC[N@@H+](Cc1nc(C)sc1C)C1CC1 ZINC000336694971 386370165 /nfs/dbraw/zinc/37/01/65/386370165.db2.gz FLOAOXKBOYINFI-UHFFFAOYSA-N 1 1 238.400 3.524 20 0 BHADMO CC[N@@H+](Cc1nc(C)sc1C)C1CCCC1 ZINC000336696881 350451988 /nfs/dbraw/zinc/45/19/88/350451988.db2.gz HNEBKDKIVOEKSA-UHFFFAOYSA-N 1 1 238.400 3.524 20 0 BHADMO c1cc([C@H]2CCC[N@@H+]2CCC2CC2)cs1 ZINC000336697354 183364070 /nfs/dbraw/zinc/36/40/70/183364070.db2.gz OGYKUVLSOYLUAO-CYBMUJFWSA-N 1 1 221.369 3.685 20 0 BHADMO c1cc([C@@H]2CCC[N@@H+]2CCC2CC2)cs1 ZINC000336697548 183360929 /nfs/dbraw/zinc/36/09/29/183360929.db2.gz OGYKUVLSOYLUAO-ZDUSSCGKSA-N 1 1 221.369 3.685 20 0 BHADMO c1csc([C@H]2CCC[N@@H+]2CCC2CC2)c1 ZINC000336700020 386387237 /nfs/dbraw/zinc/38/72/37/386387237.db2.gz YHZYVXFORPVLJF-GFCCVEGCSA-N 1 1 221.369 3.685 20 0 BHADMO c1csc([C@@H]2CCC[N@@H+]2CCC2CC2)c1 ZINC000336700023 386387626 /nfs/dbraw/zinc/38/76/26/386387626.db2.gz YHZYVXFORPVLJF-LBPRGKRZSA-N 1 1 221.369 3.685 20 0 BHADMO CCCC[N@@H+](Cc1sc(C)nc1C)C1CC1 ZINC000336700850 386400983 /nfs/dbraw/zinc/40/09/83/386400983.db2.gz LJSVTOIPTRBHNN-UHFFFAOYSA-N 1 1 238.400 3.524 20 0 BHADMO CCC(CC)C[N@H+]1CCC[C@H]1c1cccnc1 ZINC000336702994 168353055 /nfs/dbraw/zinc/35/30/55/168353055.db2.gz BBMYYHIOSVQIMM-HNNXBMFYSA-N 1 1 232.371 3.655 20 0 BHADMO CCC(CC)C[N@H+]1CCC[C@@H]1c1cccnc1 ZINC000336702995 168349704 /nfs/dbraw/zinc/34/97/04/168349704.db2.gz BBMYYHIOSVQIMM-OAHLLOKOSA-N 1 1 232.371 3.655 20 0 BHADMO CCC(CC)C[N@@H+](CC)Cc1cccc(C)n1 ZINC000336703751 168350560 /nfs/dbraw/zinc/35/05/60/168350560.db2.gz BTTVHUBRKORMTR-UHFFFAOYSA-N 1 1 234.387 3.648 20 0 BHADMO Cc1nc(C)c(C[N@@H+]2CCCCC[C@@H]2C)s1 ZINC000336704336 386392075 /nfs/dbraw/zinc/39/20/75/386392075.db2.gz RXDKYXDRDSOARD-JTQLQIEISA-N 1 1 238.400 3.524 20 0 BHADMO Cc1nc(C)c(C[N@@H+]2CCCCC[C@H]2C)s1 ZINC000336704338 386392296 /nfs/dbraw/zinc/39/22/96/386392296.db2.gz RXDKYXDRDSOARD-SNVBAGLBSA-N 1 1 238.400 3.524 20 0 BHADMO Cc1nc(C[N@@H+]2CCCCC[C@@H]2C)c(C)s1 ZINC000336704369 386392281 /nfs/dbraw/zinc/39/22/81/386392281.db2.gz UYFJAJGJAPEMOV-JTQLQIEISA-N 1 1 238.400 3.524 20 0 BHADMO Cc1nc(C[N@@H+]2CCCCC[C@H]2C)c(C)s1 ZINC000336704370 386392790 /nfs/dbraw/zinc/39/27/90/386392790.db2.gz UYFJAJGJAPEMOV-SNVBAGLBSA-N 1 1 238.400 3.524 20 0 BHADMO CCC(CC)C[N@@H+](Cc1cccnc1)C(C)C ZINC000336704916 168350340 /nfs/dbraw/zinc/35/03/40/168350340.db2.gz DBLBTGVEXUPHBX-UHFFFAOYSA-N 1 1 234.387 3.728 20 0 BHADMO CC[N@@H+](CCC1CC1)[C@H](C)c1cccc(O)c1 ZINC000336705500 386395485 /nfs/dbraw/zinc/39/54/85/386395485.db2.gz AYVKVDQOVSCCGO-GFCCVEGCSA-N 1 1 233.355 3.575 20 0 BHADMO CC[N@@H+](CCC1CC1)[C@@H](C)c1cccc(O)c1 ZINC000336705502 386395035 /nfs/dbraw/zinc/39/50/35/386395035.db2.gz AYVKVDQOVSCCGO-LBPRGKRZSA-N 1 1 233.355 3.575 20 0 BHADMO CCCC[N@@H+](Cc1nc(C)c(C)s1)C1CC1 ZINC000336707176 386410277 /nfs/dbraw/zinc/41/02/77/386410277.db2.gz SDYBPGDVFJTYMJ-UHFFFAOYSA-N 1 1 238.400 3.524 20 0 BHADMO c1ccc([C@@H]2CSCC[N@@H+]2CCC2CC2)cc1 ZINC000336707268 386411554 /nfs/dbraw/zinc/41/15/54/386411554.db2.gz MMZUNIFRJXBYSA-HNNXBMFYSA-N 1 1 247.407 3.577 20 0 BHADMO c1ccc([C@H]2CSCC[N@@H+]2CCC2CC2)cc1 ZINC000336707429 386410446 /nfs/dbraw/zinc/41/04/46/386410446.db2.gz MMZUNIFRJXBYSA-OAHLLOKOSA-N 1 1 247.407 3.577 20 0 BHADMO FC(F)(F)CCNc1cc[nH+]c2ccsc21 ZINC000336708092 388466714 /nfs/dbraw/zinc/46/67/14/388466714.db2.gz QPQXWUAUMKGYJA-UHFFFAOYSA-N 1 1 246.257 3.661 20 0 BHADMO Cc1nc(C[N@@H+]2[C@H](C)CCC[C@@H]2C)c(C)s1 ZINC000336708503 386416018 /nfs/dbraw/zinc/41/60/18/386416018.db2.gz UWAMUBXJVTWORR-AOOOYVTPSA-N 1 1 238.400 3.523 20 0 BHADMO Cc1ccc(C[N@H+](C)CCSC(C)C)s1 ZINC000336708933 386419233 /nfs/dbraw/zinc/41/92/33/386419233.db2.gz SOEBAUAQANLDDJ-UHFFFAOYSA-N 1 1 243.441 3.630 20 0 BHADMO Cc1nc(C[N@H+](C(C)C)C2CCC2)sc1C ZINC000336710486 386426666 /nfs/dbraw/zinc/42/66/66/386426666.db2.gz ZEWNIPGHIOUODG-UHFFFAOYSA-N 1 1 238.400 3.523 20 0 BHADMO CCC(CC)C[N@H+]1CCC[C@@H]1c1cc(C)no1 ZINC000336710583 168351140 /nfs/dbraw/zinc/35/11/40/168351140.db2.gz LHOVSZPQQSGRBZ-CYBMUJFWSA-N 1 1 236.359 3.556 20 0 BHADMO CCC(CC)C[N@H+]1CCC[C@H]1c1cc(C)no1 ZINC000336710686 168351635 /nfs/dbraw/zinc/35/16/35/168351635.db2.gz LHOVSZPQQSGRBZ-ZDUSSCGKSA-N 1 1 236.359 3.556 20 0 BHADMO Cc1ccsc1C[N@H+](C)CCSC(C)C ZINC000336710972 386427769 /nfs/dbraw/zinc/42/77/69/386427769.db2.gz UBEKFMJGEYOLNN-UHFFFAOYSA-N 1 1 243.441 3.630 20 0 BHADMO CC[N@@H+](Cc1cccc(C)n1)C1CCCCC1 ZINC000336711603 350459310 /nfs/dbraw/zinc/45/93/10/350459310.db2.gz RKAHNCPAXUDTBC-UHFFFAOYSA-N 1 1 232.371 3.545 20 0 BHADMO Cc1cccc(C[N@H+](C)C2CCCCCC2)n1 ZINC000336712719 179064672 /nfs/dbraw/zinc/06/46/72/179064672.db2.gz OPKRAFAUOFJBQR-UHFFFAOYSA-N 1 1 232.371 3.545 20 0 BHADMO CC[N@@H+](CCSC(C)C)Cc1cccs1 ZINC000336713019 386429479 /nfs/dbraw/zinc/42/94/79/386429479.db2.gz VHYGHKIVZFGMEF-UHFFFAOYSA-N 1 1 243.441 3.712 20 0 BHADMO CC(C)SCC[N@@H+](C)[C@H]1CCc2ccccc21 ZINC000336716598 167323052 /nfs/dbraw/zinc/32/30/52/167323052.db2.gz UBYHAXGWTVCILO-HNNXBMFYSA-N 1 1 249.423 3.747 20 0 BHADMO CC(C)SCC[N@@H+](C)[C@@H]1CCc2ccccc21 ZINC000336716611 167323676 /nfs/dbraw/zinc/32/36/76/167323676.db2.gz UBYHAXGWTVCILO-OAHLLOKOSA-N 1 1 249.423 3.747 20 0 BHADMO CCC[C@H](C)Nc1cc(C2CC2)cc[nH+]1 ZINC000336721477 385911854 /nfs/dbraw/zinc/91/18/54/385911854.db2.gz DQSOWLXBUMRWRD-JTQLQIEISA-N 1 1 204.317 3.560 20 0 BHADMO CCC[C@@H](C)Nc1cc(C2CC2)cc[nH+]1 ZINC000336721479 169371730 /nfs/dbraw/zinc/37/17/30/169371730.db2.gz DQSOWLXBUMRWRD-SNVBAGLBSA-N 1 1 204.317 3.560 20 0 BHADMO CC[C@H]([NH2+]Cc1cscn1)c1cccc(C)c1 ZINC000336722926 386228930 /nfs/dbraw/zinc/22/89/30/386228930.db2.gz YMLSWVTYBGUNND-AWEZNQCLSA-N 1 1 246.379 3.692 20 0 BHADMO CC[C@@H]([NH2+]Cc1cscn1)c1cccc(C)c1 ZINC000336722934 351233485 /nfs/dbraw/zinc/23/34/85/351233485.db2.gz YMLSWVTYBGUNND-CQSZACIVSA-N 1 1 246.379 3.692 20 0 BHADMO CC(C)SCC[N@@H+](Cc1ccccc1)C1CC1 ZINC000336726382 167324323 /nfs/dbraw/zinc/32/43/23/167324323.db2.gz YSZWLSUKTQILEH-UHFFFAOYSA-N 1 1 249.423 3.793 20 0 BHADMO Cc1cccc(NC2CCC3(CC3)CC2)[nH+]1 ZINC000336729222 386102787 /nfs/dbraw/zinc/10/27/87/386102787.db2.gz HPNSZPORQIGTKW-UHFFFAOYSA-N 1 1 216.328 3.525 20 0 BHADMO CCC[C@@H](CC)Nc1cc(C2CC2)cc[nH+]1 ZINC000336735689 169380514 /nfs/dbraw/zinc/38/05/14/169380514.db2.gz LWMPFUTVWJJNHZ-CYBMUJFWSA-N 1 1 218.344 3.950 20 0 BHADMO CCC[C@H](CC)Nc1cc(C2CC2)cc[nH+]1 ZINC000336735690 385597558 /nfs/dbraw/zinc/59/75/58/385597558.db2.gz LWMPFUTVWJJNHZ-ZDUSSCGKSA-N 1 1 218.344 3.950 20 0 BHADMO CC1(C)CC(Nc2cc(C3CC3)cc[nH+]2)C1 ZINC000336735939 385721093 /nfs/dbraw/zinc/72/10/93/385721093.db2.gz IKCUJCZVUNXUKX-UHFFFAOYSA-N 1 1 216.328 3.560 20 0 BHADMO CC[C@@H](Nc1cc(C2CC2)cc[nH+]1)C1CC1 ZINC000336738464 352110273 /nfs/dbraw/zinc/11/02/73/352110273.db2.gz OHTBSMHSHUQBCP-CYBMUJFWSA-N 1 1 216.328 3.560 20 0 BHADMO CC[C@H](Nc1cc(C2CC2)cc[nH+]1)C1CC1 ZINC000336738466 385659409 /nfs/dbraw/zinc/65/94/09/385659409.db2.gz OHTBSMHSHUQBCP-ZDUSSCGKSA-N 1 1 216.328 3.560 20 0 BHADMO Cc1cc[nH+]c(NC2CCC3(CC3)CC2)c1 ZINC000336741205 188169553 /nfs/dbraw/zinc/16/95/53/188169553.db2.gz QXCBNMZJGCCZTN-UHFFFAOYSA-N 1 1 216.328 3.525 20 0 BHADMO Cc1cccc(NCc2ccsc2Cl)[nH+]1 ZINC000336741356 179150827 /nfs/dbraw/zinc/15/08/27/179150827.db2.gz VNAMMTNTQQYTRP-UHFFFAOYSA-N 1 1 238.743 3.717 20 0 BHADMO CC[C@@H]([NH2+][C@H](C)c1ccon1)c1cccs1 ZINC000336741812 352387787 /nfs/dbraw/zinc/38/77/87/352387787.db2.gz RKPIMGAPLICEMO-NXEZZACHSA-N 1 1 236.340 3.538 20 0 BHADMO CC[C@H]([NH2+][C@@H](C)c1ccon1)c1cccs1 ZINC000336741814 385911438 /nfs/dbraw/zinc/91/14/38/385911438.db2.gz RKPIMGAPLICEMO-UWVGGRQHSA-N 1 1 236.340 3.538 20 0 BHADMO CC[C@@H]([NH2+][C@@H](C)c1ccon1)c1cccs1 ZINC000336741816 352387706 /nfs/dbraw/zinc/38/77/06/352387706.db2.gz RKPIMGAPLICEMO-VHSXEESVSA-N 1 1 236.340 3.538 20 0 BHADMO CC[C@H]([NH2+][C@H](C)c1ccon1)c1cccs1 ZINC000336741817 385911949 /nfs/dbraw/zinc/91/19/49/385911949.db2.gz RKPIMGAPLICEMO-ZJUUUORDSA-N 1 1 236.340 3.538 20 0 BHADMO CC[C@@H](C)[C@@H](C)Nc1cc(C2CC2)cc[nH+]1 ZINC000336741830 385911265 /nfs/dbraw/zinc/91/12/65/385911265.db2.gz RKYDFYIWSFLIHH-GHMZBOCLSA-N 1 1 218.344 3.806 20 0 BHADMO CC[C@@H](C)[C@H](C)Nc1cc(C2CC2)cc[nH+]1 ZINC000336741832 385911945 /nfs/dbraw/zinc/91/19/45/385911945.db2.gz RKYDFYIWSFLIHH-MNOVXSKESA-N 1 1 218.344 3.806 20 0 BHADMO CC[C@H](C)[C@H](C)Nc1cc(C2CC2)cc[nH+]1 ZINC000336741833 171391652 /nfs/dbraw/zinc/39/16/52/171391652.db2.gz RKYDFYIWSFLIHH-QWRGUYRKSA-N 1 1 218.344 3.806 20 0 BHADMO CC[C@H](C)[C@@H](C)Nc1cc(C2CC2)cc[nH+]1 ZINC000336741835 171367481 /nfs/dbraw/zinc/36/74/81/171367481.db2.gz RKYDFYIWSFLIHH-WDEREUQCSA-N 1 1 218.344 3.806 20 0 BHADMO Cc1ccc[nH+]c1NCc1ccsc1Cl ZINC000336743164 179396061 /nfs/dbraw/zinc/39/60/61/179396061.db2.gz XTEJFFYIIKKGIM-UHFFFAOYSA-N 1 1 238.743 3.717 20 0 BHADMO CC[C@H](CC(F)(F)F)Nc1cc(C)cc[nH+]1 ZINC000336747745 188346987 /nfs/dbraw/zinc/34/69/87/188346987.db2.gz XOEXUYLDBCJAQR-SECBINFHSA-N 1 1 232.249 3.533 20 0 BHADMO CC[C@@H](CC(F)(F)F)Nc1cc(C)cc[nH+]1 ZINC000336747746 385980802 /nfs/dbraw/zinc/98/08/02/385980802.db2.gz XOEXUYLDBCJAQR-VIFPVBQESA-N 1 1 232.249 3.533 20 0 BHADMO CC[C@@H](Nc1cc(C2CC2)cc[nH+]1)C(C)C ZINC000336748118 352938291 /nfs/dbraw/zinc/93/82/91/352938291.db2.gz XUPKDLAOYVGNTM-CYBMUJFWSA-N 1 1 218.344 3.806 20 0 BHADMO CC[C@H](Nc1cc(C2CC2)cc[nH+]1)C(C)C ZINC000336748120 398197562 /nfs/dbraw/zinc/19/75/62/398197562.db2.gz XUPKDLAOYVGNTM-ZDUSSCGKSA-N 1 1 218.344 3.806 20 0 BHADMO CC(C)(C)CNc1cc[nH+]c2ccsc21 ZINC000336758538 386637397 /nfs/dbraw/zinc/63/73/97/386637397.db2.gz KVVPNFQDRHKSIT-UHFFFAOYSA-N 1 1 220.341 3.754 20 0 BHADMO COc1ccccc1[C@@H]1CCC[N@H+]1CCC1CC1 ZINC000336783896 175348794 /nfs/dbraw/zinc/34/87/94/175348794.db2.gz IETWPRRRMZSTKR-HNNXBMFYSA-N 1 1 245.366 3.632 20 0 BHADMO COc1ccccc1[C@H]1CCC[N@H+]1CCC1CC1 ZINC000336783897 175354323 /nfs/dbraw/zinc/35/43/23/175354323.db2.gz IETWPRRRMZSTKR-OAHLLOKOSA-N 1 1 245.366 3.632 20 0 BHADMO COC(C)(C)CC[N@H+]1CCC[C@H]1c1ccccc1 ZINC000336784783 386511805 /nfs/dbraw/zinc/51/18/05/386511805.db2.gz XIAHIWAGAPPYOK-HNNXBMFYSA-N 1 1 247.382 3.639 20 0 BHADMO COC(C)(C)CC[N@H+]1CCC[C@@H]1c1ccccc1 ZINC000336784784 386511630 /nfs/dbraw/zinc/51/16/30/386511630.db2.gz XIAHIWAGAPPYOK-OAHLLOKOSA-N 1 1 247.382 3.639 20 0 BHADMO C[N@@H+](CCCC(C)(C)C)Cc1ccoc1 ZINC000337121369 386613511 /nfs/dbraw/zinc/61/35/11/386613511.db2.gz AGLYWIGIKJNHCH-UHFFFAOYSA-N 1 1 209.333 3.538 20 0 BHADMO Cc1ncc(C[N@H+](C)C[C@H](C)CC(C)C)s1 ZINC000337123794 180137974 /nfs/dbraw/zinc/13/79/74/180137974.db2.gz CKTLYFUQXBWURD-LLVKDONJSA-N 1 1 240.416 3.566 20 0 BHADMO Cc1ncc(C[N@H+](C)C[C@@H](C)CC(C)C)s1 ZINC000337123795 180137578 /nfs/dbraw/zinc/13/75/78/180137578.db2.gz CKTLYFUQXBWURD-NSHDSACASA-N 1 1 240.416 3.566 20 0 BHADMO C[C@@H]1CCCC[N@H+]1Cc1cnc2ccccc2c1 ZINC000337125620 176074257 /nfs/dbraw/zinc/07/42/57/176074257.db2.gz FFFWEEIZYNSBEZ-CYBMUJFWSA-N 1 1 240.350 3.609 20 0 BHADMO C[C@H]1CCCC[N@H+]1Cc1cnc2ccccc2c1 ZINC000337125621 177076799 /nfs/dbraw/zinc/07/67/99/177076799.db2.gz FFFWEEIZYNSBEZ-ZDUSSCGKSA-N 1 1 240.350 3.609 20 0 BHADMO C[N@@H+](CCCC(C)(C)C)Cc1ccco1 ZINC000337128165 386615690 /nfs/dbraw/zinc/61/56/90/386615690.db2.gz HYIJWIHTHNVPEJ-UHFFFAOYSA-N 1 1 209.333 3.538 20 0 BHADMO C[C@@H]1CC[C@H](C)[N@@H+]1Cc1cnc2ccccc2c1 ZINC000337131316 177187476 /nfs/dbraw/zinc/18/74/76/177187476.db2.gz AACGDESWCOOEMV-BETUJISGSA-N 1 1 240.350 3.608 20 0 BHADMO C[N@@H+](Cc1cnc2ccccc2c1)CC(C)(C)C ZINC000337134472 386621816 /nfs/dbraw/zinc/62/18/16/386621816.db2.gz LSXNIJQVVBQIAI-UHFFFAOYSA-N 1 1 242.366 3.713 20 0 BHADMO CCC[N@@H+](Cc1cnc2ccccc2c1)C1CC1 ZINC000337136320 169179994 /nfs/dbraw/zinc/17/99/94/169179994.db2.gz NDEBGPLCJIBVFJ-UHFFFAOYSA-N 1 1 240.350 3.609 20 0 BHADMO CC[N@H+](Cc1cnc2ccccc2c1)CC(C)C ZINC000337138563 169929769 /nfs/dbraw/zinc/92/97/69/169929769.db2.gz QSAAEVFSUAYYNA-UHFFFAOYSA-N 1 1 242.366 3.713 20 0 BHADMO CC1(C)CCC[N@H+]1Cc1cnc2ccccc2c1 ZINC000337138671 350559309 /nfs/dbraw/zinc/55/93/09/350559309.db2.gz PFUZGYDRUOQATI-UHFFFAOYSA-N 1 1 240.350 3.609 20 0 BHADMO CCc1[nH+]ccn1CCSC1CCCCC1 ZINC000337140003 172026487 /nfs/dbraw/zinc/02/64/87/172026487.db2.gz TUIBADDPIBDPOU-UHFFFAOYSA-N 1 1 238.400 3.511 20 0 BHADMO CC(C)[C@@H](C)[N@@H+](C)Cc1cnc2ccccc2c1 ZINC000337140586 167369622 /nfs/dbraw/zinc/36/96/22/167369622.db2.gz UKQYUXRXJICRON-CYBMUJFWSA-N 1 1 242.366 3.711 20 0 BHADMO CC(C)[C@H](C)[N@@H+](C)Cc1cnc2ccccc2c1 ZINC000337140588 386622814 /nfs/dbraw/zinc/62/28/14/386622814.db2.gz UKQYUXRXJICRON-ZDUSSCGKSA-N 1 1 242.366 3.711 20 0 BHADMO Cc1nc(C[N@@H+](C)CCCC(C)(C)C)cs1 ZINC000337141553 386625016 /nfs/dbraw/zinc/62/50/16/386625016.db2.gz SLYYXAAVDNEIMB-UHFFFAOYSA-N 1 1 240.416 3.710 20 0 BHADMO Cc1nc(C[N@H+](C)CCCC(C)(C)C)cs1 ZINC000337141553 386625011 /nfs/dbraw/zinc/62/50/11/386625011.db2.gz SLYYXAAVDNEIMB-UHFFFAOYSA-N 1 1 240.416 3.710 20 0 BHADMO CC[C@H]1CCC[N@H+]1Cc1cnc2ccccc2c1 ZINC000337142123 386624990 /nfs/dbraw/zinc/62/49/90/386624990.db2.gz SYEWINDLSKODOH-HNNXBMFYSA-N 1 1 240.350 3.609 20 0 BHADMO CC[C@@H]1CCC[N@H+]1Cc1cnc2ccccc2c1 ZINC000337142124 350560131 /nfs/dbraw/zinc/56/01/31/350560131.db2.gz SYEWINDLSKODOH-OAHLLOKOSA-N 1 1 240.350 3.609 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)Cc1cnc2ccccc2c1 ZINC000337142525 169364531 /nfs/dbraw/zinc/36/45/31/169364531.db2.gz XDMLCNBHLAEVFH-CYBMUJFWSA-N 1 1 242.366 3.855 20 0 BHADMO CCC[C@H](C)[N@@H+](C)Cc1cnc2ccccc2c1 ZINC000337142526 386626323 /nfs/dbraw/zinc/62/63/23/386626323.db2.gz XDMLCNBHLAEVFH-ZDUSSCGKSA-N 1 1 242.366 3.855 20 0 BHADMO Cc1ncc(C[N@@H+](C)CCCC(C)(C)C)s1 ZINC000337142852 180138642 /nfs/dbraw/zinc/13/86/42/180138642.db2.gz USKBZCLTUAEURT-UHFFFAOYSA-N 1 1 240.416 3.710 20 0 BHADMO CC[N@@H+](Cc1ccnn1C(C)C)C1CCCCC1 ZINC000337143926 350560273 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386654398 /nfs/dbraw/zinc/65/43/98/386654398.db2.gz OAISTXSKCAQZFV-UONOGXRCSA-N 1 1 234.387 3.757 20 0 BHADMO CC(C)C[C@@H](C)C[N@@H+](C)[C@H](C)c1cccnc1 ZINC000337184130 188361520 /nfs/dbraw/zinc/36/15/20/188361520.db2.gz OAISTXSKCAQZFV-ZIAGYGMSSA-N 1 1 234.387 3.757 20 0 BHADMO Cc1ncsc1C[N@@H+](C)CCCC(C)(C)C ZINC000337185091 180313876 /nfs/dbraw/zinc/31/38/76/180313876.db2.gz OBURDJRBXLJLLE-UHFFFAOYSA-N 1 1 240.416 3.710 20 0 BHADMO CCC(C)(C)[N@@H+](C)Cc1cnc2ccccc2c1 ZINC000337185726 168287416 /nfs/dbraw/zinc/28/74/16/168287416.db2.gz OYTDYFBSFWIYFA-UHFFFAOYSA-N 1 1 242.366 3.855 20 0 BHADMO C[C@H](c1ccccn1)[N@@H+](C)CCCC(C)(C)C ZINC000337189379 177042515 /nfs/dbraw/zinc/04/25/15/177042515.db2.gz RLUVZJIETFKWAF-CYBMUJFWSA-N 1 1 234.387 3.901 20 0 BHADMO CC(C)(C)CCC[N@@H+](Cc1cccnc1)C1CC1 ZINC000337190618 386642569 /nfs/dbraw/zinc/64/25/69/386642569.db2.gz SRYQAQSTOBOZIG-UHFFFAOYSA-N 1 1 246.398 3.872 20 0 BHADMO CC[C@@H](C)C[N@@H+](C)Cc1cnc2ccccc2c1 ZINC000337190732 386642061 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Cc1ccc([C@@H](C)[NH2+][C@H](C)c2ccncc2F)o1 ZINC000338009288 178849030 /nfs/dbraw/zinc/84/90/30/178849030.db2.gz BVJVEGOTDXGOPD-GHMZBOCLSA-N 1 1 248.301 3.534 20 0 BHADMO Cc1ccc([C@H](C)[NH2+][C@H](C)c2ccncc2F)o1 ZINC000338009292 385879248 /nfs/dbraw/zinc/87/92/48/385879248.db2.gz BVJVEGOTDXGOPD-MNOVXSKESA-N 1 1 248.301 3.534 20 0 BHADMO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2ccncc2F)o1 ZINC000338009295 178895582 /nfs/dbraw/zinc/89/55/82/178895582.db2.gz BVJVEGOTDXGOPD-QWRGUYRKSA-N 1 1 248.301 3.534 20 0 BHADMO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccncc2F)o1 ZINC000338009298 385879390 /nfs/dbraw/zinc/87/93/90/385879390.db2.gz BVJVEGOTDXGOPD-WDEREUQCSA-N 1 1 248.301 3.534 20 0 BHADMO Cc1ccc[nH+]c1NCc1ccc2ncccc2c1 ZINC000338183504 188017307 /nfs/dbraw/zinc/01/73/07/188017307.db2.gz ODROSAPDPYPCEP-UHFFFAOYSA-N 1 1 249.317 3.550 20 0 BHADMO CC[N@@H+](Cc1csc2ccccc12)C1CC1 ZINC000338203254 350673052 /nfs/dbraw/zinc/67/30/52/350673052.db2.gz GNOLUYUYKIDTIK-UHFFFAOYSA-N 1 1 231.364 3.886 20 0 BHADMO C[N@H+](Cc1ccoc1)C[C@@H]1CCCC(F)(F)C1 ZINC000338234784 385932062 /nfs/dbraw/zinc/93/20/62/385932062.db2.gz BDRZTGFBKQOYPC-LLVKDONJSA-N 1 1 243.297 3.537 20 0 BHADMO C[N@H+](Cc1ccoc1)C[C@H]1CCCC(F)(F)C1 ZINC000338234788 385930352 /nfs/dbraw/zinc/93/03/52/385930352.db2.gz BDRZTGFBKQOYPC-NSHDSACASA-N 1 1 243.297 3.537 20 0 BHADMO CC[N@@H+](Cc1c(Cl)cccc1OC)C(C)C ZINC000338235556 350674744 /nfs/dbraw/zinc/67/47/44/350674744.db2.gz WMULEKBJANVTMD-UHFFFAOYSA-N 1 1 241.762 3.579 20 0 BHADMO Cc1cccc(C[N@H+](C)CCSC(C)C)c1 ZINC000338236325 179067901 /nfs/dbraw/zinc/06/79/01/179067901.db2.gz ZNMJYURZQAZWCQ-UHFFFAOYSA-N 1 1 237.412 3.568 20 0 BHADMO Cc1ccc(C[N@H+](C)CCSC(C)C)cc1 ZINC000338236941 385931848 /nfs/dbraw/zinc/93/18/48/385931848.db2.gz PKINMHLMGWDKFJ-UHFFFAOYSA-N 1 1 237.412 3.568 20 0 BHADMO C[N@H+](Cc1ccco1)C[C@@H]1CCCC(F)(F)C1 ZINC000338254409 385928698 /nfs/dbraw/zinc/92/86/98/385928698.db2.gz PZWQWNXKIPKKRI-LLVKDONJSA-N 1 1 243.297 3.537 20 0 BHADMO C[N@H+](Cc1ccco1)C[C@H]1CCCC(F)(F)C1 ZINC000338254412 385929031 /nfs/dbraw/zinc/92/90/31/385929031.db2.gz PZWQWNXKIPKKRI-NSHDSACASA-N 1 1 243.297 3.537 20 0 BHADMO CC[N@@H+](CCSC(C)C)Cc1ccccc1 ZINC000338262118 385943189 /nfs/dbraw/zinc/94/31/89/385943189.db2.gz FISADVMHHBCPFP-UHFFFAOYSA-N 1 1 237.412 3.650 20 0 BHADMO CC(C)SCC[N@@H+](C)C1CCC(C)CC1 ZINC000338264355 168158179 /nfs/dbraw/zinc/15/81/79/168158179.db2.gz MTTVCGHRWIEHLC-UHFFFAOYSA-N 1 1 229.433 3.639 20 0 BHADMO FC1(F)CCC[C@@H](C[N@H+]2CCC3(CCC3)C2)C1 ZINC000338270552 385935238 /nfs/dbraw/zinc/93/52/38/385935238.db2.gz IBZOKKPEQUMGQB-GFCCVEGCSA-N 1 1 243.341 3.688 20 0 BHADMO FC1(F)CCC[C@H](C[N@H+]2CCC3(CCC3)C2)C1 ZINC000338270553 385936098 /nfs/dbraw/zinc/93/60/98/385936098.db2.gz IBZOKKPEQUMGQB-LBPRGKRZSA-N 1 1 243.341 3.688 20 0 BHADMO CC(C)SCC[N@H+]1CC[C@@H](C)C2(CCC2)C1 ZINC000338276304 167326897 /nfs/dbraw/zinc/32/68/97/167326897.db2.gz CUEMBYLJUKNVTG-CYBMUJFWSA-N 1 1 241.444 3.640 20 0 BHADMO 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/nfs/dbraw/zinc/69/47/29/350694729.db2.gz QDTBFQRGUPBGOX-UHFFFAOYSA-N 1 1 229.776 3.776 20 0 BHADMO CC1=CC[N@@H+](Cc2sccc2Cl)CC1 ZINC000338565020 168115106 /nfs/dbraw/zinc/11/51/06/168115106.db2.gz KQHQBWXAMAQSAY-UHFFFAOYSA-N 1 1 227.760 3.554 20 0 BHADMO CC1=CC[N@H+](Cc2sccc2Cl)CC1 ZINC000338565020 168115102 /nfs/dbraw/zinc/11/51/02/168115102.db2.gz KQHQBWXAMAQSAY-UHFFFAOYSA-N 1 1 227.760 3.554 20 0 BHADMO CO[C@@H](C[N@@H+](C(C)C)C1CCC1)c1ccccc1 ZINC000338567351 386054667 /nfs/dbraw/zinc/05/46/67/386054667.db2.gz MNUCFLIROLTUSB-INIZCTEOSA-N 1 1 247.382 3.637 20 0 BHADMO CO[C@H](C[N@@H+](C(C)C)C1CCC1)c1ccccc1 ZINC000338567352 386052795 /nfs/dbraw/zinc/05/27/95/386052795.db2.gz MNUCFLIROLTUSB-MRXNPFEDSA-N 1 1 247.382 3.637 20 0 BHADMO Cc1ccsc1C[N@H+](C)[C@@H]1CC[C@H](C)C1 ZINC000338883961 386173700 /nfs/dbraw/zinc/17/37/00/386173700.db2.gz NABYFPNONKHESU-CMPLNLGQSA-N 1 1 223.385 3.677 20 0 BHADMO Cc1ccsc1C[N@H+](C)[C@H]1CC[C@H](C)C1 ZINC000338883962 386175058 /nfs/dbraw/zinc/17/50/58/386175058.db2.gz NABYFPNONKHESU-JQWIXIFHSA-N 1 1 223.385 3.677 20 0 BHADMO Cc1ccsc1C[N@H+](C)[C@H]1CC[C@@H](C)C1 ZINC000338883963 386173465 /nfs/dbraw/zinc/17/34/65/386173465.db2.gz NABYFPNONKHESU-PWSUYJOCSA-N 1 1 223.385 3.677 20 0 BHADMO Cc1ccsc1C[N@H+](C)[C@@H]1CC[C@@H](C)C1 ZINC000338883965 386174087 /nfs/dbraw/zinc/17/40/87/386174087.db2.gz NABYFPNONKHESU-ZYHUDNBSSA-N 1 1 223.385 3.677 20 0 BHADMO CCCC[N@@H+](C)Cc1ccc(C(C)C)nc1C ZINC000338885910 386174356 /nfs/dbraw/zinc/17/43/56/386174356.db2.gz WXPNSLRTRCGELK-UHFFFAOYSA-N 1 1 234.387 3.745 20 0 BHADMO COC1(CC[N@@H+](C)[C@@H](C)c2ccccc2)CCC1 ZINC000338890646 386169645 /nfs/dbraw/zinc/16/96/45/386169645.db2.gz VQXNIRRHQSJEEK-AWEZNQCLSA-N 1 1 247.382 3.639 20 0 BHADMO COC1(CC[N@@H+](C)[C@H](C)c2ccccc2)CCC1 ZINC000338890647 386168277 /nfs/dbraw/zinc/16/82/77/386168277.db2.gz VQXNIRRHQSJEEK-CQSZACIVSA-N 1 1 247.382 3.639 20 0 BHADMO CCc1ccc(C[N@@H+](C)C2CCC(C)CC2)nc1 ZINC000338890914 386169638 /nfs/dbraw/zinc/16/96/38/386169638.db2.gz XAMVPLGXQBMKPP-UHFFFAOYSA-N 1 1 246.398 3.655 20 0 BHADMO Cc1nc(C(C)C)ccc1C[N@@H+](C)C1CCCC1 ZINC000338891713 179895962 /nfs/dbraw/zinc/89/59/62/179895962.db2.gz IDBPYQLHBYVOMW-UHFFFAOYSA-N 1 1 246.398 3.888 20 0 BHADMO CC[C@H]1CCCC[N@H+]1Cc1ccc(COC)cc1 ZINC000338895561 386170134 /nfs/dbraw/zinc/17/01/34/386170134.db2.gz OUIUFAKEFINZFB-INIZCTEOSA-N 1 1 247.382 3.598 20 0 BHADMO CC[C@@H]1CCCC[N@H+]1Cc1ccc(COC)cc1 ZINC000338895562 350718411 /nfs/dbraw/zinc/71/84/11/350718411.db2.gz OUIUFAKEFINZFB-MRXNPFEDSA-N 1 1 247.382 3.598 20 0 BHADMO Cc1nc(C(C)C)ccc1C[N@H+]1CCCC[C@H]1C ZINC000338897404 386172599 /nfs/dbraw/zinc/17/25/99/386172599.db2.gz AJJCDARQHYMIIL-CYBMUJFWSA-N 1 1 246.398 3.888 20 0 BHADMO Cc1nc(C(C)C)ccc1C[N@H+]1CCCC[C@@H]1C ZINC000338897405 386171315 /nfs/dbraw/zinc/17/13/15/386171315.db2.gz AJJCDARQHYMIIL-ZDUSSCGKSA-N 1 1 246.398 3.888 20 0 BHADMO Cc1nc(C(C)C)ccc1C[N@H+](C)[C@@H](C)C(C)C ZINC000338897552 386171200 /nfs/dbraw/zinc/17/12/00/386171200.db2.gz RPQCJFBHBNISEZ-AWEZNQCLSA-N 1 1 248.414 3.990 20 0 BHADMO Cc1nc(C(C)C)ccc1C[N@H+](C)[C@H](C)C(C)C ZINC000338897553 386172442 /nfs/dbraw/zinc/17/24/42/386172442.db2.gz RPQCJFBHBNISEZ-CQSZACIVSA-N 1 1 248.414 3.990 20 0 BHADMO C[C@H]1CC[C@H]([N@@H+](C)Cc2ccc(F)cc2F)C1 ZINC000338900237 177204021 /nfs/dbraw/zinc/20/40/21/177204021.db2.gz DXFLKBYNNZZVOK-GWCFXTLKSA-N 1 1 239.309 3.585 20 0 BHADMO C[C@H]1CC[C@@H]([N@@H+](C)Cc2ccc(F)cc2F)C1 ZINC000338900238 177191181 /nfs/dbraw/zinc/19/11/81/177191181.db2.gz DXFLKBYNNZZVOK-GXFFZTMASA-N 1 1 239.309 3.585 20 0 BHADMO C[C@@H]1CC[C@H]([N@@H+](C)Cc2ccc(F)cc2F)C1 ZINC000338900239 176228763 /nfs/dbraw/zinc/22/87/63/176228763.db2.gz DXFLKBYNNZZVOK-MFKMUULPSA-N 1 1 239.309 3.585 20 0 BHADMO C[C@@H]1CC[C@@H]([N@@H+](C)Cc2ccc(F)cc2F)C1 ZINC000338900240 176207251 /nfs/dbraw/zinc/20/72/51/176207251.db2.gz DXFLKBYNNZZVOK-ZWNOBZJWSA-N 1 1 239.309 3.585 20 0 BHADMO CCCC[N@@H+](Cc1ccc(COC)cc1)C1CC1 ZINC000338902743 386170871 /nfs/dbraw/zinc/17/08/71/386170871.db2.gz IZTMJEZGPIQPDS-UHFFFAOYSA-N 1 1 247.382 3.598 20 0 BHADMO C[C@H]1CC[C@@H]([N@@H+](C)Cc2ccc(F)c(F)c2)C1 ZINC000338905195 177191824 /nfs/dbraw/zinc/19/18/24/177191824.db2.gz QDUZNPHGRIHRCV-CMPLNLGQSA-N 1 1 239.309 3.585 20 0 BHADMO C[C@H]1CC[C@H]([N@@H+](C)Cc2ccc(F)c(F)c2)C1 ZINC000338905196 177203668 /nfs/dbraw/zinc/20/36/68/177203668.db2.gz QDUZNPHGRIHRCV-JQWIXIFHSA-N 1 1 239.309 3.585 20 0 BHADMO C[C@@H]1CC[C@H]([N@@H+](C)Cc2ccc(F)c(F)c2)C1 ZINC000338905197 176228974 /nfs/dbraw/zinc/22/89/74/176228974.db2.gz QDUZNPHGRIHRCV-PWSUYJOCSA-N 1 1 239.309 3.585 20 0 BHADMO C[C@@H]1CC[C@@H]([N@@H+](C)Cc2ccc(F)c(F)c2)C1 ZINC000338905198 176207116 /nfs/dbraw/zinc/20/71/16/176207116.db2.gz QDUZNPHGRIHRCV-ZYHUDNBSSA-N 1 1 239.309 3.585 20 0 BHADMO CCc1nc(C(C)C)ccc1C[N@H+](CC)C1CC1 ZINC000338905749 350720036 /nfs/dbraw/zinc/72/00/36/350720036.db2.gz SBYFQLFEROLEFQ-UHFFFAOYSA-N 1 1 246.398 3.752 20 0 BHADMO COCc1ccc(C[N@@H+](CC(C)C)C(C)C)cc1 ZINC000338907631 386177946 /nfs/dbraw/zinc/17/79/46/386177946.db2.gz LLRDAYOBNIKGOZ-UHFFFAOYSA-N 1 1 249.398 3.699 20 0 BHADMO Cc1nc(C(C)C)ccc1C[N@H+]1CCC[C@@H](C)C1 ZINC000338907982 386180291 /nfs/dbraw/zinc/18/02/91/386180291.db2.gz SICKBISMJSUXQH-CYBMUJFWSA-N 1 1 246.398 3.745 20 0 BHADMO Cc1nc(C(C)C)ccc1C[N@H+]1CCC[C@H](C)C1 ZINC000338907983 386179676 /nfs/dbraw/zinc/17/96/76/386179676.db2.gz SICKBISMJSUXQH-ZDUSSCGKSA-N 1 1 246.398 3.745 20 0 BHADMO CCc1ccc(C[N@@H+](CC(C)C)C(C)C)nc1 ZINC000338908674 386173978 /nfs/dbraw/zinc/17/39/78/386173978.db2.gz UWBYHVIAJOPDIG-UHFFFAOYSA-N 1 1 234.387 3.510 20 0 BHADMO Cc1nc(C(C)C)ccc1C[N@H+](C(C)C)C1CC1 ZINC000338909373 386173503 /nfs/dbraw/zinc/17/35/03/386173503.db2.gz ZGKSIAQTIGMDDD-UHFFFAOYSA-N 1 1 246.398 3.886 20 0 BHADMO CCc1ccc(C[N@@H+](C)[C@H]2CCC[C@H](C)C2)nc1 ZINC000338914410 386174750 /nfs/dbraw/zinc/17/47/50/386174750.db2.gz YIAFVEBLQMVZDV-BBRMVZONSA-N 1 1 246.398 3.655 20 0 BHADMO CCc1ccc(C[N@@H+](C)[C@H]2CCC[C@@H](C)C2)nc1 ZINC000338914411 386174680 /nfs/dbraw/zinc/17/46/80/386174680.db2.gz YIAFVEBLQMVZDV-CJNGLKHVSA-N 1 1 246.398 3.655 20 0 BHADMO CCc1ccc(C[N@@H+](C)[C@@H]2CCC[C@@H](C)C2)nc1 ZINC000338914412 386173738 /nfs/dbraw/zinc/17/37/38/386173738.db2.gz YIAFVEBLQMVZDV-CZUORRHYSA-N 1 1 246.398 3.655 20 0 BHADMO CCc1ccc(C[N@@H+](C)[C@@H]2CCC[C@H](C)C2)nc1 ZINC000338914413 386174995 /nfs/dbraw/zinc/17/49/95/386174995.db2.gz YIAFVEBLQMVZDV-XJKSGUPXSA-N 1 1 246.398 3.655 20 0 BHADMO CC[N@@H+](Cc1ccc(C(C)C)nc1C)C(C)C ZINC000338921537 350720962 /nfs/dbraw/zinc/72/09/62/350720962.db2.gz UMIVUODITQCQGC-UHFFFAOYSA-N 1 1 234.387 3.744 20 0 BHADMO C[N@@H+](Cc1ccoc1)[C@H]1C=CCCCCC1 ZINC000338926543 386180013 /nfs/dbraw/zinc/18/00/13/386180013.db2.gz PQIDESIYLSHSOF-AWEZNQCLSA-N 1 1 219.328 3.600 20 0 BHADMO C[N@@H+](Cc1ccoc1)[C@@H]1C=CCCCCC1 ZINC000338926547 386180359 /nfs/dbraw/zinc/18/03/59/386180359.db2.gz PQIDESIYLSHSOF-CQSZACIVSA-N 1 1 219.328 3.600 20 0 BHADMO CCc1nc(C(C)C)ccc1C[N@@H+](C)CC1CC1 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386209560 /nfs/dbraw/zinc/20/95/60/386209560.db2.gz NNTMTQQKPFMMJB-OCCSQVGLSA-N 1 1 246.398 3.744 20 0 BHADMO Cc1nc(C(C)C)ccc1C[N@H+]1CC[C@@H](C)[C@H]1C ZINC000339010957 386209449 /nfs/dbraw/zinc/20/94/49/386209449.db2.gz NNTMTQQKPFMMJB-TZMCWYRMSA-N 1 1 246.398 3.744 20 0 BHADMO Fc1cccc(C[N@H+]2CCC23CCC3)c1Cl ZINC000339011772 386209934 /nfs/dbraw/zinc/20/99/34/386209934.db2.gz CVQPKMLIBLDOBX-UHFFFAOYSA-N 1 1 239.721 3.608 20 0 BHADMO Fc1cccc(C[N@@H+]2CCC23CCC3)c1Cl ZINC000339011772 386209929 /nfs/dbraw/zinc/20/99/29/386209929.db2.gz CVQPKMLIBLDOBX-UHFFFAOYSA-N 1 1 239.721 3.608 20 0 BHADMO CCc1ccc(C[N@H+](CC)C[C@H](C)CC)nc1 ZINC000339011878 386208775 /nfs/dbraw/zinc/20/87/75/386208775.db2.gz VRUIWJJRNVZXDF-CYBMUJFWSA-N 1 1 234.387 3.512 20 0 BHADMO CCc1ccc(C[N@H+](CC)C[C@@H](C)CC)nc1 ZINC000339011879 386210130 /nfs/dbraw/zinc/21/01/30/386210130.db2.gz VRUIWJJRNVZXDF-ZDUSSCGKSA-N 1 1 234.387 3.512 20 0 BHADMO Cc1nc(C(C)C)ccc1C[N@H+]1CCC12CCC2 ZINC000339013621 386212982 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168116311 /nfs/dbraw/zinc/11/63/11/168116311.db2.gz ZZKAYDDBSDEIMG-UHFFFAOYSA-N 1 1 244.382 3.665 20 0 BHADMO CC[C@H]1CC[C@H](C)[N@H+]1Cc1ccc(COC)cc1 ZINC000339062481 386230646 /nfs/dbraw/zinc/23/06/46/386230646.db2.gz FJHXJQDYXJTMFV-BBRMVZONSA-N 1 1 247.382 3.596 20 0 BHADMO CC[C@H]1CC[C@@H](C)[N@H+]1Cc1ccc(COC)cc1 ZINC000339062482 386230653 /nfs/dbraw/zinc/23/06/53/386230653.db2.gz FJHXJQDYXJTMFV-CJNGLKHVSA-N 1 1 247.382 3.596 20 0 BHADMO CC[C@@H]1CC[C@@H](C)[N@H+]1Cc1ccc(COC)cc1 ZINC000339062483 171037354 /nfs/dbraw/zinc/03/73/54/171037354.db2.gz FJHXJQDYXJTMFV-CZUORRHYSA-N 1 1 247.382 3.596 20 0 BHADMO CC[C@@H]1CC[C@H](C)[N@H+]1Cc1ccc(COC)cc1 ZINC000339062484 171055003 /nfs/dbraw/zinc/05/50/03/171055003.db2.gz FJHXJQDYXJTMFV-XJKSGUPXSA-N 1 1 247.382 3.596 20 0 BHADMO CCC[N@@H+](Cc1ccc([C@@H]2C[C@H]2C)o1)C1CC1 ZINC000339089939 169176280 /nfs/dbraw/zinc/17/62/80/169176280.db2.gz DYSQFFSIOBBQAJ-BXUZGUMPSA-N 1 1 233.355 3.777 20 0 BHADMO CCC[N@@H+](Cc1ccc([C@H]2C[C@H]2C)o1)C1CC1 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CCc1ccc(C[N@H+]2C[C@H](C)C[C@@H](C)[C@@H]2C)nc1 ZINC000339120562 386250303 /nfs/dbraw/zinc/25/03/03/386250303.db2.gz RNRCZMMBWUHWCK-MCIONIFRSA-N 1 1 246.398 3.510 20 0 BHADMO CCc1ccc(C[N@H+]2C[C@H](C)C[C@@H](C)[C@H]2C)nc1 ZINC000339120563 386250064 /nfs/dbraw/zinc/25/00/64/386250064.db2.gz RNRCZMMBWUHWCK-MGPQQGTHSA-N 1 1 246.398 3.510 20 0 BHADMO CCc1ccc(C[N@H+]2C[C@H](C)C[C@H](C)[C@@H]2C)nc1 ZINC000339120564 386250018 /nfs/dbraw/zinc/25/00/18/386250018.db2.gz RNRCZMMBWUHWCK-RDBSUJKOSA-N 1 1 246.398 3.510 20 0 BHADMO C[C@H]1CC[C@@H]([N@@H+](C)Cc2cccc3[nH]ccc32)C1 ZINC000339124152 177191059 /nfs/dbraw/zinc/19/10/59/177191059.db2.gz LEKNIBQVZUTPOT-GXTWGEPZSA-N 1 1 242.366 3.788 20 0 BHADMO C[C@H]1CC[C@H]([N@@H+](C)Cc2cccc3[nH]ccc32)C1 ZINC000339124154 177204062 /nfs/dbraw/zinc/20/40/62/177204062.db2.gz LEKNIBQVZUTPOT-JSGCOSHPSA-N 1 1 242.366 3.788 20 0 BHADMO C[C@@H]1CC[C@H]([N@@H+](C)Cc2cccc3[nH]ccc32)C1 ZINC000339124156 176228476 /nfs/dbraw/zinc/22/84/76/176228476.db2.gz 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224.307 3.571 20 0 BHADMO Cc1ccc(CNc2cccc(C3CC3)[nH+]2)s1 ZINC000339428548 386420482 /nfs/dbraw/zinc/42/04/82/386420482.db2.gz LRMQHLANLJQNQQ-UHFFFAOYSA-N 1 1 244.363 3.941 20 0 BHADMO Clc1ccc(CNc2cccc(C3CC3)[nH+]2)o1 ZINC000339428623 386421760 /nfs/dbraw/zinc/42/17/60/386421760.db2.gz MPZUCOOQPKOLNY-UHFFFAOYSA-N 1 1 248.713 3.818 20 0 BHADMO Fc1ccccc1CNc1cccc(C2CC2)[nH+]1 ZINC000339428898 181013557 /nfs/dbraw/zinc/01/35/57/181013557.db2.gz HPHOXTAALOFZLD-UHFFFAOYSA-N 1 1 242.297 3.710 20 0 BHADMO CC1(CNc2cccc(C3CC3)[nH+]2)CCC1 ZINC000339428926 168047935 /nfs/dbraw/zinc/04/79/35/168047935.db2.gz ILNUTJWTEZYBJO-UHFFFAOYSA-N 1 1 216.328 3.561 20 0 BHADMO CCc1ccc(CNc2cccc(C3CC3)[nH+]2)o1 ZINC000339428969 386421169 /nfs/dbraw/zinc/42/11/69/386421169.db2.gz JXDAGBQYXATJEH-UHFFFAOYSA-N 1 1 242.322 3.727 20 0 BHADMO Cc1ccc(CNc2cccc(C3CC3)[nH+]2)cc1 ZINC000339429032 386420757 /nfs/dbraw/zinc/42/07/57/386420757.db2.gz UTLSMAZRFHMVNS-UHFFFAOYSA-N 1 1 238.334 3.880 20 0 BHADMO 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CCCC[N@@H+](Cc1c[nH]cn1)[C@@H]1CCC[C@@H](C)C1 ZINC000339643122 386504016 /nfs/dbraw/zinc/50/40/16/386504016.db2.gz CRLMUGAGSXQQBB-UKRRQHHQSA-N 1 1 249.402 3.591 20 0 BHADMO CCCC[N@H+](Cc1c[nH]cn1)[C@@H]1CCC[C@@H](C)C1 ZINC000339643122 386504013 /nfs/dbraw/zinc/50/40/13/386504013.db2.gz CRLMUGAGSXQQBB-UKRRQHHQSA-N 1 1 249.402 3.591 20 0 BHADMO CCCC[N@@H+](Cc1cnc[nH]1)[C@@H]1CCC[C@@H](C)C1 ZINC000339643122 386504008 /nfs/dbraw/zinc/50/40/08/386504008.db2.gz CRLMUGAGSXQQBB-UKRRQHHQSA-N 1 1 249.402 3.591 20 0 BHADMO CCCC[N@@H+](Cc1c[nH]cn1)[C@H]1CCC[C@H](C)C1 ZINC000339643124 386501571 /nfs/dbraw/zinc/50/15/71/386501571.db2.gz CRLMUGAGSXQQBB-ZFWWWQNUSA-N 1 1 249.402 3.591 20 0 BHADMO CCCC[N@H+](Cc1c[nH]cn1)[C@H]1CCC[C@H](C)C1 ZINC000339643124 386501564 /nfs/dbraw/zinc/50/15/64/386501564.db2.gz CRLMUGAGSXQQBB-ZFWWWQNUSA-N 1 1 249.402 3.591 20 0 BHADMO CCCC[N@@H+](Cc1cnc[nH]1)[C@H]1CCC[C@H](C)C1 ZINC000339643124 386501560 /nfs/dbraw/zinc/50/15/60/386501560.db2.gz CRLMUGAGSXQQBB-ZFWWWQNUSA-N 1 1 249.402 3.591 20 0 BHADMO CCCC[C@H](C)[N@@H+](CCCC)Cc1ncccn1 ZINC000339646822 350771341 /nfs/dbraw/zinc/77/13/41/350771341.db2.gz JIMYEPZABKADCL-AWEZNQCLSA-N 1 1 249.402 3.657 20 0 BHADMO CCCC[C@@H](C)[N@@H+](CCCC)Cc1ncccn1 ZINC000339646823 350771385 /nfs/dbraw/zinc/77/13/85/350771385.db2.gz JIMYEPZABKADCL-CQSZACIVSA-N 1 1 249.402 3.657 20 0 BHADMO Cc1ccc(C[N@H+]2CCC[C@@H]2CF)c(Cl)c1 ZINC000339664103 386511371 /nfs/dbraw/zinc/51/13/71/386511371.db2.gz HTXMKIRSYISHJB-GFCCVEGCSA-N 1 1 241.737 3.582 20 0 BHADMO Cc1ccc(C[N@@H+]2CCC[C@@H]2CF)c(Cl)c1 ZINC000339664103 386511366 /nfs/dbraw/zinc/51/13/66/386511366.db2.gz HTXMKIRSYISHJB-GFCCVEGCSA-N 1 1 241.737 3.582 20 0 BHADMO Cc1ccc(C[N@H+]2CCC[C@H]2CF)c(Cl)c1 ZINC000339664104 386513093 /nfs/dbraw/zinc/51/30/93/386513093.db2.gz HTXMKIRSYISHJB-LBPRGKRZSA-N 1 1 241.737 3.582 20 0 BHADMO Cc1ccc(C[N@@H+]2CCC[C@H]2CF)c(Cl)c1 ZINC000339664104 386513087 /nfs/dbraw/zinc/51/30/87/386513087.db2.gz HTXMKIRSYISHJB-LBPRGKRZSA-N 1 1 241.737 3.582 20 0 BHADMO Cc1cc(Cl)ccc1C[N@H+]1CCC[C@@H]1CF ZINC000339666682 178066456 /nfs/dbraw/zinc/06/64/56/178066456.db2.gz IQCHVOPDUJYUKB-CYBMUJFWSA-N 1 1 241.737 3.582 20 0 BHADMO Cc1cc(Cl)ccc1C[N@@H+]1CCC[C@@H]1CF ZINC000339666682 178066455 /nfs/dbraw/zinc/06/64/55/178066455.db2.gz IQCHVOPDUJYUKB-CYBMUJFWSA-N 1 1 241.737 3.582 20 0 BHADMO Cc1cc(Cl)ccc1C[N@H+]1CCC[C@H]1CF ZINC000339666683 178066760 /nfs/dbraw/zinc/06/67/60/178066760.db2.gz IQCHVOPDUJYUKB-ZDUSSCGKSA-N 1 1 241.737 3.582 20 0 BHADMO Cc1cc(Cl)ccc1C[N@@H+]1CCC[C@H]1CF ZINC000339666683 178066759 /nfs/dbraw/zinc/06/67/59/178066759.db2.gz IQCHVOPDUJYUKB-ZDUSSCGKSA-N 1 1 241.737 3.582 20 0 BHADMO FC[C@H]1CCC[N@H+]1Cc1csc2ccccc12 ZINC000339667536 386511162 /nfs/dbraw/zinc/51/11/62/386511162.db2.gz SNSNYKOHSVXCJH-GFCCVEGCSA-N 1 1 249.354 3.835 20 0 BHADMO FC[C@@H]1CCC[N@H+]1Cc1csc2ccccc12 ZINC000339667537 386512201 /nfs/dbraw/zinc/51/22/01/386512201.db2.gz SNSNYKOHSVXCJH-LBPRGKRZSA-N 1 1 249.354 3.835 20 0 BHADMO CCCc1[nH+]ccn1CCC(C)(C)CC ZINC000339689613 188368269 /nfs/dbraw/zinc/36/82/69/188368269.db2.gz RWBMVAWEIFVJIO-UHFFFAOYSA-N 1 1 208.349 3.662 20 0 BHADMO CCCc1[nH+]ccn1CCCSCC(C)C ZINC000339689907 188192426 /nfs/dbraw/zinc/19/24/26/188192426.db2.gz YPVDFWUSEROMEK-UHFFFAOYSA-N 1 1 240.416 3.615 20 0 BHADMO CCCc1[nH+]ccn1Cc1cc2ccccc2o1 ZINC000339690071 386519520 /nfs/dbraw/zinc/51/95/20/386519520.db2.gz CCHJJYXNHQVQJG-UHFFFAOYSA-N 1 1 240.306 3.630 20 0 BHADMO CC(C)[N@@H+](Cc1ccc(Cl)cc1)C1CC1 ZINC000339719646 386530672 /nfs/dbraw/zinc/53/06/72/386530672.db2.gz NFNOAORIMKSXNQ-UHFFFAOYSA-N 1 1 223.747 3.713 20 0 BHADMO Cc1ccncc1C[N@H+]1CCC[C@H]2CCCC[C@H]21 ZINC000339733797 386550929 /nfs/dbraw/zinc/55/09/29/386550929.db2.gz KUSJMJWTVICXAA-GDBMZVCRSA-N 1 1 244.382 3.545 20 0 BHADMO Cc1ccncc1C[N@H+]1CCC[C@@H]2CCCC[C@H]21 ZINC000339733798 386550646 /nfs/dbraw/zinc/55/06/46/386550646.db2.gz KUSJMJWTVICXAA-GOEBONIOSA-N 1 1 244.382 3.545 20 0 BHADMO Cc1ccncc1C[N@H+]1CCC[C@@H]2CCCC[C@@H]21 ZINC000339733799 386551021 /nfs/dbraw/zinc/55/10/21/386551021.db2.gz KUSJMJWTVICXAA-HOCLYGCPSA-N 1 1 244.382 3.545 20 0 BHADMO Cc1ccncc1C[N@H+]1CCC[C@H]2CCCC[C@@H]21 ZINC000339733800 386550362 /nfs/dbraw/zinc/55/03/62/386550362.db2.gz KUSJMJWTVICXAA-ZBFHGGJFSA-N 1 1 244.382 3.545 20 0 BHADMO Cc1cccc(C[N@H+]2CCC[C@H]3CCCC[C@H]32)n1 ZINC000339734746 179076820 /nfs/dbraw/zinc/07/68/20/179076820.db2.gz ZPNKLYVNTYCMSL-GDBMZVCRSA-N 1 1 244.382 3.545 20 0 BHADMO Cc1cccc(C[N@H+]2CCC[C@@H]3CCCC[C@H]32)n1 ZINC000339734747 179076046 /nfs/dbraw/zinc/07/60/46/179076046.db2.gz ZPNKLYVNTYCMSL-GOEBONIOSA-N 1 1 244.382 3.545 20 0 BHADMO Cc1cccc(C[N@H+]2CCC[C@@H]3CCCC[C@@H]32)n1 ZINC000339734748 179076517 /nfs/dbraw/zinc/07/65/17/179076517.db2.gz ZPNKLYVNTYCMSL-HOCLYGCPSA-N 1 1 244.382 3.545 20 0 BHADMO Cc1cccc(C[N@H+]2CCC[C@H]3CCCC[C@@H]32)n1 ZINC000339734749 179077147 /nfs/dbraw/zinc/07/71/47/179077147.db2.gz ZPNKLYVNTYCMSL-ZBFHGGJFSA-N 1 1 244.382 3.545 20 0 BHADMO CC[C@@H](Nc1cc(C)cc[nH+]1)c1c(C)noc1C ZINC000339787062 350832858 /nfs/dbraw/zinc/83/28/58/350832858.db2.gz WHBCNDONKCAELU-GFCCVEGCSA-N 1 1 245.326 3.558 20 0 BHADMO CC[C@H](Nc1cc(C)cc[nH+]1)c1c(C)noc1C ZINC000339787064 386632247 /nfs/dbraw/zinc/63/22/47/386632247.db2.gz WHBCNDONKCAELU-LBPRGKRZSA-N 1 1 245.326 3.558 20 0 BHADMO C[N@@H+](Cc1ccccc1C(F)(F)F)C1CCC1 ZINC000339863225 386716448 /nfs/dbraw/zinc/71/64/48/386716448.db2.gz RGMJAXCCXWBDCO-UHFFFAOYSA-N 1 1 243.272 3.690 20 0 BHADMO CC[N@@H+](Cc1cccc(Cl)c1)C1CCC1 ZINC000339864157 350848660 /nfs/dbraw/zinc/84/86/60/350848660.db2.gz ANJDRRWAJJNXAT-UHFFFAOYSA-N 1 1 223.747 3.714 20 0 BHADMO CC[N@@H+](Cc1ccccc1Cl)C1CCC1 ZINC000339864330 350848951 /nfs/dbraw/zinc/84/89/51/350848951.db2.gz CSUYSXFPEZPMOH-UHFFFAOYSA-N 1 1 223.747 3.714 20 0 BHADMO Fc1ccc(C[N@@H+](CC2CC2)C2CCC2)cc1 ZINC000339868851 386726782 /nfs/dbraw/zinc/72/67/82/386726782.db2.gz ZSQUNMHKDPSLJH-UHFFFAOYSA-N 1 1 233.330 3.590 20 0 BHADMO CC(C)CSCC[N@@H+](C)Cc1ccccc1 ZINC000340158995 187344070 /nfs/dbraw/zinc/34/40/70/187344070.db2.gz RBKKBKVESRFQEH-UHFFFAOYSA-N 1 1 237.412 3.508 20 0 BHADMO Cc1cccc(C[N@@H+]2CC=C(C(C)(C)C)CC2)n1 ZINC000340187834 179074042 /nfs/dbraw/zinc/07/40/42/179074042.db2.gz CSHUGPJSBQMNNJ-UHFFFAOYSA-N 1 1 244.382 3.568 20 0 BHADMO C[C@H](c1cccnc1)[N@@H+]1CC=C(C(C)(C)C)CC1 ZINC000340187976 177044408 /nfs/dbraw/zinc/04/44/08/177044408.db2.gz BOKBTDLPGFLENJ-CYBMUJFWSA-N 1 1 244.382 3.821 20 0 BHADMO C[C@@H](c1cccnc1)[N@@H+]1CC=C(C(C)(C)C)CC1 ZINC000340187978 176028562 /nfs/dbraw/zinc/02/85/62/176028562.db2.gz BOKBTDLPGFLENJ-ZDUSSCGKSA-N 1 1 244.382 3.821 20 0 BHADMO Cc1ccncc1C[N@@H+]1CC=C(C(C)(C)C)CC1 ZINC000340188139 385845617 /nfs/dbraw/zinc/84/56/17/385845617.db2.gz GXLMWQKZLHIKOV-UHFFFAOYSA-N 1 1 244.382 3.568 20 0 BHADMO C[C@H](c1ccccn1)[N@@H+]1CC=C(C(C)(C)C)CC1 ZINC000340191239 177043870 /nfs/dbraw/zinc/04/38/70/177043870.db2.gz OZQWYIHDNVAXOA-CYBMUJFWSA-N 1 1 244.382 3.821 20 0 BHADMO C[C@@H](c1ccccn1)[N@@H+]1CC=C(C(C)(C)C)CC1 ZINC000340191240 176028348 /nfs/dbraw/zinc/02/83/48/176028348.db2.gz OZQWYIHDNVAXOA-ZDUSSCGKSA-N 1 1 244.382 3.821 20 0 BHADMO Cc1ccc(C[N@@H+]2CC=C(C(C)(C)C)CC2)nc1 ZINC000340191688 385868244 /nfs/dbraw/zinc/86/82/44/385868244.db2.gz UGXUILUZSIIXDT-UHFFFAOYSA-N 1 1 244.382 3.568 20 0 BHADMO CC[N@@H+](Cc1ccc(F)c2cccnc12)C(C)C ZINC000340212880 352057393 /nfs/dbraw/zinc/05/73/93/352057393.db2.gz ALHDNFDZUPSLJT-UHFFFAOYSA-N 1 1 246.329 3.604 20 0 BHADMO Cc1cc(C)c(C[N@@H+](C)Cc2ccoc2)c(C)c1 ZINC000340213574 352058569 /nfs/dbraw/zinc/05/85/69/352058569.db2.gz AYFAEFIAHLVXEF-UHFFFAOYSA-N 1 1 243.350 3.837 20 0 BHADMO Cc1ccc(C[N@H+]2CCCC23CCCCC3)nc1 ZINC000340235623 386055245 /nfs/dbraw/zinc/05/52/45/386055245.db2.gz IZPHIQFZNYMJAT-UHFFFAOYSA-N 1 1 244.382 3.689 20 0 BHADMO Cc1cccc(C[N@H+]2CCCC23CCCCC3)n1 ZINC000340237887 179074066 /nfs/dbraw/zinc/07/40/66/179074066.db2.gz UDUGYGDDNINOGH-UHFFFAOYSA-N 1 1 244.382 3.689 20 0 BHADMO Cc1ccncc1C[N@H+]1CCCC12CCCCC2 ZINC000340239805 386069767 /nfs/dbraw/zinc/06/97/67/386069767.db2.gz RCIYMFLSXNOSAW-UHFFFAOYSA-N 1 1 244.382 3.689 20 0 BHADMO C[N@@H+](CC1(C)CCC1)[C@H]1CCc2ccccc21 ZINC000340275643 172640064 /nfs/dbraw/zinc/64/00/64/172640064.db2.gz BSWCTFOGYGLFRR-HNNXBMFYSA-N 1 1 229.367 3.796 20 0 BHADMO C[N@@H+](CC1(C)CCC1)[C@@H]1CCc2ccccc21 ZINC000340275646 386185980 /nfs/dbraw/zinc/18/59/80/386185980.db2.gz BSWCTFOGYGLFRR-OAHLLOKOSA-N 1 1 229.367 3.796 20 0 BHADMO CC[N@@H+](CC1(C)CCC1)[C@H](C)c1cccc(O)c1 ZINC000340276801 386188428 /nfs/dbraw/zinc/18/84/28/386188428.db2.gz AOVKPBLFCBAJBW-CYBMUJFWSA-N 1 1 247.382 3.965 20 0 BHADMO CC[N@@H+](CC1(C)CCC1)[C@@H](C)c1cccc(O)c1 ZINC000340276802 386187740 /nfs/dbraw/zinc/18/77/40/386187740.db2.gz AOVKPBLFCBAJBW-ZDUSSCGKSA-N 1 1 247.382 3.965 20 0 BHADMO C[N@H+](Cc1ccccc1)C[C@@H]1CCC(F)(F)C1 ZINC000340281096 386198566 /nfs/dbraw/zinc/19/85/66/386198566.db2.gz VFEVCIJINZXCJO-CYBMUJFWSA-N 1 1 239.309 3.554 20 0 BHADMO C[N@H+](Cc1ccccc1)C[C@H]1CCC(F)(F)C1 ZINC000340281113 386198398 /nfs/dbraw/zinc/19/83/98/386198398.db2.gz VFEVCIJINZXCJO-ZDUSSCGKSA-N 1 1 239.309 3.554 20 0 BHADMO C[C@@H]([N@@H+](C)C[C@@H]1CCC(F)(F)C1)C1(C)CC1 ZINC000340283300 386195257 /nfs/dbraw/zinc/19/52/57/386195257.db2.gz YXVBVYXHLIDJRX-GHMZBOCLSA-N 1 1 231.330 3.542 20 0 BHADMO C[C@@H]([N@@H+](C)C[C@H]1CCC(F)(F)C1)C1(C)CC1 ZINC000340283304 386198460 /nfs/dbraw/zinc/19/84/60/386198460.db2.gz YXVBVYXHLIDJRX-MNOVXSKESA-N 1 1 231.330 3.542 20 0 BHADMO C[C@H]([N@@H+](C)C[C@H]1CCC(F)(F)C1)C1(C)CC1 ZINC000340283306 386198425 /nfs/dbraw/zinc/19/84/25/386198425.db2.gz YXVBVYXHLIDJRX-QWRGUYRKSA-N 1 1 231.330 3.542 20 0 BHADMO C[C@H]([N@@H+](C)C[C@@H]1CCC(F)(F)C1)C1(C)CC1 ZINC000340283308 386198102 /nfs/dbraw/zinc/19/81/02/386198102.db2.gz YXVBVYXHLIDJRX-WDEREUQCSA-N 1 1 231.330 3.542 20 0 BHADMO C[N@@H+](Cc1ccc(F)c(F)c1)CC1(C)CCC1 ZINC000340284649 172850880 /nfs/dbraw/zinc/85/08/80/172850880.db2.gz QNVXAJZBHVCSRL-UHFFFAOYSA-N 1 1 239.309 3.587 20 0 BHADMO CC1(C[N@H+]2CCS[C@@H]3CCCC[C@H]32)CCC1 ZINC000340284843 168026960 /nfs/dbraw/zinc/02/69/60/168026960.db2.gz BRQOFUWVYXOCHC-CHWSQXEVSA-N 1 1 239.428 3.537 20 0 BHADMO CC1(C[N@H+]2CCS[C@H]3CCCC[C@H]32)CCC1 ZINC000340284860 168026465 /nfs/dbraw/zinc/02/64/65/168026465.db2.gz BRQOFUWVYXOCHC-OLZOCXBDSA-N 1 1 239.428 3.537 20 0 BHADMO CC1(C[N@H+]2CCS[C@@H]3CCCC[C@@H]32)CCC1 ZINC000340284863 168026541 /nfs/dbraw/zinc/02/65/41/168026541.db2.gz BRQOFUWVYXOCHC-QWHCGFSZSA-N 1 1 239.428 3.537 20 0 BHADMO CC1(C[N@H+]2CCS[C@H]3CCCC[C@@H]32)CCC1 ZINC000340284867 168027188 /nfs/dbraw/zinc/02/71/88/168027188.db2.gz BRQOFUWVYXOCHC-STQMWFEESA-N 1 1 239.428 3.537 20 0 BHADMO C[C@H](c1cccc(O)c1)[N@@H+](C)CC1(C)CCC1 ZINC000340287646 177036475 /nfs/dbraw/zinc/03/64/75/177036475.db2.gz WQCSTSOIOJGLCR-GFCCVEGCSA-N 1 1 233.355 3.575 20 0 BHADMO C[C@@H](c1cccc(O)c1)[N@@H+](C)CC1(C)CCC1 ZINC000340287647 176018132 /nfs/dbraw/zinc/01/81/32/176018132.db2.gz WQCSTSOIOJGLCR-LBPRGKRZSA-N 1 1 233.355 3.575 20 0 BHADMO CC1(C[N@@H+](Cc2cccs2)C2CC2)CCC1 ZINC000340287819 168024384 /nfs/dbraw/zinc/02/43/84/168024384.db2.gz MGBQEULRHJPUTM-UHFFFAOYSA-N 1 1 235.396 3.903 20 0 BHADMO C[C@H](c1cccs1)[N@@H+](C)CC1(C)CCC1 ZINC000340289772 177048422 /nfs/dbraw/zinc/04/84/22/177048422.db2.gz QOUBCYZOYVNDCU-LLVKDONJSA-N 1 1 223.385 3.931 20 0 BHADMO C[C@@H](c1cccs1)[N@@H+](C)CC1(C)CCC1 ZINC000340289778 176033362 /nfs/dbraw/zinc/03/33/62/176033362.db2.gz QOUBCYZOYVNDCU-NSHDSACASA-N 1 1 223.385 3.931 20 0 BHADMO CC[N@@H+](Cc1cccs1)CC1(C)CCC1 ZINC000340289993 352157367 /nfs/dbraw/zinc/15/73/67/352157367.db2.gz LZCUOYJUSNACMH-UHFFFAOYSA-N 1 1 223.385 3.760 20 0 BHADMO C[C@H](c1ccco1)[N@@H+](C)C[C@@H]1CCC(F)(F)C1 ZINC000340291435 177047863 /nfs/dbraw/zinc/04/78/63/177047863.db2.gz QDBJPVROZGSZHT-GHMZBOCLSA-N 1 1 243.297 3.708 20 0 BHADMO C[C@H](c1ccco1)[N@@H+](C)C[C@H]1CCC(F)(F)C1 ZINC000340291449 177048134 /nfs/dbraw/zinc/04/81/34/177048134.db2.gz QDBJPVROZGSZHT-MNOVXSKESA-N 1 1 243.297 3.708 20 0 BHADMO C[C@@H](c1ccco1)[N@@H+](C)C[C@H]1CCC(F)(F)C1 ZINC000340291453 176031020 /nfs/dbraw/zinc/03/10/20/176031020.db2.gz QDBJPVROZGSZHT-QWRGUYRKSA-N 1 1 243.297 3.708 20 0 BHADMO C[C@@H](c1ccco1)[N@@H+](C)C[C@@H]1CCC(F)(F)C1 ZINC000340291455 176031296 /nfs/dbraw/zinc/03/12/96/176031296.db2.gz QDBJPVROZGSZHT-WDEREUQCSA-N 1 1 243.297 3.708 20 0 BHADMO COc1ccc(C[N@@H+](C)CC2(C)CCC2)cc1C ZINC000340291458 386224964 /nfs/dbraw/zinc/22/49/64/386224964.db2.gz WKJDKOHGCOVKTR-UHFFFAOYSA-N 1 1 247.382 3.626 20 0 BHADMO CCSCC[C@@H](C)[N@@H+](C)CC1(C)CCC1 ZINC000340292352 386225122 /nfs/dbraw/zinc/22/51/22/386225122.db2.gz UEDHGCYFIPQKDH-GFCCVEGCSA-N 1 1 229.433 3.640 20 0 BHADMO CCSCC[C@H](C)[N@@H+](C)CC1(C)CCC1 ZINC000340292367 398083929 /nfs/dbraw/zinc/08/39/29/398083929.db2.gz UEDHGCYFIPQKDH-LBPRGKRZSA-N 1 1 229.433 3.640 20 0 BHADMO C[C@H]([NH2+][C@@H]1CCC[C@H]1F)c1cccc(F)c1F ZINC000340524360 386121061 /nfs/dbraw/zinc/12/10/61/386121061.db2.gz QLVDTFVWMHRJJK-MKPLZMMCSA-N 1 1 243.272 3.506 20 0 BHADMO C[C@H]([NH2+][C@H]1CCC[C@@H]1F)c1cccc(F)c1F 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/nfs/dbraw/zinc/86/38/05/386863805.db2.gz KBNNIMGMBPTMFF-AATRIKPKSA-N 1 1 232.371 3.648 20 0 BHADMO CC/C=C\CC[N@@H+](Cc1cccnc1)C(C)C ZINC000341294271 386864255 /nfs/dbraw/zinc/86/42/55/386864255.db2.gz KBNNIMGMBPTMFF-WAYWQWQTSA-N 1 1 232.371 3.648 20 0 BHADMO CC/C=C\CC[N@@H+](C)Cc1nc2ccccc2o1 ZINC000341315386 386893351 /nfs/dbraw/zinc/89/33/51/386893351.db2.gz HXVMDQJNUFWOQR-PLNGDYQASA-N 1 1 244.338 3.616 20 0 BHADMO CC/C=C\CC[N@@H+](C)Cc1cccc(N(C)C)c1 ZINC000341318458 386878784 /nfs/dbraw/zinc/87/87/84/386878784.db2.gz MGPSADKERKGDIX-SREVYHEPSA-N 1 1 246.398 3.541 20 0 BHADMO CC/C=C/CC[N@@H+](C)Cc1cccc(N(C)C)c1 ZINC000341318461 386878740 /nfs/dbraw/zinc/87/87/40/386878740.db2.gz MGPSADKERKGDIX-VOTSOKGWSA-N 1 1 246.398 3.541 20 0 BHADMO CC/C=C\CC[N@H+]1CCCC[C@@H](SC)C1 ZINC000341320417 386879931 /nfs/dbraw/zinc/87/99/31/386879931.db2.gz PISMGFFBBWWWPW-DSYXLKISSA-N 1 1 227.417 3.560 20 0 BHADMO CC/C=C/CC[N@H+]1CCCC[C@H](SC)C1 ZINC000341320428 386878390 /nfs/dbraw/zinc/87/83/90/386878390.db2.gz PISMGFFBBWWWPW-IHVVCDCBSA-N 1 1 227.417 3.560 20 0 BHADMO CC/C=C/CC[N@H+]1CCCC[C@@H](SC)C1 ZINC000341320437 386879376 /nfs/dbraw/zinc/87/93/76/386879376.db2.gz PISMGFFBBWWWPW-MUBLQREKSA-N 1 1 227.417 3.560 20 0 BHADMO CC/C=C\CC[N@H+]1CCCC[C@H](SC)C1 ZINC000341320441 386879841 /nfs/dbraw/zinc/87/98/41/386879841.db2.gz PISMGFFBBWWWPW-ZFDPJTLLSA-N 1 1 227.417 3.560 20 0 BHADMO CCC[C@H]1CCC[N@H+]([C@@H](C)c2cccnc2)C1 ZINC000341540700 386923100 /nfs/dbraw/zinc/92/31/00/386923100.db2.gz DLYYKMZJXZRKNQ-KBPBESRZSA-N 1 1 232.371 3.655 20 0 BHADMO CCC[C@H]1CCC[N@H+]([C@H](C)c2cccnc2)C1 ZINC000341540703 386923498 /nfs/dbraw/zinc/92/34/98/386923498.db2.gz DLYYKMZJXZRKNQ-KGLIPLIRSA-N 1 1 232.371 3.655 20 0 BHADMO CCC[C@@H]1CCC[N@H+]([C@@H](C)c2cccnc2)C1 ZINC000341540705 386922939 /nfs/dbraw/zinc/92/29/39/386922939.db2.gz DLYYKMZJXZRKNQ-UONOGXRCSA-N 1 1 232.371 3.655 20 0 BHADMO CCC[C@@H]1CCC[N@H+]([C@H](C)c2cccnc2)C1 ZINC000341540707 386922440 /nfs/dbraw/zinc/92/24/40/386922440.db2.gz DLYYKMZJXZRKNQ-ZIAGYGMSSA-N 1 1 232.371 3.655 20 0 BHADMO Cc1ccc(C[N@H+](C)Cc2ccccc2F)s1 ZINC000341572223 386918164 /nfs/dbraw/zinc/91/81/64/386918164.db2.gz GXSNRKVOCATGLP-UHFFFAOYSA-N 1 1 249.354 3.828 20 0 BHADMO Cc1ccc(C[N@@H+](C)Cc2ccccc2F)s1 ZINC000341572223 386918160 /nfs/dbraw/zinc/91/81/60/386918160.db2.gz GXSNRKVOCATGLP-UHFFFAOYSA-N 1 1 249.354 3.828 20 0 BHADMO C[N@@H+](CCCSCc1ccccc1)C1CCC1 ZINC000341573699 386939192 /nfs/dbraw/zinc/93/91/92/386939192.db2.gz JFLKRHPJYLLPIA-UHFFFAOYSA-N 1 1 249.423 3.794 20 0 BHADMO Cc1ccc(C[N@H+](C)Cc2cccc(F)c2)s1 ZINC000341577836 386925975 /nfs/dbraw/zinc/92/59/75/386925975.db2.gz OIMHPNORPWDNGV-UHFFFAOYSA-N 1 1 249.354 3.828 20 0 BHADMO C[C@H]1CCC[N@H+]1CCCSCc1ccccc1 ZINC000341598402 177109527 /nfs/dbraw/zinc/10/95/27/177109527.db2.gz YLNAWZIKCNUYQJ-AWEZNQCLSA-N 1 1 249.423 3.794 20 0 BHADMO C[C@@H]1CCC[N@H+]1CCCSCc1ccccc1 ZINC000341598407 176109402 /nfs/dbraw/zinc/10/94/02/176109402.db2.gz YLNAWZIKCNUYQJ-CQSZACIVSA-N 1 1 249.423 3.794 20 0 BHADMO CC[N@@H+](CCCSCc1ccccc1)C1CC1 ZINC000341603655 386931979 /nfs/dbraw/zinc/93/19/79/386931979.db2.gz OBNPPLRFNJUCCO-UHFFFAOYSA-N 1 1 249.423 3.794 20 0 BHADMO CC[C@H](C)[N@H+]1CCC[C@@]2(CC=CCC2)C1 ZINC000341662086 171317336 /nfs/dbraw/zinc/31/73/36/171317336.db2.gz SUIYGYPUHNWFFF-KBPBESRZSA-N 1 1 207.361 3.607 20 0 BHADMO CC[C@@H](C)[N@H+]1CCC[C@@]2(CC=CCC2)C1 ZINC000341662088 386940473 /nfs/dbraw/zinc/94/04/73/386940473.db2.gz SUIYGYPUHNWFFF-KGLIPLIRSA-N 1 1 207.361 3.607 20 0 BHADMO CC[C@H](C)[N@H+]1CCC[C@]2(CC=CCC2)C1 ZINC000341662089 171317819 /nfs/dbraw/zinc/31/78/19/171317819.db2.gz SUIYGYPUHNWFFF-UONOGXRCSA-N 1 1 207.361 3.607 20 0 BHADMO CC[C@@H](C)[N@H+]1CCC[C@]2(CC=CCC2)C1 ZINC000341662090 386939047 /nfs/dbraw/zinc/93/90/47/386939047.db2.gz SUIYGYPUHNWFFF-ZIAGYGMSSA-N 1 1 207.361 3.607 20 0 BHADMO Cc1ccc(F)c([C@H](C)[C@H](C)c2[nH+]ccn2C)c1 ZINC000341796475 386963531 /nfs/dbraw/zinc/96/35/31/386963531.db2.gz CODWIILUPVMWOX-NEPJUHHUSA-N 1 1 246.329 3.775 20 0 BHADMO Cc1ccc(F)c([C@@H](C)[C@@H](C)c2[nH+]ccn2C)c1 ZINC000341796476 386962958 /nfs/dbraw/zinc/96/29/58/386962958.db2.gz CODWIILUPVMWOX-NWDGAFQWSA-N 1 1 246.329 3.775 20 0 BHADMO Cc1ccc(F)c([C@@H](C)[C@H](C)c2[nH+]ccn2C)c1 ZINC000341796477 386964640 /nfs/dbraw/zinc/96/46/40/386964640.db2.gz CODWIILUPVMWOX-RYUDHWBXSA-N 1 1 246.329 3.775 20 0 BHADMO Cc1ccc(F)c([C@H](C)[C@@H](C)c2[nH+]ccn2C)c1 ZINC000341796478 386964117 /nfs/dbraw/zinc/96/41/17/386964117.db2.gz CODWIILUPVMWOX-VXGBXAGGSA-N 1 1 246.329 3.775 20 0 BHADMO CC(C)[C@@H](C)[N@@H+](C)Cc1cccc2cccnc21 ZINC000341806357 167369413 /nfs/dbraw/zinc/36/94/13/167369413.db2.gz GWILTQVKMSZMEM-CYBMUJFWSA-N 1 1 242.366 3.711 20 0 BHADMO CC(C)[C@H](C)[N@@H+](C)Cc1cccc2cccnc21 ZINC000341806359 386970629 /nfs/dbraw/zinc/97/06/29/386970629.db2.gz GWILTQVKMSZMEM-ZDUSSCGKSA-N 1 1 242.366 3.711 20 0 BHADMO CC(C)[C@@H](C)[N@@H+](C)Cc1nc2ccccc2s1 ZINC000341811703 167368567 /nfs/dbraw/zinc/36/85/67/167368567.db2.gz VSJXRLKCKBNSHS-LLVKDONJSA-N 1 1 248.395 3.773 20 0 BHADMO CC(C)[C@H](C)[N@@H+](C)Cc1nc2ccccc2s1 ZINC000341811704 386974260 /nfs/dbraw/zinc/97/42/60/386974260.db2.gz VSJXRLKCKBNSHS-NSHDSACASA-N 1 1 248.395 3.773 20 0 BHADMO C[N@@H+](CCCCCF)Cc1ccc(F)c(F)c1 ZINC000341829228 386968657 /nfs/dbraw/zinc/96/86/57/386968657.db2.gz AARXXYLOJAKJJD-UHFFFAOYSA-N 1 1 245.288 3.536 20 0 BHADMO FCCCCC[N@@H+](Cc1ccccc1)C1CC1 ZINC000341829807 386969061 /nfs/dbraw/zinc/96/90/61/386969061.db2.gz DKYGEHJHPAUOBE-UHFFFAOYSA-N 1 1 235.346 3.791 20 0 BHADMO C[N@@H+](CCCCCF)Cc1ccc(F)cc1F ZINC000341829825 386969253 /nfs/dbraw/zinc/96/92/53/386969253.db2.gz DUTKLJCQBRSJPG-UHFFFAOYSA-N 1 1 245.288 3.536 20 0 BHADMO Cc1ccccc1C[N@@H+](C)CCCCCF ZINC000341831334 179269602 /nfs/dbraw/zinc/26/96/02/179269602.db2.gz IPDQTUAKNQRIAM-UHFFFAOYSA-N 1 1 223.335 3.567 20 0 BHADMO CC[N@@H+](CCCCCF)Cc1cccs1 ZINC000341833503 386970672 /nfs/dbraw/zinc/97/06/72/386970672.db2.gz DQNWLSJVJODJFE-UHFFFAOYSA-N 1 1 229.364 3.710 20 0 BHADMO CC1CCC([N@@H+](C)CCCCCF)CC1 ZINC000341833710 168157742 /nfs/dbraw/zinc/15/77/42/168157742.db2.gz PMEVUKKFBUIXBC-UHFFFAOYSA-N 1 1 215.356 3.637 20 0 BHADMO Cc1cc([C@H]2CCC[N@H+]2CCC(C)(C)C)on1 ZINC000341834308 178266799 /nfs/dbraw/zinc/26/67/99/178266799.db2.gz RXBXEJGMIHVRML-GFCCVEGCSA-N 1 1 236.359 3.556 20 0 BHADMO Cc1cc([C@@H]2CCC[N@H+]2CCC(C)(C)C)on1 ZINC000341834310 178240735 /nfs/dbraw/zinc/24/07/35/178240735.db2.gz RXBXEJGMIHVRML-LBPRGKRZSA-N 1 1 236.359 3.556 20 0 BHADMO FCCCCC[N@@H+](Cc1cccs1)C1CC1 ZINC000341835106 386970984 /nfs/dbraw/zinc/97/09/84/386970984.db2.gz LJUDYOXTQFNNHP-UHFFFAOYSA-N 1 1 241.375 3.852 20 0 BHADMO Cc1ccsc1C[N@@H+](C)CCCCCF ZINC000341835752 386972347 /nfs/dbraw/zinc/97/23/47/386972347.db2.gz PNKWZGGGDVMAQX-UHFFFAOYSA-N 1 1 229.364 3.628 20 0 BHADMO Cc1cc(C[N@H+](C)[C@H](C)C(C)C)c(C)s1 ZINC000341835956 386972561 /nfs/dbraw/zinc/97/25/61/386972561.db2.gz LBLPHXOQQCIFRO-LLVKDONJSA-N 1 1 225.401 3.841 20 0 BHADMO Cc1cc(C[N@H+](C)[C@@H](C)C(C)C)c(C)s1 ZINC000341835959 386972022 /nfs/dbraw/zinc/97/20/22/386972022.db2.gz LBLPHXOQQCIFRO-NSHDSACASA-N 1 1 225.401 3.841 20 0 BHADMO CC[N@@H+](CCCCCF)Cc1ccccc1 ZINC000341837444 386977452 /nfs/dbraw/zinc/97/74/52/386977452.db2.gz VLNHNSCCMAVURM-UHFFFAOYSA-N 1 1 223.335 3.648 20 0 BHADMO Cc1cc(C[N@H+](C(C)C)C2CCCCC2)on1 ZINC000341841262 386976650 /nfs/dbraw/zinc/97/66/50/386976650.db2.gz RDKRPMROTRNFAN-UHFFFAOYSA-N 1 1 236.359 3.526 20 0 BHADMO C[C@@H]1Cc2ccccc2C[N@H+]1CCCCCF ZINC000341874009 386981362 /nfs/dbraw/zinc/98/13/62/386981362.db2.gz IBGVARFLSNZQMG-CYBMUJFWSA-N 1 1 235.346 3.573 20 0 BHADMO C[C@H]1Cc2ccccc2C[N@H+]1CCCCCF ZINC000341874010 177389722 /nfs/dbraw/zinc/38/97/22/177389722.db2.gz IBGVARFLSNZQMG-ZDUSSCGKSA-N 1 1 235.346 3.573 20 0 BHADMO CCS[C@@H]1CC[C@@H]([N@@H+](C)CCCCCF)C1 ZINC000341875600 386983029 /nfs/dbraw/zinc/98/30/29/386983029.db2.gz WWMRFGHRYJJQNE-CHWSQXEVSA-N 1 1 247.423 3.732 20 0 BHADMO CCS[C@H]1CC[C@@H]([N@@H+](C)CCCCCF)C1 ZINC000341875606 386982157 /nfs/dbraw/zinc/98/21/57/386982157.db2.gz WWMRFGHRYJJQNE-OLZOCXBDSA-N 1 1 247.423 3.732 20 0 BHADMO CCS[C@@H]1CC[C@H]([N@@H+](C)CCCCCF)C1 ZINC000341875607 386982592 /nfs/dbraw/zinc/98/25/92/386982592.db2.gz WWMRFGHRYJJQNE-QWHCGFSZSA-N 1 1 247.423 3.732 20 0 BHADMO CCS[C@H]1CC[C@H]([N@@H+](C)CCCCCF)C1 ZINC000341875609 386982390 /nfs/dbraw/zinc/98/23/90/386982390.db2.gz WWMRFGHRYJJQNE-STQMWFEESA-N 1 1 247.423 3.732 20 0 BHADMO Cc1ccc(C[N@@H+](C)CCCCCF)s1 ZINC000341878429 187356267 /nfs/dbraw/zinc/35/62/67/187356267.db2.gz UKEXICPPMALWLF-UHFFFAOYSA-N 1 1 229.364 3.628 20 0 BHADMO FCCCCC[N@H+]1CC[C@H]1c1ccccc1 ZINC000341880033 386985694 /nfs/dbraw/zinc/98/56/94/386985694.db2.gz ZCIYRGRJKPSIPM-AWEZNQCLSA-N 1 1 221.319 3.573 20 0 BHADMO FCCCCC[N@H+]1CC[C@@H]1c1ccccc1 ZINC000341880034 386985656 /nfs/dbraw/zinc/98/56/56/386985656.db2.gz ZCIYRGRJKPSIPM-CQSZACIVSA-N 1 1 221.319 3.573 20 0 BHADMO CCS[C@@H]1CCCC[N@@H+](CCCCCF)C1 ZINC000341890800 386983578 /nfs/dbraw/zinc/98/35/78/386983578.db2.gz MVMLFCAPSUZBDP-CYBMUJFWSA-N 1 1 247.423 3.734 20 0 BHADMO CCS[C@H]1CCCC[N@@H+](CCCCCF)C1 ZINC000341890803 386983658 /nfs/dbraw/zinc/98/36/58/386983658.db2.gz MVMLFCAPSUZBDP-ZDUSSCGKSA-N 1 1 247.423 3.734 20 0 BHADMO C[C@@H]1c2ccccc2C[N@@H+]1CCCCCF ZINC000341893717 386995462 /nfs/dbraw/zinc/99/54/62/386995462.db2.gz SICGAAJYOFPZRV-GFCCVEGCSA-N 1 1 221.319 3.703 20 0 BHADMO C[C@H]1c2ccccc2C[N@@H+]1CCCCCF ZINC000341893718 386994643 /nfs/dbraw/zinc/99/46/43/386994643.db2.gz SICGAAJYOFPZRV-LBPRGKRZSA-N 1 1 221.319 3.703 20 0 BHADMO C[C@@H]1CC[N@@H+](CCCCCF)CC12CCC2 ZINC000341902588 176168319 /nfs/dbraw/zinc/16/83/19/176168319.db2.gz FUHMRXQDSJYRQN-CYBMUJFWSA-N 1 1 227.367 3.638 20 0 BHADMO C[C@H]1CC[N@@H+](CCCCCF)CC12CCC2 ZINC000341902589 177160342 /nfs/dbraw/zinc/16/03/42/177160342.db2.gz FUHMRXQDSJYRQN-ZDUSSCGKSA-N 1 1 227.367 3.638 20 0 BHADMO FCCCCC[N@H+]1Cc2ccccc2C2(CC2)C1 ZINC000341902669 386987177 /nfs/dbraw/zinc/98/71/77/386987177.db2.gz AWULEEOQCGJTDZ-UHFFFAOYSA-N 1 1 247.357 3.674 20 0 BHADMO C[C@H]1CC[C@]2(CC[N@@H+](CCCCCF)C2)C1 ZINC000341908634 177208050 /nfs/dbraw/zinc/20/80/50/177208050.db2.gz MMEZHZDYVDDCJJ-KBPBESRZSA-N 1 1 227.367 3.638 20 0 BHADMO C[C@@H]1CC[C@]2(CC[N@@H+](CCCCCF)C2)C1 ZINC000341908635 176238140 /nfs/dbraw/zinc/23/81/40/176238140.db2.gz MMEZHZDYVDDCJJ-KGLIPLIRSA-N 1 1 227.367 3.638 20 0 BHADMO C[C@H]1CC[C@@]2(CC[N@@H+](CCCCCF)C2)C1 ZINC000341908636 177196686 /nfs/dbraw/zinc/19/66/86/177196686.db2.gz MMEZHZDYVDDCJJ-UONOGXRCSA-N 1 1 227.367 3.638 20 0 BHADMO C[C@@H]1CC[C@@]2(CC[N@@H+](CCCCCF)C2)C1 ZINC000341908637 176218835 /nfs/dbraw/zinc/21/88/35/176218835.db2.gz MMEZHZDYVDDCJJ-ZIAGYGMSSA-N 1 1 227.367 3.638 20 0 BHADMO CCSCC[C@@H](C)[N@@H+](C)CCCCCF ZINC000341909198 386990862 /nfs/dbraw/zinc/99/08/62/386990862.db2.gz OLJNFKFDBQOOMY-GFCCVEGCSA-N 1 1 235.412 3.590 20 0 BHADMO CCSCC[C@H](C)[N@@H+](C)CCCCCF ZINC000341909199 386990551 /nfs/dbraw/zinc/99/05/51/386990551.db2.gz OLJNFKFDBQOOMY-LBPRGKRZSA-N 1 1 235.412 3.590 20 0 BHADMO Cc1nc(CNc2[nH+]cccc2C(C)C)cs1 ZINC000341950454 387002670 /nfs/dbraw/zinc/00/26/70/387002670.db2.gz OBJYELAZWYNGLY-UHFFFAOYSA-N 1 1 247.367 3.582 20 0 BHADMO Cc1ccoc1CNc1[nH+]cccc1C(C)C ZINC000341956509 387008676 /nfs/dbraw/zinc/00/86/76/387008676.db2.gz XPAOYXJUWYSCFV-UHFFFAOYSA-N 1 1 230.311 3.719 20 0 BHADMO CC(C)c1ccc[nH+]c1NCc1cccc(F)c1 ZINC000341956555 387008212 /nfs/dbraw/zinc/00/82/12/387008212.db2.gz YDXOZHXBFHOYPJ-UHFFFAOYSA-N 1 1 244.313 3.956 20 0 BHADMO CCc1ccc(CNc2[nH+]cccc2C(C)C)o1 ZINC000341957425 387007520 /nfs/dbraw/zinc/00/75/20/387007520.db2.gz YHVZRNRYFSZNRX-UHFFFAOYSA-N 1 1 244.338 3.973 20 0 BHADMO Cc1ccc(CNc2[nH+]cccc2C(C)C)o1 ZINC000341957482 387008410 /nfs/dbraw/zinc/00/84/10/387008410.db2.gz YNUCURZQFSRPEO-UHFFFAOYSA-N 1 1 230.311 3.719 20 0 BHADMO c1ccc(C2=CCC[N@H+](CC3CCC3)C2)cc1 ZINC000341971744 387010093 /nfs/dbraw/zinc/01/00/93/387010093.db2.gz FCXMGIATHAOMIF-UHFFFAOYSA-N 1 1 227.351 3.576 20 0 BHADMO CC(C)c1ccc[nH+]c1NCc1ccccc1 ZINC000341972101 387009905 /nfs/dbraw/zinc/00/99/05/387009905.db2.gz RGNJJFGVVZNBKW-UHFFFAOYSA-N 1 1 226.323 3.817 20 0 BHADMO Cc1ncsc1CNc1[nH+]cccc1C(C)C ZINC000341978050 180323301 /nfs/dbraw/zinc/32/33/01/180323301.db2.gz BTFJWKSQINCLPC-UHFFFAOYSA-N 1 1 247.367 3.582 20 0 BHADMO CC(C)c1ccc[nH+]c1NCc1ccccc1F ZINC000341981439 582747878 /nfs/dbraw/zinc/74/78/78/582747878.db2.gz IHUMJGQBAXACAF-UHFFFAOYSA-N 1 1 244.313 3.956 20 0 BHADMO CSCCC[N@H+]1CCC=C(c2ccccc2)C1 ZINC000341983720 411504097 /nfs/dbraw/zinc/50/40/97/411504097.db2.gz UTHLQBDNWPZVDX-UHFFFAOYSA-N 1 1 247.407 3.529 20 0 BHADMO Cc1ccc(CNc2[nH+]cccc2C(C)C)cn1 ZINC000341987889 566430693 /nfs/dbraw/zinc/43/06/93/566430693.db2.gz XLWWOHPEKGRDCX-UHFFFAOYSA-N 1 1 241.338 3.521 20 0 BHADMO CC[N@@H+](Cc1ncc(Cl)s1)C1CCCC1 ZINC000341992639 352736750 /nfs/dbraw/zinc/73/67/50/352736750.db2.gz NVDHGWBFSDAVRK-UHFFFAOYSA-N 1 1 244.791 3.561 20 0 BHADMO CCSCC[N@H+]1CCC=C(c2ccccc2)C1 ZINC000341992898 385914621 /nfs/dbraw/zinc/91/46/21/385914621.db2.gz QRVVCINTQNIPQG-UHFFFAOYSA-N 1 1 247.407 3.529 20 0 BHADMO CC[C@H](F)C[N@H+]1CCC=C(c2ccccc2)C1 ZINC000342001104 387014050 /nfs/dbraw/zinc/01/40/50/387014050.db2.gz ZAUJRFAFFYEUGD-HNNXBMFYSA-N 1 1 233.330 3.524 20 0 BHADMO CC[C@@H](F)C[N@H+]1CCC=C(c2ccccc2)C1 ZINC000342001106 387013630 /nfs/dbraw/zinc/01/36/30/387013630.db2.gz ZAUJRFAFFYEUGD-OAHLLOKOSA-N 1 1 233.330 3.524 20 0 BHADMO c1ccc(C2=CCC[N@H+](CCC3CC3)C2)cc1 ZINC000342015539 188399327 /nfs/dbraw/zinc/39/93/27/188399327.db2.gz LACDCUPQOLKGFL-UHFFFAOYSA-N 1 1 227.351 3.576 20 0 BHADMO CC(C)c1ccc[nH+]c1NCc1ccc(F)cc1 ZINC000342025259 385912693 /nfs/dbraw/zinc/91/26/93/385912693.db2.gz YHKCJJBGOILFPG-UHFFFAOYSA-N 1 1 244.313 3.956 20 0 BHADMO Cc1cccc(C[N@@H+]2CCCC[C@H]2CC(C)C)n1 ZINC000342034000 179074534 /nfs/dbraw/zinc/07/45/34/179074534.db2.gz DOTCRLZDFLKCTH-INIZCTEOSA-N 1 1 246.398 3.791 20 0 BHADMO Cc1cccc(C[N@@H+]2CCCC[C@@H]2CC(C)C)n1 ZINC000342034001 179072975 /nfs/dbraw/zinc/07/29/75/179072975.db2.gz DOTCRLZDFLKCTH-MRXNPFEDSA-N 1 1 246.398 3.791 20 0 BHADMO C[C@@H]1CC[C@H](C)[N@@H+]1CCSc1ccccc1 ZINC000342034808 177186474 /nfs/dbraw/zinc/18/64/74/177186474.db2.gz FOZDUHJBWRBTRY-BETUJISGSA-N 1 1 235.396 3.652 20 0 BHADMO C[N@@H+](CCCCCF)Cc1cc(F)cc(F)c1 ZINC000342120780 385932000 /nfs/dbraw/zinc/93/20/00/385932000.db2.gz FIYUEQZYNXDFEP-UHFFFAOYSA-N 1 1 245.288 3.536 20 0 BHADMO C[N@@H+](CCCCCF)Cc1cccc2[nH]ccc21 ZINC000342131069 411504563 /nfs/dbraw/zinc/50/45/63/411504563.db2.gz PORYUHMQXUFITD-UHFFFAOYSA-N 1 1 248.345 3.740 20 0 BHADMO CC(C)[N@@H+](CCCCCF)CC1CCC1 ZINC000342181003 187356503 /nfs/dbraw/zinc/35/65/03/187356503.db2.gz YVCWFPOGUYKYCP-UHFFFAOYSA-N 1 1 215.356 3.637 20 0 BHADMO CC/C=C\CC[N@H+]1CCC[C@H]1c1ccc[nH]1 ZINC000342181512 385939435 /nfs/dbraw/zinc/93/94/35/385939435.db2.gz BXFARKGBIRLLTB-NQHOJNORSA-N 1 1 218.344 3.508 20 0 BHADMO CC/C=C\CC[N@H+]1CCC[C@@H]1c1ccc[nH]1 ZINC000342181513 385940567 /nfs/dbraw/zinc/94/05/67/385940567.db2.gz BXFARKGBIRLLTB-VQTKUKTRSA-N 1 1 218.344 3.508 20 0 BHADMO CC/C=C\CC[N@H+]1CCC[C@H]1C1CCC1 ZINC000342201538 385957954 /nfs/dbraw/zinc/95/79/54/385957954.db2.gz KMFNPEPGONHXOX-NQHOJNORSA-N 1 1 207.361 3.607 20 0 BHADMO CC/C=C/CC[N@H+]1CCC[C@@H]1C1CCC1 ZINC000342201545 385956434 /nfs/dbraw/zinc/95/64/34/385956434.db2.gz KMFNPEPGONHXOX-RDFMZFSFSA-N 1 1 207.361 3.607 20 0 BHADMO CC/C=C\CC[N@H+]1CCC[C@@H]1C1CCC1 ZINC000342201547 385955386 /nfs/dbraw/zinc/95/53/86/385955386.db2.gz KMFNPEPGONHXOX-VQTKUKTRSA-N 1 1 207.361 3.607 20 0 BHADMO CC/C=C/CC[N@H+]1CCC[C@H]1C1CCC1 ZINC000342201548 385956763 /nfs/dbraw/zinc/95/67/63/385956763.db2.gz KMFNPEPGONHXOX-XGACYXMMSA-N 1 1 207.361 3.607 20 0 BHADMO CC(C)(C)CC(C)(C)Nc1[nH+]cnc2[nH]ccc21 ZINC000342215470 166553939 /nfs/dbraw/zinc/55/39/39/166553939.db2.gz DAAIVJRDNZGHBV-UHFFFAOYSA-N 1 1 246.358 3.585 20 0 BHADMO CC/C=C\CC[N@@H+](C)Cc1cccs1 ZINC000342215613 385959786 /nfs/dbraw/zinc/95/97/86/385959786.db2.gz FBTRLOVYSVEFCV-PLNGDYQASA-N 1 1 209.358 3.536 20 0 BHADMO CC/C=C/CC[N@@H+](C)Cc1cccs1 ZINC000342215615 385960501 /nfs/dbraw/zinc/96/05/01/385960501.db2.gz FBTRLOVYSVEFCV-SNAWJCMRSA-N 1 1 209.358 3.536 20 0 BHADMO CC/C=C/CC[N@@H+](Cc1ccco1)C(C)C ZINC000342227060 135253924 /nfs/dbraw/zinc/25/39/24/135253924.db2.gz CAIUSHLNBIFTOP-AATRIKPKSA-N 1 1 221.344 3.846 20 0 BHADMO CC/C=C\CC[N@@H+](Cc1ccco1)C(C)C ZINC000342227061 135253489 /nfs/dbraw/zinc/25/34/89/135253489.db2.gz CAIUSHLNBIFTOP-WAYWQWQTSA-N 1 1 221.344 3.846 20 0 BHADMO CC/C=C\CC[N@@H+](C)[C@@H](C)c1ccco1 ZINC000342241998 365540707 /nfs/dbraw/zinc/54/07/07/365540707.db2.gz VTWSZKBZPQRRIT-FJOGCWAESA-N 1 1 207.317 3.629 20 0 BHADMO CC/C=C\CC[N@@H+](C)[C@H](C)c1ccco1 ZINC000342242826 346557715 /nfs/dbraw/zinc/55/77/15/346557715.db2.gz VTWSZKBZPQRRIT-FOQNGQEVSA-N 1 1 207.317 3.629 20 0 BHADMO CC/C=C\CC[N@H+]1CCC[C@@H]1c1cccn1C ZINC000342251062 343726755 /nfs/dbraw/zinc/72/67/55/343726755.db2.gz QOCABTLUSXSOPN-FOSCPCJNSA-N 1 1 232.371 3.518 20 0 BHADMO CC/C=C\CC[N@H+]1CCC[C@H]1c1cccn1C ZINC000342251078 343726772 /nfs/dbraw/zinc/72/67/72/343726772.db2.gz QOCABTLUSXSOPN-XVWMLYKFSA-N 1 1 232.371 3.518 20 0 BHADMO CC/C=C\CC[N@@H+](C)[C@H](C)c1cccc(O)c1 ZINC000342255321 365540876 /nfs/dbraw/zinc/54/08/76/365540876.db2.gz XMZHUAGOEROQEW-CFHLNLSMSA-N 1 1 233.355 3.741 20 0 BHADMO CC/C=C\CC[N@@H+](C)[C@@H](C)c1cccc(O)c1 ZINC000342255322 365540927 /nfs/dbraw/zinc/54/09/27/365540927.db2.gz XMZHUAGOEROQEW-SZZPACECSA-N 1 1 233.355 3.741 20 0 BHADMO CSc1ccc(C[N@H+]2CCCC[C@@H]2C)cc1 ZINC000342333448 352744389 /nfs/dbraw/zinc/74/43/89/352744389.db2.gz MMEDWDAHYQUSJZ-LBPRGKRZSA-N 1 1 235.396 3.783 20 0 BHADMO CC[C@H]1Cc2ccccc2C[N@H+]1CCCSC ZINC000342337125 135264965 /nfs/dbraw/zinc/26/49/65/135264965.db2.gz KFGOKTMWBDFIJZ-HNNXBMFYSA-N 1 1 249.423 3.576 20 0 BHADMO CC[C@@H]1Cc2ccccc2C[N@H+]1CCCSC ZINC000342337126 135265496 /nfs/dbraw/zinc/26/54/96/135265496.db2.gz KFGOKTMWBDFIJZ-OAHLLOKOSA-N 1 1 249.423 3.576 20 0 BHADMO CC[N@@H+](CCCC1CCCC1)Cc1ccccn1 ZINC000342352764 135260998 /nfs/dbraw/zinc/26/09/98/135260998.db2.gz AULIHDJDJBQCDA-UHFFFAOYSA-N 1 1 246.398 3.874 20 0 BHADMO CC[N@@H+](CCC(C)(C)CC)Cc1ccccn1 ZINC000342372805 135268465 /nfs/dbraw/zinc/26/84/65/135268465.db2.gz JRKOJSOWUJLCBQ-UHFFFAOYSA-N 1 1 234.387 3.730 20 0 BHADMO CC[C@H](C)[C@@H]1CCCC[N@H+]1Cc1cccc(C)n1 ZINC000342582079 535913751 /nfs/dbraw/zinc/91/37/51/535913751.db2.gz FYGZUTQXEMOXBH-BBRMVZONSA-N 1 1 246.398 3.791 20 0 BHADMO CC[C@@H](C)[C@@H]1CCCC[N@H+]1Cc1cccc(C)n1 ZINC000342582081 535701345 /nfs/dbraw/zinc/70/13/45/535701345.db2.gz FYGZUTQXEMOXBH-CJNGLKHVSA-N 1 1 246.398 3.791 20 0 BHADMO CC[C@@H](C)[C@H]1CCCC[N@H+]1Cc1cccc(C)n1 ZINC000342582083 135292509 /nfs/dbraw/zinc/29/25/09/135292509.db2.gz FYGZUTQXEMOXBH-CZUORRHYSA-N 1 1 246.398 3.791 20 0 BHADMO CC[C@H](C)[C@H]1CCCC[N@H+]1Cc1cccc(C)n1 ZINC000342582084 135292487 /nfs/dbraw/zinc/29/24/87/135292487.db2.gz FYGZUTQXEMOXBH-XJKSGUPXSA-N 1 1 246.398 3.791 20 0 BHADMO Cc1ccccc1[C@@H](C)[N@@H+](C)CC[C@@H]1CCCO1 ZINC000342591012 135293505 /nfs/dbraw/zinc/29/35/05/135293505.db2.gz DDTDNSVKKJMKDT-CABCVRRESA-N 1 1 247.382 3.557 20 0 BHADMO Cc1ccccc1[C@H](C)[N@@H+](C)CC[C@@H]1CCCO1 ZINC000342591014 135293695 /nfs/dbraw/zinc/29/36/95/135293695.db2.gz DDTDNSVKKJMKDT-GJZGRUSLSA-N 1 1 247.382 3.557 20 0 BHADMO Cc1ccccc1[C@@H](C)[N@@H+](C)CC[C@H]1CCCO1 ZINC000342591016 135293895 /nfs/dbraw/zinc/29/38/95/135293895.db2.gz DDTDNSVKKJMKDT-HUUCEWRRSA-N 1 1 247.382 3.557 20 0 BHADMO Cc1ccccc1[C@H](C)[N@@H+](C)CC[C@H]1CCCO1 ZINC000342591017 135293795 /nfs/dbraw/zinc/29/37/95/135293795.db2.gz DDTDNSVKKJMKDT-LSDHHAIUSA-N 1 1 247.382 3.557 20 0 BHADMO Cc1cccc([C@@H](C)[N@@H+](C)CC[C@H]2CCCO2)c1 ZINC000342596957 135301062 /nfs/dbraw/zinc/30/10/62/135301062.db2.gz HQCDSLCCRDRPEE-GDBMZVCRSA-N 1 1 247.382 3.557 20 0 BHADMO Cc1cccc([C@H](C)[N@@H+](C)CC[C@H]2CCCO2)c1 ZINC000342596958 135300894 /nfs/dbraw/zinc/30/08/94/135300894.db2.gz HQCDSLCCRDRPEE-GOEBONIOSA-N 1 1 247.382 3.557 20 0 BHADMO Cc1cccc([C@H](C)[N@@H+](C)CC[C@@H]2CCCO2)c1 ZINC000342596960 135301380 /nfs/dbraw/zinc/30/13/80/135301380.db2.gz HQCDSLCCRDRPEE-HOCLYGCPSA-N 1 1 247.382 3.557 20 0 BHADMO Cc1cccc([C@@H](C)[N@@H+](C)CC[C@@H]2CCCO2)c1 ZINC000342596961 135301016 /nfs/dbraw/zinc/30/10/16/135301016.db2.gz HQCDSLCCRDRPEE-ZBFHGGJFSA-N 1 1 247.382 3.557 20 0 BHADMO CC[C@@H](c1ccccc1)[N@@H+](C)CC[C@H]1CCCO1 ZINC000342603092 135302148 /nfs/dbraw/zinc/30/21/48/135302148.db2.gz XLIWIIPVDAZDFA-CVEARBPZSA-N 1 1 247.382 3.639 20 0 BHADMO CC[C@@H](c1ccccc1)[N@@H+](C)CC[C@@H]1CCCO1 ZINC000342603093 135301856 /nfs/dbraw/zinc/30/18/56/135301856.db2.gz XLIWIIPVDAZDFA-HOTGVXAUSA-N 1 1 247.382 3.639 20 0 BHADMO CC[C@H](c1ccccc1)[N@@H+](C)CC[C@H]1CCCO1 ZINC000342603095 135301768 /nfs/dbraw/zinc/30/17/68/135301768.db2.gz XLIWIIPVDAZDFA-HZPDHXFCSA-N 1 1 247.382 3.639 20 0 BHADMO CC[C@H](c1ccccc1)[N@@H+](C)CC[C@@H]1CCCO1 ZINC000342603098 135301729 /nfs/dbraw/zinc/30/17/29/135301729.db2.gz XLIWIIPVDAZDFA-JKSUJKDBSA-N 1 1 247.382 3.639 20 0 BHADMO CCC[C@H]1[C@@H](C)CCC[N@H+]1Cc1cccc(C)n1 ZINC000342608038 135303278 /nfs/dbraw/zinc/30/32/78/135303278.db2.gz SJAYXNSPAIAZMY-BBRMVZONSA-N 1 1 246.398 3.791 20 0 BHADMO CCC[C@H]1[C@H](C)CCC[N@H+]1Cc1cccc(C)n1 ZINC000342608039 135302645 /nfs/dbraw/zinc/30/26/45/135302645.db2.gz SJAYXNSPAIAZMY-CJNGLKHVSA-N 1 1 246.398 3.791 20 0 BHADMO CCC[C@@H]1[C@H](C)CCC[N@H+]1Cc1cccc(C)n1 ZINC000342608041 535510386 /nfs/dbraw/zinc/51/03/86/535510386.db2.gz SJAYXNSPAIAZMY-CZUORRHYSA-N 1 1 246.398 3.791 20 0 BHADMO CCC[C@@H]1[C@@H](C)CCC[N@H+]1Cc1cccc(C)n1 ZINC000342608043 535507455 /nfs/dbraw/zinc/50/74/55/535507455.db2.gz SJAYXNSPAIAZMY-XJKSGUPXSA-N 1 1 246.398 3.791 20 0 BHADMO Cc1occc1C[N@H+](C)Cc1c(C)cccc1C ZINC000342615662 135296206 /nfs/dbraw/zinc/29/62/06/135296206.db2.gz LEWNLTDCAPEKLP-UHFFFAOYSA-N 1 1 243.350 3.837 20 0 BHADMO CC/C=C\CC[N@@H+](C)C[C@H](C)c1nccs1 ZINC000342635237 535245534 /nfs/dbraw/zinc/24/55/34/535245534.db2.gz PUZGDROBQYABOX-FJOGCWAESA-N 1 1 238.400 3.535 20 0 BHADMO CC/C=C\CC[N@@H+](C)C[C@@H](C)c1nccs1 ZINC000342635238 535245219 /nfs/dbraw/zinc/24/52/19/535245219.db2.gz PUZGDROBQYABOX-FOQNGQEVSA-N 1 1 238.400 3.535 20 0 BHADMO Cc1cccc([C@@H](C)[N@@H+](C)Cc2ccoc2)c1 ZINC000342639857 135299376 /nfs/dbraw/zinc/29/93/76/135299376.db2.gz WJQYCAUVBOOGFX-CYBMUJFWSA-N 1 1 229.323 3.781 20 0 BHADMO Cc1cccc([C@H](C)[N@@H+](C)Cc2ccoc2)c1 ZINC000342639860 135299220 /nfs/dbraw/zinc/29/92/20/135299220.db2.gz WJQYCAUVBOOGFX-ZDUSSCGKSA-N 1 1 229.323 3.781 20 0 BHADMO Cc1cccc(C[N@H+](C(C)C)C2CCCC2)n1 ZINC000342644470 135300339 /nfs/dbraw/zinc/30/03/39/135300339.db2.gz SHDQSHFKCROUGI-UHFFFAOYSA-N 1 1 232.371 3.543 20 0 BHADMO Cc1[nH+]ccn1CCSc1cc(C)ccc1C ZINC000342657635 135307727 /nfs/dbraw/zinc/30/77/27/135307727.db2.gz BOAOIQRRZGRMDX-UHFFFAOYSA-N 1 1 246.379 3.601 20 0 BHADMO Cc1[nH+]ccn1CCSc1ccc(C)cc1C ZINC000342658781 136223519 /nfs/dbraw/zinc/22/35/19/136223519.db2.gz CTSLCHKXQKXILW-UHFFFAOYSA-N 1 1 246.379 3.601 20 0 BHADMO CCC[C@H](C)C[N@H+]1CCC[C@H]1c1cc(C)no1 ZINC000342678816 535610086 /nfs/dbraw/zinc/61/00/86/535610086.db2.gz MOJDJAAXXHMKJD-AAEUAGOBSA-N 1 1 236.359 3.556 20 0 BHADMO CCC[C@@H](C)C[N@H+]1CCC[C@@H]1c1cc(C)no1 ZINC000342678817 535325647 /nfs/dbraw/zinc/32/56/47/535325647.db2.gz MOJDJAAXXHMKJD-DGCLKSJQSA-N 1 1 236.359 3.556 20 0 BHADMO CCC[C@H](C)C[N@H+]1CCC[C@@H]1c1cc(C)no1 ZINC000342678818 535610975 /nfs/dbraw/zinc/61/09/75/535610975.db2.gz MOJDJAAXXHMKJD-WCQYABFASA-N 1 1 236.359 3.556 20 0 BHADMO CCC[C@@H](C)C[N@H+]1CCC[C@H]1c1cc(C)no1 ZINC000342678819 535326248 /nfs/dbraw/zinc/32/62/48/535326248.db2.gz MOJDJAAXXHMKJD-YPMHNXCESA-N 1 1 236.359 3.556 20 0 BHADMO CCCC[N@@H+](CC)Cc1nc(C2CC2)cs1 ZINC000342701440 135307396 /nfs/dbraw/zinc/30/73/96/135307396.db2.gz YSFYQLLGLOPJLN-UHFFFAOYSA-N 1 1 238.400 3.643 20 0 BHADMO CC(C)[N@@H+](Cc1cccc(Cl)c1)C1CC1 ZINC000342701960 135307619 /nfs/dbraw/zinc/30/76/19/135307619.db2.gz CIBNOAMGISZFKJ-UHFFFAOYSA-N 1 1 223.747 3.713 20 0 BHADMO Cc1[nH+]ccn1CCCSC1CCCCC1 ZINC000342707470 135312643 /nfs/dbraw/zinc/31/26/43/135312643.db2.gz GLWWLBGBGAWGSL-UHFFFAOYSA-N 1 1 238.400 3.648 20 0 BHADMO Cc1cccc(C)c1C[N@@H+](C)Cc1ccco1 ZINC000342708899 135312933 /nfs/dbraw/zinc/31/29/33/135312933.db2.gz DQXIVPURQSAJFI-UHFFFAOYSA-N 1 1 229.323 3.528 20 0 BHADMO C[N@@H+](Cc1ccoc1)Cc1cccc(Cl)c1 ZINC000342709061 135313056 /nfs/dbraw/zinc/31/30/56/135313056.db2.gz IVEQZIRDLVQCMA-UHFFFAOYSA-N 1 1 235.714 3.565 20 0 BHADMO Cc1ccc(C[N@H+](C)Cc2c(C)cccc2C)o1 ZINC000342717863 135313409 /nfs/dbraw/zinc/31/34/09/135313409.db2.gz NFWRCMZGRUXATH-UHFFFAOYSA-N 1 1 243.350 3.837 20 0 BHADMO Cc1ccc(CCC[N@H+](C)Cc2ccoc2)cc1 ZINC000342732610 135316501 /nfs/dbraw/zinc/31/65/01/135316501.db2.gz KIUJEOHVNRTVTD-UHFFFAOYSA-N 1 1 243.350 3.653 20 0 BHADMO CC/C=C\CCSCCCn1cc[nH+]c1C ZINC000342736044 535246756 /nfs/dbraw/zinc/24/67/56/535246756.db2.gz FLCKZOLCRNPVOU-PLNGDYQASA-N 1 1 238.400 3.671 20 0 BHADMO CCC(C)(C)[N@@H+](C)Cc1nc(C2CC2)cs1 ZINC000342748089 535355069 /nfs/dbraw/zinc/35/50/69/535355069.db2.gz IGSSLQQKCCVZMM-UHFFFAOYSA-N 1 1 238.400 3.641 20 0 BHADMO CCC[C@H](C)[N@@H+](C)Cc1nc(C2CC2)cs1 ZINC000342766842 535631633 /nfs/dbraw/zinc/63/16/33/535631633.db2.gz XXGCTFQLZZGKKU-JTQLQIEISA-N 1 1 238.400 3.641 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)Cc1nc(C2CC2)cs1 ZINC000342766843 135326396 /nfs/dbraw/zinc/32/63/96/135326396.db2.gz XXGCTFQLZZGKKU-SNVBAGLBSA-N 1 1 238.400 3.641 20 0 BHADMO CC[N@@H+](Cc1cn(C(C)C)nc1C)C1CCCC1 ZINC000342821356 352864854 /nfs/dbraw/zinc/86/48/54/352864854.db2.gz MQUNJROULVUBAN-UHFFFAOYSA-N 1 1 249.402 3.537 20 0 BHADMO CC[N@@H+](CCCc1ccc(C)nc1)C1CCCC1 ZINC000342833411 352834430 /nfs/dbraw/zinc/83/44/30/352834430.db2.gz AAGUTLWFLQSYDW-UHFFFAOYSA-N 1 1 246.398 3.587 20 0 BHADMO CC[N@@H+](Cc1sccc1OC)C1CCCC1 ZINC000342833949 352835056 /nfs/dbraw/zinc/83/50/56/352835056.db2.gz CVPRRZDFAKRPIZ-UHFFFAOYSA-N 1 1 239.384 3.521 20 0 BHADMO c1coc(C[N@H+]2CCC=C(c3ccccc3)C2)c1 ZINC000342844583 352872460 /nfs/dbraw/zinc/87/24/60/352872460.db2.gz ZOYDLXDVVFFGSV-UHFFFAOYSA-N 1 1 239.318 3.569 20 0 BHADMO CC(C)[C@@H]1CC[N@H+]1Cc1ccc([C@@H]2C[C@H]2C)o1 ZINC000342850165 352874532 /nfs/dbraw/zinc/87/45/32/352874532.db2.gz LPCXMGFKYQEMNP-BNOWGMLFSA-N 1 1 233.355 3.633 20 0 BHADMO CC(C)[C@@H]1CC[N@H+]1Cc1ccc([C@H]2C[C@@H]2C)o1 ZINC000342850166 352874455 /nfs/dbraw/zinc/87/44/55/352874455.db2.gz LPCXMGFKYQEMNP-UBHSHLNASA-N 1 1 233.355 3.633 20 0 BHADMO CC(C)[C@@H]1CC[N@H+]1Cc1ccc([C@H]2C[C@H]2C)o1 ZINC000342850167 352874197 /nfs/dbraw/zinc/87/41/97/352874197.db2.gz LPCXMGFKYQEMNP-XBFCOCLRSA-N 1 1 233.355 3.633 20 0 BHADMO CC(C)[C@@H]1CC[N@H+]1Cc1ccc([C@@H]2C[C@@H]2C)o1 ZINC000342850168 352874565 /nfs/dbraw/zinc/87/45/65/352874565.db2.gz LPCXMGFKYQEMNP-YUTCNCBUSA-N 1 1 233.355 3.633 20 0 BHADMO CSc1ccc(C[N@H+]2CC[C@H]2C(C)C)cc1 ZINC000342862016 352879134 /nfs/dbraw/zinc/87/91/34/352879134.db2.gz PLBHXCRTUUJTJL-AWEZNQCLSA-N 1 1 235.396 3.639 20 0 BHADMO CSc1ccc(C[N@H+]2CC[C@@H]2C(C)C)cc1 ZINC000342862017 352879255 /nfs/dbraw/zinc/87/92/55/352879255.db2.gz PLBHXCRTUUJTJL-CQSZACIVSA-N 1 1 235.396 3.639 20 0 BHADMO CC(C)[C@@H]1CC[N@H+]1Cc1coc2ccccc12 ZINC000342863192 352880688 /nfs/dbraw/zinc/88/06/88/352880688.db2.gz WDANEPDMFOZEGE-AWEZNQCLSA-N 1 1 229.323 3.663 20 0 BHADMO CC(C)[C@H]1CC[N@H+]1Cc1coc2ccccc12 ZINC000342863193 352880756 /nfs/dbraw/zinc/88/07/56/352880756.db2.gz WDANEPDMFOZEGE-CQSZACIVSA-N 1 1 229.323 3.663 20 0 BHADMO CC(C)[C@@H]1CC[N@H+]1Cc1cc2cc(F)ccc2o1 ZINC000342863514 352881579 /nfs/dbraw/zinc/88/15/79/352881579.db2.gz XWMBKZYZZWOBRW-AWEZNQCLSA-N 1 1 247.313 3.802 20 0 BHADMO CC(C)[C@H]1CC[N@H+]1Cc1cc2cc(F)ccc2o1 ZINC000342863515 352881850 /nfs/dbraw/zinc/88/18/50/352881850.db2.gz XWMBKZYZZWOBRW-CQSZACIVSA-N 1 1 247.313 3.802 20 0 BHADMO CSC[C@@H]1CCC[N@H+]1Cc1c(C)cccc1C ZINC000342909952 135334356 /nfs/dbraw/zinc/33/43/56/135334356.db2.gz JVYOXDIMLQJNRC-AWEZNQCLSA-N 1 1 249.423 3.631 20 0 BHADMO CSC[C@H]1CCC[N@H+]1Cc1c(C)cccc1C ZINC000342909953 135334527 /nfs/dbraw/zinc/33/45/27/135334527.db2.gz JVYOXDIMLQJNRC-CQSZACIVSA-N 1 1 249.423 3.631 20 0 BHADMO Cc1cccc(C)c1C[N@H+]1CCC2(CCC2)C1 ZINC000342936042 135336572 /nfs/dbraw/zinc/33/65/72/135336572.db2.gz CZBDVNJKPPKTRT-UHFFFAOYSA-N 1 1 229.367 3.679 20 0 BHADMO CSc1ccc(C[N@H+]2CCCC2(C)C)cc1 ZINC000342994666 135343029 /nfs/dbraw/zinc/34/30/29/135343029.db2.gz AJFLXRMFWJFHOT-UHFFFAOYSA-N 1 1 235.396 3.783 20 0 BHADMO Fc1cccc(C[N@H+]2CCC[C@H]2C2CCC2)c1 ZINC000342997192 135343747 /nfs/dbraw/zinc/34/37/47/135343747.db2.gz CPZOKDKQROLOQX-HNNXBMFYSA-N 1 1 233.330 3.590 20 0 BHADMO Fc1cccc(C[N@H+]2CCC[C@@H]2C2CCC2)c1 ZINC000342997195 135343734 /nfs/dbraw/zinc/34/37/34/135343734.db2.gz CPZOKDKQROLOQX-OAHLLOKOSA-N 1 1 233.330 3.590 20 0 BHADMO Fc1ccccc1C[N@H+]1CCC[C@H]1C1CCC1 ZINC000343006786 135344327 /nfs/dbraw/zinc/34/43/27/135344327.db2.gz KKMRUCWIOXKCRF-HNNXBMFYSA-N 1 1 233.330 3.590 20 0 BHADMO Fc1ccccc1C[N@H+]1CCC[C@@H]1C1CCC1 ZINC000343006787 135344376 /nfs/dbraw/zinc/34/43/76/135344376.db2.gz KKMRUCWIOXKCRF-OAHLLOKOSA-N 1 1 233.330 3.590 20 0 BHADMO Fc1ccc(C[N@H+]2CCC[C@H]2C2CCC2)cc1 ZINC000343011159 135344379 /nfs/dbraw/zinc/34/43/79/135344379.db2.gz TXFBZGVBFJAAQL-HNNXBMFYSA-N 1 1 233.330 3.590 20 0 BHADMO Fc1ccc(C[N@H+]2CCC[C@@H]2C2CCC2)cc1 ZINC000343011160 135344323 /nfs/dbraw/zinc/34/43/23/135344323.db2.gz TXFBZGVBFJAAQL-OAHLLOKOSA-N 1 1 233.330 3.590 20 0 BHADMO CC(C)[N@@H+](Cc1ccco1)[C@@H]1C=CCCC1 ZINC000343040259 352952186 /nfs/dbraw/zinc/95/21/86/352952186.db2.gz CGYUJPPHTXARPV-CYBMUJFWSA-N 1 1 219.328 3.599 20 0 BHADMO CC(C)[N@@H+](Cc1ccco1)[C@H]1C=CCCC1 ZINC000343040261 352952529 /nfs/dbraw/zinc/95/25/29/352952529.db2.gz CGYUJPPHTXARPV-ZDUSSCGKSA-N 1 1 219.328 3.599 20 0 BHADMO Cc1cc(C[N@H+]2CCCC2(C)C)c(C)s1 ZINC000343048134 352934825 /nfs/dbraw/zinc/93/48/25/352934825.db2.gz NFDQCKNUPFICSN-UHFFFAOYSA-N 1 1 223.385 3.739 20 0 BHADMO CCCc1[nH+]ccn1CCCC1CCCC1 ZINC000343077067 352954392 /nfs/dbraw/zinc/95/43/92/352954392.db2.gz PRRNWONADBFKJE-UHFFFAOYSA-N 1 1 220.360 3.806 20 0 BHADMO CC(C)C[N@@H+](Cc1cscn1)C1CCCC1 ZINC000343100008 135354584 /nfs/dbraw/zinc/35/45/84/135354584.db2.gz AWXDWCRGTGZDIV-UHFFFAOYSA-N 1 1 238.400 3.544 20 0 BHADMO CC(C)(C)C[C@H]1CCC[N@H+]1Cc1cscn1 ZINC000343100036 534653656 /nfs/dbraw/zinc/65/36/56/534653656.db2.gz BLGDWBLELGBPNV-GFCCVEGCSA-N 1 1 238.400 3.544 20 0 BHADMO CC(C)(C)C[C@@H]1CCC[N@H+]1Cc1cscn1 ZINC000343100037 135354878 /nfs/dbraw/zinc/35/48/78/135354878.db2.gz BLGDWBLELGBPNV-LBPRGKRZSA-N 1 1 238.400 3.544 20 0 BHADMO CC(C)C[N@@H+](CCc1ccccn1)C1CCCC1 ZINC000343105884 352972361 /nfs/dbraw/zinc/97/23/61/352972361.db2.gz WUGCMONUOACFFI-UHFFFAOYSA-N 1 1 246.398 3.525 20 0 BHADMO C[N@H+](Cc1cccnc1)CC1CCC(C)(C)CC1 ZINC000343282977 353348013 /nfs/dbraw/zinc/34/80/13/353348013.db2.gz LVCDNTHSWXYQMI-UHFFFAOYSA-N 1 1 246.398 3.730 20 0 BHADMO CCC[N@@H+](Cc1ccn(C(CC)CC)n1)C1CC1 ZINC000343387791 353875733 /nfs/dbraw/zinc/87/57/33/353875733.db2.gz OWCSIGQRHULIMS-UHFFFAOYSA-N 1 1 249.402 3.619 20 0 BHADMO Cc1cc[nH+]c(NCc2ccc3ccccc3n2)c1 ZINC000343461325 353896590 /nfs/dbraw/zinc/89/65/90/353896590.db2.gz ULNQUIKSSLTAJH-UHFFFAOYSA-N 1 1 249.317 3.550 20 0 BHADMO c1cc2[nH+]ccc(N3CC[C@@H](C4CC4)C3)c2s1 ZINC000343471479 353900683 /nfs/dbraw/zinc/90/06/83/353900683.db2.gz PKHMNLKFRWZYKR-LLVKDONJSA-N 1 1 244.363 3.533 20 0 BHADMO c1cc2[nH+]ccc(N3CC[C@H](C4CC4)C3)c2s1 ZINC000343471483 353900442 /nfs/dbraw/zinc/90/04/42/353900442.db2.gz PKHMNLKFRWZYKR-NSHDSACASA-N 1 1 244.363 3.533 20 0 BHADMO Cc1cccc(NCc2ccc3ccccc3n2)[nH+]1 ZINC000343488537 353907561 /nfs/dbraw/zinc/90/75/61/353907561.db2.gz YMPRDTWQDDLUFT-UHFFFAOYSA-N 1 1 249.317 3.550 20 0 BHADMO Cc1nn(C(C)C)cc1C[N@@H+](C)C1CCCCC1 ZINC000343513851 353925021 /nfs/dbraw/zinc/92/50/21/353925021.db2.gz OHEXASKPBUODDP-UHFFFAOYSA-N 1 1 249.402 3.537 20 0 BHADMO Cc1nn(C(C)C)cc1C[N@@H+](C(C)C)C1CCC1 ZINC000343520096 353926439 /nfs/dbraw/zinc/92/64/39/353926439.db2.gz AQGQAAOPYKEGLV-UHFFFAOYSA-N 1 1 249.402 3.535 20 0 BHADMO Cc1nn(C(C)C)cc1C[N@H+]1CCCCC[C@H]1C ZINC000343521444 136231000 /nfs/dbraw/zinc/23/10/00/136231000.db2.gz CYNVNJDHHUNTOF-CYBMUJFWSA-N 1 1 249.402 3.537 20 0 BHADMO Cc1nn(C(C)C)cc1C[N@H+]1CCCCC[C@@H]1C ZINC000343521446 136231026 /nfs/dbraw/zinc/23/10/26/136231026.db2.gz CYNVNJDHHUNTOF-ZDUSSCGKSA-N 1 1 249.402 3.537 20 0 BHADMO CCCC[N@@H+](Cc1cn(C(C)C)nc1C)C1CC1 ZINC000343521565 136231016 /nfs/dbraw/zinc/23/10/16/136231016.db2.gz VFBQJJSUZCLERS-UHFFFAOYSA-N 1 1 249.402 3.537 20 0 BHADMO CC[C@H]1CCCC[N@H+]1Cc1cn(C(C)C)nc1C ZINC000343569325 353936649 /nfs/dbraw/zinc/93/66/49/353936649.db2.gz JKNKENKLDXKYSX-HNNXBMFYSA-N 1 1 249.402 3.537 20 0 BHADMO CC[C@@H]1CCCC[N@H+]1Cc1cn(C(C)C)nc1C ZINC000343569326 353936543 /nfs/dbraw/zinc/93/65/43/353936543.db2.gz JKNKENKLDXKYSX-OAHLLOKOSA-N 1 1 249.402 3.537 20 0 BHADMO Cc1nn(C(C)C)cc1C[N@@H+](C)C1(C)CCCC1 ZINC000343597154 353930298 /nfs/dbraw/zinc/93/02/98/353930298.db2.gz KNZWMIJJKXOQFK-UHFFFAOYSA-N 1 1 249.402 3.537 20 0 BHADMO CC[N@@H+](C[C@H]1CCCO1)[C@H](C)c1cccc(C)c1 ZINC000343616194 353945728 /nfs/dbraw/zinc/94/57/28/353945728.db2.gz DYPZBHCBJCFMHX-GDBMZVCRSA-N 1 1 247.382 3.557 20 0 BHADMO CC[N@@H+](C[C@H]1CCCO1)[C@@H](C)c1cccc(C)c1 ZINC000343616197 353945715 /nfs/dbraw/zinc/94/57/15/353945715.db2.gz DYPZBHCBJCFMHX-GOEBONIOSA-N 1 1 247.382 3.557 20 0 BHADMO CC[N@@H+](C[C@@H]1CCCO1)[C@@H](C)c1cccc(C)c1 ZINC000343616199 353945691 /nfs/dbraw/zinc/94/56/91/353945691.db2.gz DYPZBHCBJCFMHX-HOCLYGCPSA-N 1 1 247.382 3.557 20 0 BHADMO CC[N@@H+](C[C@@H]1CCCO1)[C@H](C)c1cccc(C)c1 ZINC000343616201 353945867 /nfs/dbraw/zinc/94/58/67/353945867.db2.gz DYPZBHCBJCFMHX-ZBFHGGJFSA-N 1 1 247.382 3.557 20 0 BHADMO CC[N@@H+](C[C@@H]1CCCO1)[C@H](C)c1ccccc1C ZINC000343633083 353948705 /nfs/dbraw/zinc/94/87/05/353948705.db2.gz ZQXRYSZWGQTFAG-CABCVRRESA-N 1 1 247.382 3.557 20 0 BHADMO CC[N@@H+](C[C@@H]1CCCO1)[C@@H](C)c1ccccc1C ZINC000343633084 353948859 /nfs/dbraw/zinc/94/88/59/353948859.db2.gz ZQXRYSZWGQTFAG-GJZGRUSLSA-N 1 1 247.382 3.557 20 0 BHADMO CC[N@@H+](C[C@H]1CCCO1)[C@H](C)c1ccccc1C ZINC000343633085 353948756 /nfs/dbraw/zinc/94/87/56/353948756.db2.gz ZQXRYSZWGQTFAG-HUUCEWRRSA-N 1 1 247.382 3.557 20 0 BHADMO CC[N@@H+](C[C@H]1CCCO1)[C@@H](C)c1ccccc1C ZINC000343633086 133699981 /nfs/dbraw/zinc/69/99/81/133699981.db2.gz ZQXRYSZWGQTFAG-LSDHHAIUSA-N 1 1 247.382 3.557 20 0 BHADMO CSCCC[N@@H+](C)Cc1ccsc1Cl ZINC000343671978 133699076 /nfs/dbraw/zinc/69/90/76/133699076.db2.gz GASWLRGKHCXTTN-UHFFFAOYSA-N 1 1 249.832 3.586 20 0 BHADMO CSCCC[N@@H+](C)Cc1cc(Cl)cs1 ZINC000343673859 353954164 /nfs/dbraw/zinc/95/41/64/353954164.db2.gz HWFBTSZQXPIUSH-UHFFFAOYSA-N 1 1 249.832 3.586 20 0 BHADMO CSCCC[N@@H+](C)Cc1coc2ccccc12 ZINC000343674294 353961061 /nfs/dbraw/zinc/96/10/61/353961061.db2.gz IQNNROFOOYEDKS-UHFFFAOYSA-N 1 1 249.379 3.618 20 0 BHADMO CSCCC[N@@H+](C)Cc1cc(C)sc1C ZINC000343687319 353963636 /nfs/dbraw/zinc/96/36/36/353963636.db2.gz XUDFRRGAAFMYCI-UHFFFAOYSA-N 1 1 243.441 3.550 20 0 BHADMO C[C@@H]([NH2+][C@H]1C[C@@H](C)c2ccccc21)c1ccon1 ZINC000343788939 353994283 /nfs/dbraw/zinc/99/42/83/353994283.db2.gz HJGLMQVRHGPFKY-HFAKWTLXSA-N 1 1 242.322 3.574 20 0 BHADMO C[C@H]([NH2+][C@@H]1C[C@@H](C)c2ccccc21)c1ccon1 ZINC000343788942 353994374 /nfs/dbraw/zinc/99/43/74/353994374.db2.gz HJGLMQVRHGPFKY-JRPNMDOOSA-N 1 1 242.322 3.574 20 0 BHADMO C[C@@H]([NH2+][C@@H]1C[C@@H](C)c2ccccc21)c1ccon1 ZINC000343788945 353994444 /nfs/dbraw/zinc/99/44/44/353994444.db2.gz HJGLMQVRHGPFKY-UEKVPHQBSA-N 1 1 242.322 3.574 20 0 BHADMO C[C@H]([NH2+][C@H]1C[C@@H](C)c2ccccc21)c1ccon1 ZINC000343788948 353994578 /nfs/dbraw/zinc/99/45/78/353994578.db2.gz HJGLMQVRHGPFKY-ZETOZRRWSA-N 1 1 242.322 3.574 20 0 BHADMO CC[C@H]1CCC[N@H+]([C@@H](C)c2cccnc2)CC1 ZINC000343939057 354048561 /nfs/dbraw/zinc/04/85/61/354048561.db2.gz UVYWVSBCPKTQAK-KBPBESRZSA-N 1 1 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C[N@@H+](Cc1cccs1)[C@@H]1CCC(C)(C)C1 ZINC000344506126 354290558 /nfs/dbraw/zinc/29/05/58/354290558.db2.gz XSXGTGLYTAGZLE-LLVKDONJSA-N 1 1 223.385 3.759 20 0 BHADMO C[N@@H+](Cc1cccs1)[C@H]1CCC(C)(C)C1 ZINC000344506128 354290792 /nfs/dbraw/zinc/29/07/92/354290792.db2.gz XSXGTGLYTAGZLE-NSHDSACASA-N 1 1 223.385 3.759 20 0 BHADMO Cc1cc(Cl)ccc1C[N@@H+](C)Cc1ccc[nH]1 ZINC000344524135 354278850 /nfs/dbraw/zinc/27/88/50/354278850.db2.gz SXZOFHSEEQNDHS-UHFFFAOYSA-N 1 1 248.757 3.609 20 0 BHADMO Cc1[nH+]ccn1C/C=C\c1ccc(Cl)cc1 ZINC000344604745 365712686 /nfs/dbraw/zinc/71/26/86/365712686.db2.gz AGJVMUIHEWSZEM-IHWYPQMZSA-N 1 1 232.714 3.558 20 0 BHADMO CC(C)[N@@H+](CCSc1ccccc1)C1CC1 ZINC000344612702 354325810 /nfs/dbraw/zinc/32/58/10/354325810.db2.gz WUUWSUDQTXFICW-UHFFFAOYSA-N 1 1 235.396 3.652 20 0 BHADMO Cc1[nH+]cn(C/C=C\c2ccc(Cl)cc2)c1C ZINC000344673655 388509296 /nfs/dbraw/zinc/50/92/96/388509296.db2.gz LQMZJEVYCNPNFR-ARJAWSKDSA-N 1 1 246.741 3.867 20 0 BHADMO CCCCC[N@@H+](Cc1cncc(F)c1)C(C)C ZINC000344685008 354333303 /nfs/dbraw/zinc/33/33/03/354333303.db2.gz YMYJGEIVFCVOTQ-UHFFFAOYSA-N 1 1 238.350 3.621 20 0 BHADMO Cc1ccc(C)c(C[N@@H+](C)Cc2ccoc2)c1 ZINC000345093652 385993855 /nfs/dbraw/zinc/99/38/55/385993855.db2.gz UNOGXJSLMATUPY-UHFFFAOYSA-N 1 1 229.323 3.528 20 0 BHADMO C[N@@H+](Cc1ccoc1)Cc1ccc(Cl)cc1 ZINC000345099864 385997951 /nfs/dbraw/zinc/99/79/51/385997951.db2.gz SUPWWSDHOUOKOC-UHFFFAOYSA-N 1 1 235.714 3.565 20 0 BHADMO C[N@H+](Cc1ccoc1)Cc1ccc(Cl)s1 ZINC000345099876 385997528 /nfs/dbraw/zinc/99/75/28/385997528.db2.gz SYGDPHKGTKCXPC-UHFFFAOYSA-N 1 1 241.743 3.627 20 0 BHADMO C[N@@H+](Cc1ccoc1)Cc1ccc(Cl)s1 ZINC000345099876 385997524 /nfs/dbraw/zinc/99/75/24/385997524.db2.gz SYGDPHKGTKCXPC-UHFFFAOYSA-N 1 1 241.743 3.627 20 0 BHADMO CCc1cccc(C[N@@H+](C)Cc2ccoc2C)c1 ZINC000345735439 354747594 /nfs/dbraw/zinc/74/75/94/354747594.db2.gz BSIBXMAFPNOIHR-UHFFFAOYSA-N 1 1 243.350 3.782 20 0 BHADMO COC(C)(C)CC[N@@H+](Cc1ccccc1)C(C)C ZINC000345781691 354763114 /nfs/dbraw/zinc/76/31/14/354763114.db2.gz ZQKOZOUBALCUNF-UHFFFAOYSA-N 1 1 249.398 3.712 20 0 BHADMO CC(C)C[C@@H]1CCC[N@H+]([C@H](C)c2cccnc2)C1 ZINC000345842397 386121710 /nfs/dbraw/zinc/12/17/10/386121710.db2.gz IRQGCGJMTMQVPE-CABCVRRESA-N 1 1 246.398 3.901 20 0 BHADMO CC(C)C[C@@H]1CCC[N@H+]([C@@H](C)c2cccnc2)C1 ZINC000345842399 386121747 /nfs/dbraw/zinc/12/17/47/386121747.db2.gz IRQGCGJMTMQVPE-GJZGRUSLSA-N 1 1 246.398 3.901 20 0 BHADMO CC(C)C[C@H]1CCC[N@H+]([C@H](C)c2cccnc2)C1 ZINC000345842400 386121845 /nfs/dbraw/zinc/12/18/45/386121845.db2.gz IRQGCGJMTMQVPE-HUUCEWRRSA-N 1 1 246.398 3.901 20 0 BHADMO CC(C)C[C@H]1CCC[N@H+]([C@@H](C)c2cccnc2)C1 ZINC000345842401 386124640 /nfs/dbraw/zinc/12/46/40/386124640.db2.gz IRQGCGJMTMQVPE-LSDHHAIUSA-N 1 1 246.398 3.901 20 0 BHADMO Cc1cccc(C[N@@H+]2CCC[C@@H](CC(C)C)C2)n1 ZINC000345877844 354794682 /nfs/dbraw/zinc/79/46/82/354794682.db2.gz YNNZLASXBYRMQO-HNNXBMFYSA-N 1 1 246.398 3.648 20 0 BHADMO Cc1cccc(C[N@@H+]2CCC[C@H](CC(C)C)C2)n1 ZINC000345877846 354795481 /nfs/dbraw/zinc/79/54/81/354795481.db2.gz YNNZLASXBYRMQO-OAHLLOKOSA-N 1 1 246.398 3.648 20 0 BHADMO CC(C)c1cnc(C[N@H+](C)[C@H](C)C(C)C)s1 ZINC000346129784 187362738 /nfs/dbraw/zinc/36/27/38/187362738.db2.gz HJSRQEFLIAPACN-LLVKDONJSA-N 1 1 240.416 3.743 20 0 BHADMO CC(C)c1cnc(C[N@H+](C)[C@@H](C)C(C)C)s1 ZINC000346129786 386163020 /nfs/dbraw/zinc/16/30/20/386163020.db2.gz HJSRQEFLIAPACN-NSHDSACASA-N 1 1 240.416 3.743 20 0 BHADMO CC[C@@H]1CCC[N@H+]1Cc1ncc(C(C)C)s1 ZINC000346132462 354869994 /nfs/dbraw/zinc/86/99/94/354869994.db2.gz LPZJZZKELMPJOF-LLVKDONJSA-N 1 1 238.400 3.641 20 0 BHADMO CC[C@H]1CCC[N@H+]1Cc1ncc(C(C)C)s1 ZINC000346132464 386163911 /nfs/dbraw/zinc/16/39/11/386163911.db2.gz LPZJZZKELMPJOF-NSHDSACASA-N 1 1 238.400 3.641 20 0 BHADMO C[C@H]1CCCC[C@@H]1C[N@@H+](C)Cc1ccoc1 ZINC000346133075 177079627 /nfs/dbraw/zinc/07/96/27/177079627.db2.gz MDJXACBVKWXMQH-GXTWGEPZSA-N 1 1 221.344 3.538 20 0 BHADMO C[C@H]1CCCC[C@H]1C[N@@H+](C)Cc1ccoc1 ZINC000346133076 177085159 /nfs/dbraw/zinc/08/51/59/177085159.db2.gz MDJXACBVKWXMQH-JSGCOSHPSA-N 1 1 221.344 3.538 20 0 BHADMO C[C@@H]1CCCC[C@H]1C[N@@H+](C)Cc1ccoc1 ZINC000346133077 176084280 /nfs/dbraw/zinc/08/42/80/176084280.db2.gz MDJXACBVKWXMQH-OCCSQVGLSA-N 1 1 221.344 3.538 20 0 BHADMO C[C@@H]1CCCC[C@@H]1C[N@@H+](C)Cc1ccoc1 ZINC000346133078 176075295 /nfs/dbraw/zinc/07/52/95/176075295.db2.gz MDJXACBVKWXMQH-TZMCWYRMSA-N 1 1 221.344 3.538 20 0 BHADMO CC[N@@H+](Cc1cc(C)c2ncccc2c1)C1CC1 ZINC000346138206 354870057 /nfs/dbraw/zinc/87/00/57/354870057.db2.gz TTZMHRNIWDDIIK-UHFFFAOYSA-N 1 1 240.350 3.528 20 0 BHADMO CCC[N@@H+](CC)Cc1cc(C)c2ncccc2c1 ZINC000346139135 169129383 /nfs/dbraw/zinc/12/93/83/169129383.db2.gz KMYLPOSFHCWPIA-UHFFFAOYSA-N 1 1 242.366 3.775 20 0 BHADMO CCc1cnc(C[N@@H+](CC(C)C)C(C)C)s1 ZINC000346140201 354870988 /nfs/dbraw/zinc/87/09/88/354870988.db2.gz XDOQBQGASSTODX-UHFFFAOYSA-N 1 1 240.416 3.572 20 0 BHADMO Cc1cc[nH+]c(N[C@@H]2CSc3ccccc32)c1 ZINC000346158933 386171745 /nfs/dbraw/zinc/17/17/45/386171745.db2.gz CSKGCTFGEQVKPU-GFCCVEGCSA-N 1 1 242.347 3.649 20 0 BHADMO Cc1cc[nH+]c(N[C@H]2CSc3ccccc32)c1 ZINC000346158938 386171039 /nfs/dbraw/zinc/17/10/39/386171039.db2.gz CSKGCTFGEQVKPU-LBPRGKRZSA-N 1 1 242.347 3.649 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)Cc1ncc(C(C)C)s1 ZINC000346159486 169365658 /nfs/dbraw/zinc/36/56/58/169365658.db2.gz VLEXXOMMHHHUFA-LLVKDONJSA-N 1 1 240.416 3.887 20 0 BHADMO CCC[C@H](C)[N@@H+](C)Cc1ncc(C(C)C)s1 ZINC000346159488 386171877 /nfs/dbraw/zinc/17/18/77/386171877.db2.gz VLEXXOMMHHHUFA-NSHDSACASA-N 1 1 240.416 3.887 20 0 BHADMO CC(C)c1cnc(C[N@@H+](C)CC(C)(C)C)s1 ZINC000346162000 386171476 /nfs/dbraw/zinc/17/14/76/386171476.db2.gz YDHTXSKYUMNZCX-UHFFFAOYSA-N 1 1 240.416 3.744 20 0 BHADMO CCC[N@H+](Cc1ncc(CC)s1)CC(C)C ZINC000346166743 169180298 /nfs/dbraw/zinc/18/02/98/169180298.db2.gz GEQDYFNFGACXDZ-UHFFFAOYSA-N 1 1 240.416 3.574 20 0 BHADMO CCC(C)(C)[N@@H+](C)Cc1ncc(C(C)C)s1 ZINC000346167435 168288712 /nfs/dbraw/zinc/28/87/12/168288712.db2.gz KIKKFRSTMWLPJE-UHFFFAOYSA-N 1 1 240.416 3.887 20 0 BHADMO Cc1cc(C[N@@H+]2CCC[C@H]2C)cc2cccnc12 ZINC000346169724 386172706 /nfs/dbraw/zinc/17/27/06/386172706.db2.gz MXQJOPJGUNVLAU-CYBMUJFWSA-N 1 1 240.350 3.528 20 0 BHADMO Cc1cc(C[N@@H+]2CCC[C@@H]2C)cc2cccnc12 ZINC000346169725 386172763 /nfs/dbraw/zinc/17/27/63/386172763.db2.gz MXQJOPJGUNVLAU-ZDUSSCGKSA-N 1 1 240.350 3.528 20 0 BHADMO CC[N@@H+](Cc1cc(C)c2ncccc2c1)C(C)C ZINC000346187518 386181057 /nfs/dbraw/zinc/18/10/57/386181057.db2.gz WXHMIROVZWYDDB-UHFFFAOYSA-N 1 1 242.366 3.774 20 0 BHADMO CCc1cnc(C[N@H+](CC)C[C@H](C)CC)s1 ZINC000346188153 386182310 /nfs/dbraw/zinc/18/23/10/386182310.db2.gz UWGKHLOZBRVFKQ-LLVKDONJSA-N 1 1 240.416 3.574 20 0 BHADMO CCc1cnc(C[N@H+](CC)C[C@@H](C)CC)s1 ZINC000346188155 386181459 /nfs/dbraw/zinc/18/14/59/386181459.db2.gz UWGKHLOZBRVFKQ-NSHDSACASA-N 1 1 240.416 3.574 20 0 BHADMO CC[C@@H](C)[N@@H+](C)Cc1cc(C)c2ncccc2c1 ZINC000346188891 386180840 /nfs/dbraw/zinc/18/08/40/386180840.db2.gz YFSRGXWJJOAPHB-CYBMUJFWSA-N 1 1 242.366 3.774 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1cc(C)c2ncccc2c1 ZINC000346188892 171308448 /nfs/dbraw/zinc/30/84/48/171308448.db2.gz YFSRGXWJJOAPHB-ZDUSSCGKSA-N 1 1 242.366 3.774 20 0 BHADMO CCc1cnc(C[N@H+](CC)[C@H](C)C(C)C)s1 ZINC000346189849 354875870 /nfs/dbraw/zinc/87/58/70/354875870.db2.gz ZSEDMCXZHDFILH-LLVKDONJSA-N 1 1 240.416 3.572 20 0 BHADMO CCc1cnc(C[N@H+](CC)[C@@H](C)C(C)C)s1 ZINC000346189850 354876170 /nfs/dbraw/zinc/87/61/70/354876170.db2.gz ZSEDMCXZHDFILH-NSHDSACASA-N 1 1 240.416 3.572 20 0 BHADMO Cc1cccc(C[N@H+](C)C[C@H]2CCCC[C@@H]2C)n1 ZINC000346194236 179066578 /nfs/dbraw/zinc/06/65/78/179066578.db2.gz XZUSXCDKTZYVAY-DZGCQCFKSA-N 1 1 246.398 3.648 20 0 BHADMO Cc1cccc(C[N@H+](C)C[C@@H]2CCCC[C@H]2C)n1 ZINC000346194238 179065114 /nfs/dbraw/zinc/06/51/14/179065114.db2.gz XZUSXCDKTZYVAY-HIFRSBDPSA-N 1 1 246.398 3.648 20 0 BHADMO Cc1cccc(C[N@H+](C)C[C@H]2CCCC[C@H]2C)n1 ZINC000346194239 179066560 /nfs/dbraw/zinc/06/65/60/179066560.db2.gz XZUSXCDKTZYVAY-UKRRQHHQSA-N 1 1 246.398 3.648 20 0 BHADMO Cc1cccc(C[N@H+](C)C[C@@H]2CCCC[C@@H]2C)n1 ZINC000346194241 179067290 /nfs/dbraw/zinc/06/72/90/179067290.db2.gz XZUSXCDKTZYVAY-ZFWWWQNUSA-N 1 1 246.398 3.648 20 0 BHADMO CC[N@H+](Cc1ccccn1)C[C@@H]1CCCC[C@H]1C ZINC000346215278 354873371 /nfs/dbraw/zinc/87/33/71/354873371.db2.gz ZYZWJISTNJLLIM-CABCVRRESA-N 1 1 246.398 3.730 20 0 BHADMO CC[N@H+](Cc1ccccn1)C[C@@H]1CCCC[C@@H]1C ZINC000346215279 354873332 /nfs/dbraw/zinc/87/33/32/354873332.db2.gz ZYZWJISTNJLLIM-GJZGRUSLSA-N 1 1 246.398 3.730 20 0 BHADMO CC[N@H+](Cc1ccccn1)C[C@H]1CCCC[C@H]1C ZINC000346215280 354873739 /nfs/dbraw/zinc/87/37/39/354873739.db2.gz ZYZWJISTNJLLIM-HUUCEWRRSA-N 1 1 246.398 3.730 20 0 BHADMO CC[N@H+](Cc1ccccn1)C[C@H]1CCCC[C@@H]1C ZINC000346215281 354873500 /nfs/dbraw/zinc/87/35/00/354873500.db2.gz ZYZWJISTNJLLIM-LSDHHAIUSA-N 1 1 246.398 3.730 20 0 BHADMO Cc1cc(C[N@H+](C)C2CCC2)cc2cccnc12 ZINC000346215571 386173707 /nfs/dbraw/zinc/17/37/07/386173707.db2.gz KMPJSAIGSPQJBZ-UHFFFAOYSA-N 1 1 240.350 3.528 20 0 BHADMO Cc1cc[nH+]c(N[C@@H](C)c2c(F)cccc2F)c1 ZINC000346222018 386175930 /nfs/dbraw/zinc/17/59/30/386175930.db2.gz LIPAKJJHHSHMLM-JTQLQIEISA-N 1 1 248.276 3.841 20 0 BHADMO Cc1cc[nH+]c(N[C@H](C)c2c(F)cccc2F)c1 ZINC000346222020 386175395 /nfs/dbraw/zinc/17/53/95/386175395.db2.gz LIPAKJJHHSHMLM-SNVBAGLBSA-N 1 1 248.276 3.841 20 0 BHADMO Cc1cccc(N[C@@H]2CSc3ccccc32)[nH+]1 ZINC000346222624 179154930 /nfs/dbraw/zinc/15/49/30/179154930.db2.gz LZWMSBRDDITONL-GFCCVEGCSA-N 1 1 242.347 3.649 20 0 BHADMO Cc1cccc(N[C@H]2CSc3ccccc32)[nH+]1 ZINC000346222626 179158439 /nfs/dbraw/zinc/15/84/39/179158439.db2.gz LZWMSBRDDITONL-LBPRGKRZSA-N 1 1 242.347 3.649 20 0 BHADMO Cc1cc(C[N@H+](C)CC(C)C)cc2cccnc12 ZINC000346223766 386176028 /nfs/dbraw/zinc/17/60/28/386176028.db2.gz UMHBRRVOJXWSLM-UHFFFAOYSA-N 1 1 242.366 3.631 20 0 BHADMO Cc1cc[nH+]c(N[C@H](c2cccnc2)C(C)C)c1 ZINC000346229950 386175718 /nfs/dbraw/zinc/17/57/18/386175718.db2.gz SRACXHUCHQEARR-HNNXBMFYSA-N 1 1 241.338 3.594 20 0 BHADMO CC[N@@H+](Cc1ncc(C(C)C)s1)C1CCC1 ZINC000346233830 354875280 /nfs/dbraw/zinc/87/52/80/354875280.db2.gz ZNIOKOOGVJOGGK-UHFFFAOYSA-N 1 1 238.400 3.641 20 0 BHADMO Cc1ccc2c(c1)CC[C@@H]2Nc1cccc(C)[nH+]1 ZINC000346241398 386182797 /nfs/dbraw/zinc/18/27/97/386182797.db2.gz RARWHPXXTPUTRC-HNNXBMFYSA-N 1 1 238.334 3.798 20 0 BHADMO Cc1ccc2c(c1)CC[C@H]2Nc1cccc(C)[nH+]1 ZINC000346241399 386181225 /nfs/dbraw/zinc/18/12/25/386181225.db2.gz RARWHPXXTPUTRC-OAHLLOKOSA-N 1 1 238.334 3.798 20 0 BHADMO COc1cccc([C@@H](C)Nc2cccc(C)[nH+]2)c1 ZINC000346245001 175288054 /nfs/dbraw/zinc/28/80/54/175288054.db2.gz UVQMELUUDXNSKR-GFCCVEGCSA-N 1 1 242.322 3.572 20 0 BHADMO COc1cccc([C@H](C)Nc2cccc(C)[nH+]2)c1 ZINC000346245002 175294000 /nfs/dbraw/zinc/29/40/00/175294000.db2.gz UVQMELUUDXNSKR-LBPRGKRZSA-N 1 1 242.322 3.572 20 0 BHADMO Cc1cccc(N[C@@H](C)c2c(F)cccc2F)[nH+]1 ZINC000346251148 354879751 /nfs/dbraw/zinc/87/97/51/354879751.db2.gz YHKJJBHEUSZGTC-JTQLQIEISA-N 1 1 248.276 3.841 20 0 BHADMO Cc1cccc(N[C@H](C)c2c(F)cccc2F)[nH+]1 ZINC000346251150 354879731 /nfs/dbraw/zinc/87/97/31/354879731.db2.gz YHKJJBHEUSZGTC-SNVBAGLBSA-N 1 1 248.276 3.841 20 0 BHADMO COc1ccccc1[C@@H](C)Nc1cc(C)cc[nH+]1 ZINC000346266101 354884873 /nfs/dbraw/zinc/88/48/73/354884873.db2.gz OQDRCTINHRHAKZ-GFCCVEGCSA-N 1 1 242.322 3.572 20 0 BHADMO COc1ccccc1[C@H](C)Nc1cc(C)cc[nH+]1 ZINC000346266106 354884618 /nfs/dbraw/zinc/88/46/18/354884618.db2.gz OQDRCTINHRHAKZ-LBPRGKRZSA-N 1 1 242.322 3.572 20 0 BHADMO Cc1cc[nH+]c(N[C@H]2CCc3c2cccc3F)c1 ZINC000346286371 386189844 /nfs/dbraw/zinc/18/98/44/386189844.db2.gz ZHHWBGHZFWEEAE-AWEZNQCLSA-N 1 1 242.297 3.629 20 0 BHADMO Cc1cc[nH+]c(N[C@@H]2CCc3c2cccc3F)c1 ZINC000346286372 386189762 /nfs/dbraw/zinc/18/97/62/386189762.db2.gz ZHHWBGHZFWEEAE-CQSZACIVSA-N 1 1 242.297 3.629 20 0 BHADMO CCC[N@@H+](CC)Cc1cc(-c2ccccc2)no1 ZINC000346288173 169130230 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ZYKIRTSZDSKBDI-UHFFFAOYSA-N 1 1 246.329 3.606 20 0 BHADMO CCC[N@@H+](CC)Cc1ccc(SC)cc1 ZINC000346351670 354888389 /nfs/dbraw/zinc/88/83/89/354888389.db2.gz NZTVXFNAUFUDQR-UHFFFAOYSA-N 1 1 223.385 3.640 20 0 BHADMO CCC[N@@H+](CC)Cc1nc2ccccc2s1 ZINC000346351894 354888210 /nfs/dbraw/zinc/88/82/10/354888210.db2.gz XNGLNFRAPXVPAR-UHFFFAOYSA-N 1 1 234.368 3.528 20 0 BHADMO CCC(CC)[N@@H+](CC[C@@H]1CCCO1)CC(C)C ZINC000346378846 354904929 /nfs/dbraw/zinc/90/49/29/354904929.db2.gz FUZROQJCEPEQBX-HNNXBMFYSA-N 1 1 241.419 3.702 20 0 BHADMO CCC(CC)[N@@H+](CC[C@H]1CCCO1)CC(C)C ZINC000346378848 354905157 /nfs/dbraw/zinc/90/51/57/354905157.db2.gz FUZROQJCEPEQBX-OAHLLOKOSA-N 1 1 241.419 3.702 20 0 BHADMO COC(C)(C)CC[N@@H+](C)C1CCC(C)(C)CC1 ZINC000346417860 135925971 /nfs/dbraw/zinc/92/59/71/135925971.db2.gz VZZYHSBORFCMIR-UHFFFAOYSA-N 1 1 241.419 3.702 20 0 BHADMO CC(C)C[N@@H+](CC[C@@H]1CCCO1)CC(C)(C)C ZINC000346420706 354922844 /nfs/dbraw/zinc/92/28/44/354922844.db2.gz ZKVRWVKXFRWNNO-AWEZNQCLSA-N 1 1 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UPQUETGZLRZERC-AWEZNQCLSA-N 1 1 247.382 3.747 20 0 BHADMO CCC(=O)CCC[N@@H+](C)[C@H](C)c1ccc(C)cc1 ZINC000347744422 136234198 /nfs/dbraw/zinc/23/41/98/136234198.db2.gz UPQUETGZLRZERC-CQSZACIVSA-N 1 1 247.382 3.747 20 0 BHADMO Cc1[nH+]ccn1CCCCS[C@H](C)C(C)C ZINC000347749602 136011398 /nfs/dbraw/zinc/01/13/98/136011398.db2.gz UTIVMWCMFMILDO-GFCCVEGCSA-N 1 1 240.416 3.749 20 0 BHADMO Cc1[nH+]ccn1CCCCS[C@@H](C)C(C)C ZINC000347749605 136011445 /nfs/dbraw/zinc/01/14/45/136011445.db2.gz UTIVMWCMFMILDO-LBPRGKRZSA-N 1 1 240.416 3.749 20 0 BHADMO C[C@@H](c1cccnc1)[N@@H+](C)CC12CCC(CC1)C2 ZINC000347750311 136011590 /nfs/dbraw/zinc/01/15/90/136011590.db2.gz AHAGSFUKMIIQDJ-HLIUYOAVSA-N 1 1 244.382 3.655 20 0 BHADMO C[C@H](c1cccnc1)[N@@H+](C)CC12CCC(CC1)C2 ZINC000347750317 136011513 /nfs/dbraw/zinc/01/15/13/136011513.db2.gz AHAGSFUKMIIQDJ-VQCLRJIVSA-N 1 1 244.382 3.655 20 0 BHADMO Cc1cc[nH+]c(N2CCC[C@@]3(CC=CCC3)C2)c1 ZINC000347752777 136011277 /nfs/dbraw/zinc/01/12/77/136011277.db2.gz 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CCc1ccc(C[N@H+]2CCC[C@](C)(CC)C2)cn1 ZINC000347862659 136293519 /nfs/dbraw/zinc/29/35/19/136293519.db2.gz MAFCNLWBEISMPS-INIZCTEOSA-N 1 1 246.398 3.656 20 0 BHADMO CCc1ccc(C[N@H+]2CCC[C@@](C)(CC)C2)cn1 ZINC000347862661 136293086 /nfs/dbraw/zinc/29/30/86/136293086.db2.gz MAFCNLWBEISMPS-MRXNPFEDSA-N 1 1 246.398 3.656 20 0 BHADMO CC[N@@H+](Cc1ccc2occc2c1)C1CCC1 ZINC000347862827 136293080 /nfs/dbraw/zinc/29/30/80/136293080.db2.gz WLKZFHAPJRIUKI-UHFFFAOYSA-N 1 1 229.323 3.807 20 0 BHADMO c1cc2cc(C[N@H+]3CCC4(CCC4)C3)ccc2o1 ZINC000347869014 136016618 /nfs/dbraw/zinc/01/66/18/136016618.db2.gz QXHTZDZBDXUYLE-UHFFFAOYSA-N 1 1 241.334 3.809 20 0 BHADMO CSC1(C[N@H+]2CCC[C@H]3CCCC[C@H]32)CC1 ZINC000347875623 136016992 /nfs/dbraw/zinc/01/69/92/136016992.db2.gz WPUMJTAGELOCSZ-CHWSQXEVSA-N 1 1 239.428 3.537 20 0 BHADMO CSC1(C[N@H+]2CCC[C@H]3CCCC[C@@H]32)CC1 ZINC000347875625 136017136 /nfs/dbraw/zinc/01/71/36/136017136.db2.gz WPUMJTAGELOCSZ-OLZOCXBDSA-N 1 1 239.428 3.537 20 0 BHADMO 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1 247.382 3.629 20 0 BHADMO CC[C@@H]1CC[N@@H+](Cc2ccc3occc3c2)C1 ZINC000347935174 136019068 /nfs/dbraw/zinc/01/90/68/136019068.db2.gz ZQCJYLDLPYLGHT-GFCCVEGCSA-N 1 1 229.323 3.665 20 0 BHADMO CC[C@H]1CC[N@@H+](Cc2ccc3occc3c2)C1 ZINC000347935177 136019035 /nfs/dbraw/zinc/01/90/35/136019035.db2.gz ZQCJYLDLPYLGHT-LBPRGKRZSA-N 1 1 229.323 3.665 20 0 BHADMO CC(C)[C@@H]1CC[N@H+]1Cc1ccc2occc2c1 ZINC000347962952 136017901 /nfs/dbraw/zinc/01/79/01/136017901.db2.gz QINBUOGUZPHMQD-AWEZNQCLSA-N 1 1 229.323 3.663 20 0 BHADMO CC(C)[C@H]1CC[N@H+]1Cc1ccc2occc2c1 ZINC000347962957 535202270 /nfs/dbraw/zinc/20/22/70/535202270.db2.gz QINBUOGUZPHMQD-CQSZACIVSA-N 1 1 229.323 3.663 20 0 BHADMO CC(C)C[N@@H+](C)Cc1cccc(C(F)F)c1 ZINC000347964867 535023516 /nfs/dbraw/zinc/02/35/16/535023516.db2.gz LNCKXOVZPKBZSH-UHFFFAOYSA-N 1 1 227.298 3.712 20 0 BHADMO CC[N@@H+](Cc1cccc(C(F)F)c1)C(C)C ZINC000347967548 136017498 /nfs/dbraw/zinc/01/74/98/136017498.db2.gz PBOLOTHDDMTOMV-UHFFFAOYSA-N 1 1 227.298 3.855 20 0 BHADMO C[C@@H]1CCC[N@@H+](Cc2cccc(C(F)F)c2)C1 ZINC000347973414 136022482 /nfs/dbraw/zinc/02/24/82/136022482.db2.gz QZRLEWBZACMAMZ-LLVKDONJSA-N 1 1 239.309 3.856 20 0 BHADMO C[C@H]1CCC[N@@H+](Cc2cccc(C(F)F)c2)C1 ZINC000347973415 136022677 /nfs/dbraw/zinc/02/26/77/136022677.db2.gz QZRLEWBZACMAMZ-NSHDSACASA-N 1 1 239.309 3.856 20 0 BHADMO C[C@@H]1CCCC[N@H+]1Cc1cccc(C(F)F)c1 ZINC000347973481 136022922 /nfs/dbraw/zinc/02/29/22/136022922.db2.gz RKXDIGLVZANPBP-LLVKDONJSA-N 1 1 239.309 3.999 20 0 BHADMO C[C@H]1CCCC[N@H+]1Cc1cccc(C(F)F)c1 ZINC000347973485 136022897 /nfs/dbraw/zinc/02/28/97/136022897.db2.gz RKXDIGLVZANPBP-NSHDSACASA-N 1 1 239.309 3.999 20 0 BHADMO CC(C)[N@@H+](Cc1cccc(C(F)F)c1)C1CC1 ZINC000347976020 535094687 /nfs/dbraw/zinc/09/46/87/535094687.db2.gz XSAKETXYPZZWQE-UHFFFAOYSA-N 1 1 239.309 3.997 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1cccc(C(F)F)c1 ZINC000348023265 136022649 /nfs/dbraw/zinc/02/26/49/136022649.db2.gz AITYWXISOGSZHF-JTQLQIEISA-N 1 1 227.298 3.855 20 0 BHADMO CC[C@@H](C)[N@@H+](C)Cc1cccc(C(F)F)c1 ZINC000348023267 136022561 /nfs/dbraw/zinc/02/25/61/136022561.db2.gz AITYWXISOGSZHF-SNVBAGLBSA-N 1 1 227.298 3.855 20 0 BHADMO CC1(C)CCC[N@H+]1Cc1cccc(C(F)F)c1 ZINC000348027711 136026802 /nfs/dbraw/zinc/02/68/02/136026802.db2.gz GALGMIVKVYVTOC-UHFFFAOYSA-N 1 1 239.309 3.999 20 0 BHADMO CC1=CC[N@@H+](Cc2cccc(C(F)F)c2)CC1 ZINC000348044560 136029389 /nfs/dbraw/zinc/02/93/89/136029389.db2.gz ZZRVKOXALBUBMC-UHFFFAOYSA-N 1 1 237.293 3.776 20 0 BHADMO C[C@@H]1CC[N@@H+](Cc2cccc(C(F)F)c2)[C@@H]1C ZINC000348044992 136029754 /nfs/dbraw/zinc/02/97/54/136029754.db2.gz CGAQQGBGQAYPSK-GHMZBOCLSA-N 1 1 239.309 3.855 20 0 BHADMO C[C@@H]1CC[N@@H+](Cc2cccc(C(F)F)c2)[C@H]1C ZINC000348045000 136029663 /nfs/dbraw/zinc/02/96/63/136029663.db2.gz CGAQQGBGQAYPSK-MNOVXSKESA-N 1 1 239.309 3.855 20 0 BHADMO C[C@H]1CC[N@@H+](Cc2cccc(C(F)F)c2)[C@H]1C ZINC000348045008 136029582 /nfs/dbraw/zinc/02/95/82/136029582.db2.gz CGAQQGBGQAYPSK-QWRGUYRKSA-N 1 1 239.309 3.855 20 0 BHADMO C[C@@H]1[C@@H](C)CC[N@H+]1Cc1cccc(C(F)F)c1 ZINC000348045012 136029765 /nfs/dbraw/zinc/02/97/65/136029765.db2.gz CGAQQGBGQAYPSK-WDEREUQCSA-N 1 1 239.309 3.855 20 0 BHADMO CC[N@@H+](Cc1cccc(C(F)F)c1)C1CCC1 ZINC000348047994 136030153 /nfs/dbraw/zinc/03/01/53/136030153.db2.gz MLFWJFBEFOCVHT-UHFFFAOYSA-N 1 1 239.309 3.999 20 0 BHADMO C[N@@H+](CCC1CC1)Cc1cccc(C(F)F)c1 ZINC000348054308 136031408 /nfs/dbraw/zinc/03/14/08/136031408.db2.gz XNHQYZLHQOVDEZ-UHFFFAOYSA-N 1 1 239.309 3.856 20 0 BHADMO C[C@@]1(F)CC[N@@H+](Cc2cccc(C(F)F)c2)C1 ZINC000348058927 136024083 /nfs/dbraw/zinc/02/40/83/136024083.db2.gz VMXONKGVIQIXCN-CYBMUJFWSA-N 1 1 243.272 3.558 20 0 BHADMO C[C@@]1(F)CC[N@H+](Cc2cccc(C(F)F)c2)C1 ZINC000348058927 136024082 /nfs/dbraw/zinc/02/40/82/136024082.db2.gz VMXONKGVIQIXCN-CYBMUJFWSA-N 1 1 243.272 3.558 20 0 BHADMO C[C@]1(F)CC[N@@H+](Cc2cccc(C(F)F)c2)C1 ZINC000348059093 136024405 /nfs/dbraw/zinc/02/44/05/136024405.db2.gz VMXONKGVIQIXCN-ZDUSSCGKSA-N 1 1 243.272 3.558 20 0 BHADMO 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/nfs/dbraw/zinc/42/11/44/355421144.db2.gz CMVLWZJZQRLBON-UHFFFAOYSA-N 1 1 232.371 3.545 20 0 BHADMO CC(C)c1ncc(C[N@@H+](C)C2CCCC2)s1 ZINC000349747226 355422565 /nfs/dbraw/zinc/42/25/65/355422565.db2.gz JAEVKRHDPAJHCG-UHFFFAOYSA-N 1 1 238.400 3.641 20 0 BHADMO C[N@@H+](Cc1cc2cc(F)ccc2o1)C1CCCC1 ZINC000349748547 355422620 /nfs/dbraw/zinc/42/26/20/355422620.db2.gz OCSPVBCONXZCIP-UHFFFAOYSA-N 1 1 247.313 3.946 20 0 BHADMO C[N@@H+](Cc1coc2ccccc12)C1CCCC1 ZINC000349764292 355439118 /nfs/dbraw/zinc/43/91/18/355439118.db2.gz MJPPNJBXGNLVJC-UHFFFAOYSA-N 1 1 229.323 3.807 20 0 BHADMO CC[N@@H+](C)Cc1c(Cl)oc2ccccc21 ZINC000349790801 355464207 /nfs/dbraw/zinc/46/42/07/355464207.db2.gz NGNHDYHSSVKCPN-UHFFFAOYSA-N 1 1 223.703 3.538 20 0 BHADMO Cc1ccc([C@@H]2CCC[N@H+]2Cc2ccco2)cc1 ZINC000349792741 355463928 /nfs/dbraw/zinc/46/39/28/355463928.db2.gz YZTLGWYGXJYSBW-INIZCTEOSA-N 1 1 241.334 3.925 20 0 BHADMO Cc1ccc([C@H]2CCC[N@H+]2Cc2ccco2)cc1 ZINC000349792742 355464083 /nfs/dbraw/zinc/46/40/83/355464083.db2.gz YZTLGWYGXJYSBW-MRXNPFEDSA-N 1 1 241.334 3.925 20 0 BHADMO CC[N@@H+](Cc1cc2cc(F)ccc2o1)C(C)C ZINC000349792785 355463998 /nfs/dbraw/zinc/46/39/98/355463998.db2.gz ZXRXFVFAFZSPCW-UHFFFAOYSA-N 1 1 235.302 3.802 20 0 BHADMO CC[N@@H+](C)Cc1ccc(-c2ccccc2F)o1 ZINC000349799790 355464856 /nfs/dbraw/zinc/46/48/56/355464856.db2.gz AWXMWVLNTFHMLM-UHFFFAOYSA-N 1 1 233.286 3.537 20 0 BHADMO CC[N@@H+](Cc1c(C)oc2ccccc21)C(C)C ZINC000349800486 355465292 /nfs/dbraw/zinc/46/52/92/355465292.db2.gz DVKDBMPNYDTCRB-UHFFFAOYSA-N 1 1 231.339 3.972 20 0 BHADMO CC[N@@H+](C)Cc1cc2cc(C)c(C)cc2o1 ZINC000349802642 355466236 /nfs/dbraw/zinc/46/62/36/355466236.db2.gz WMKSFNJDFUFSCR-UHFFFAOYSA-N 1 1 217.312 3.501 20 0 BHADMO CC[N@@H+](Cc1ccc(OC)cc1Cl)C(C)C ZINC000349815406 355467633 /nfs/dbraw/zinc/46/76/33/355467633.db2.gz AVLYMZIXBLENFN-UHFFFAOYSA-N 1 1 241.762 3.579 20 0 BHADMO CCc1ccc(C[N@@H+](Cc2ccco2)C(C)C)o1 ZINC000349820571 355469561 /nfs/dbraw/zinc/46/95/61/355469561.db2.gz WMABMUCKKQFBLM-UHFFFAOYSA-N 1 1 247.338 3.846 20 0 BHADMO CC(C)[N@@H+](Cc1ccco1)Cc1ccccc1F ZINC000349829161 355486936 /nfs/dbraw/zinc/48/69/36/355486936.db2.gz BWLWOLSLIVNNDV-UHFFFAOYSA-N 1 1 247.313 3.829 20 0 BHADMO CC(C)[N@H+](Cc1ccco1)Cc1ccccc1F ZINC000349829161 355486935 /nfs/dbraw/zinc/48/69/35/355486935.db2.gz BWLWOLSLIVNNDV-UHFFFAOYSA-N 1 1 247.313 3.829 20 0 BHADMO CC(C)[N@@H+](Cc1ccco1)Cc1ccc(F)cc1 ZINC000349830268 355487944 /nfs/dbraw/zinc/48/79/44/355487944.db2.gz GJUZDNASRBYHTE-UHFFFAOYSA-N 1 1 247.313 3.829 20 0 BHADMO CC(C)[N@H+](Cc1ccco1)C[C@H]1CC=CCC1 ZINC000349830523 355487768 /nfs/dbraw/zinc/48/77/68/355487768.db2.gz HOEFVBKMSPQTKF-AWEZNQCLSA-N 1 1 233.355 3.846 20 0 BHADMO CC(C)[N@H+](Cc1ccco1)C[C@@H]1CC=CCC1 ZINC000349830526 355487752 /nfs/dbraw/zinc/48/77/52/355487752.db2.gz HOEFVBKMSPQTKF-CQSZACIVSA-N 1 1 233.355 3.846 20 0 BHADMO CC(C)C[N@@H+](C)Cc1cnc(C(C)(C)C)s1 ZINC000349830706 355487681 /nfs/dbraw/zinc/48/76/81/355487681.db2.gz IPOOTQUEIMKNIY-UHFFFAOYSA-N 1 1 240.416 3.528 20 0 BHADMO CCC[C@H]([NH2+][C@H](C)c1ccon1)c1ccccc1 ZINC000349832049 355488916 /nfs/dbraw/zinc/48/89/16/355488916.db2.gz IYKZDEINLSOXJB-DOMZBBRYSA-N 1 1 244.338 3.867 20 0 BHADMO CCC[C@@H]([NH2+][C@H](C)c1ccon1)c1ccccc1 ZINC000349832053 355488863 /nfs/dbraw/zinc/48/88/63/355488863.db2.gz IYKZDEINLSOXJB-IUODEOHRSA-N 1 1 244.338 3.867 20 0 BHADMO CCC[C@@H]([NH2+][C@@H](C)c1ccon1)c1ccccc1 ZINC000349832054 355488737 /nfs/dbraw/zinc/48/87/37/355488737.db2.gz IYKZDEINLSOXJB-SWLSCSKDSA-N 1 1 244.338 3.867 20 0 BHADMO CCC[C@H]([NH2+][C@@H](C)c1ccon1)c1ccccc1 ZINC000349832057 355488839 /nfs/dbraw/zinc/48/88/39/355488839.db2.gz IYKZDEINLSOXJB-WFASDCNBSA-N 1 1 244.338 3.867 20 0 BHADMO CC(C)[N@@H+](Cc1ccco1)Cc1cccc(F)c1 ZINC000349833247 355489203 /nfs/dbraw/zinc/48/92/03/355489203.db2.gz RYSKOAXBCDBTMZ-UHFFFAOYSA-N 1 1 247.313 3.829 20 0 BHADMO Cc1ccccc1C[N@H+](Cc1ccco1)C(C)C ZINC000349834866 355489883 /nfs/dbraw/zinc/48/98/83/355489883.db2.gz ZORJRYGSYPQYTJ-UHFFFAOYSA-N 1 1 243.350 3.999 20 0 BHADMO CC[C@@H]([NH2+][C@@H](C)c1ccon1)c1ccc(C)cc1 ZINC000349839233 133918086 /nfs/dbraw/zinc/91/80/86/133918086.db2.gz YXOVSYHXYIRRFJ-GXTWGEPZSA-N 1 1 244.338 3.785 20 0 BHADMO CC[C@H]([NH2+][C@@H](C)c1ccon1)c1ccc(C)cc1 ZINC000349839234 355490923 /nfs/dbraw/zinc/49/09/23/355490923.db2.gz YXOVSYHXYIRRFJ-JSGCOSHPSA-N 1 1 244.338 3.785 20 0 BHADMO CC[C@H]([NH2+][C@H](C)c1ccon1)c1ccc(C)cc1 ZINC000349839235 355491799 /nfs/dbraw/zinc/49/17/99/355491799.db2.gz YXOVSYHXYIRRFJ-OCCSQVGLSA-N 1 1 244.338 3.785 20 0 BHADMO CC[C@@H]([NH2+][C@H](C)c1ccon1)c1ccc(C)cc1 ZINC000349839236 355491926 /nfs/dbraw/zinc/49/19/26/355491926.db2.gz YXOVSYHXYIRRFJ-TZMCWYRMSA-N 1 1 244.338 3.785 20 0 BHADMO Cc1cccc(C[N@H+](Cc2ccco2)C(C)C)c1 ZINC000349841148 355491824 /nfs/dbraw/zinc/49/18/24/355491824.db2.gz UUHDITOFKYGWKI-UHFFFAOYSA-N 1 1 243.350 3.999 20 0 BHADMO COc1ccc2oc(C[N@@H+](C)CC(C)C)cc2c1 ZINC000349852607 355483479 /nfs/dbraw/zinc/48/34/79/355483479.db2.gz DNSMXUDDOYGZED-UHFFFAOYSA-N 1 1 247.338 3.529 20 0 BHADMO CC(C)C[N@@H+](C)Cc1cc2cc(F)ccc2o1 ZINC000349854306 355496288 /nfs/dbraw/zinc/49/62/88/355496288.db2.gz NXANPWVXMNNRNU-UHFFFAOYSA-N 1 1 235.302 3.660 20 0 BHADMO CC(C)C[N@@H+](C)Cc1coc2ccccc12 ZINC000349862808 355512283 /nfs/dbraw/zinc/51/22/83/355512283.db2.gz ZNYSMMGWTGAYTL-UHFFFAOYSA-N 1 1 217.312 3.521 20 0 BHADMO Cc1oc2ccccc2c1C[N@H+](C)CC(C)C ZINC000349870236 355512814 /nfs/dbraw/zinc/51/28/14/355512814.db2.gz AXSXOQSNJJLWNC-UHFFFAOYSA-N 1 1 231.339 3.829 20 0 BHADMO CCC[N@@H+](C)Cc1c(C)oc2ccccc21 ZINC000349871364 355513954 /nfs/dbraw/zinc/51/39/54/355513954.db2.gz FVGJPLAHWAWWGY-UHFFFAOYSA-N 1 1 217.312 3.583 20 0 BHADMO C[C@@H]1C[C@@H]1c1ccc(C[N@@H+](CC2CC2)C2CC2)o1 ZINC000349921432 355527819 /nfs/dbraw/zinc/52/78/19/355527819.db2.gz RMSGLEOAKPHLAO-ABAIWWIYSA-N 1 1 245.366 3.777 20 0 BHADMO C[C@@H]1C[C@H]1c1ccc(C[N@@H+](CC2CC2)C2CC2)o1 ZINC000349921434 355527757 /nfs/dbraw/zinc/52/77/57/355527757.db2.gz RMSGLEOAKPHLAO-IAQYHMDHSA-N 1 1 245.366 3.777 20 0 BHADMO C[C@H]1C[C@@H]1c1ccc(C[N@@H+](CC2CC2)C2CC2)o1 ZINC000349921436 355527597 /nfs/dbraw/zinc/52/75/97/355527597.db2.gz RMSGLEOAKPHLAO-NHYWBVRUSA-N 1 1 245.366 3.777 20 0 BHADMO C[C@H]1C[C@H]1c1ccc(C[N@@H+](CC2CC2)C2CC2)o1 ZINC000349921438 355527726 /nfs/dbraw/zinc/52/77/26/355527726.db2.gz RMSGLEOAKPHLAO-XHDPSFHLSA-N 1 1 245.366 3.777 20 0 BHADMO C[C@H](c1ccccc1F)[N@@H+](C)Cc1ccoc1 ZINC000349922150 355528362 /nfs/dbraw/zinc/52/83/62/355528362.db2.gz VPLNYADTNXGPKX-LLVKDONJSA-N 1 1 233.286 3.612 20 0 BHADMO C[C@H](c1ccccc1F)[N@H+](C)Cc1ccoc1 ZINC000349922150 355528360 /nfs/dbraw/zinc/52/83/60/355528360.db2.gz VPLNYADTNXGPKX-LLVKDONJSA-N 1 1 233.286 3.612 20 0 BHADMO C[C@@H](c1ccccc1F)[N@@H+](C)Cc1ccoc1 ZINC000349922151 355528315 /nfs/dbraw/zinc/52/83/15/355528315.db2.gz VPLNYADTNXGPKX-NSHDSACASA-N 1 1 233.286 3.612 20 0 BHADMO C[C@@H](c1ccccc1F)[N@H+](C)Cc1ccoc1 ZINC000349922151 355528312 /nfs/dbraw/zinc/52/83/12/355528312.db2.gz VPLNYADTNXGPKX-NSHDSACASA-N 1 1 233.286 3.612 20 0 BHADMO CC1CCC([N@@H+](Cc2cccn2C)C2CC2)CC1 ZINC000349922549 355528538 /nfs/dbraw/zinc/52/85/38/355528538.db2.gz XTBJZOXMRGVSGY-UHFFFAOYSA-N 1 1 246.398 3.568 20 0 BHADMO CC1CCC([N@@H+](Cc2ccn(C)c2)C2CC2)CC1 ZINC000349941554 355532833 /nfs/dbraw/zinc/53/28/33/355532833.db2.gz ARRGRMAZJCAZRS-UHFFFAOYSA-N 1 1 246.398 3.568 20 0 BHADMO CC(C)CC[N@@H+](Cc1ccsc1)C1CC1 ZINC000349943679 358000960 /nfs/dbraw/zinc/00/09/60/358000960.db2.gz IXHJQWJAQOBXET-UHFFFAOYSA-N 1 1 223.385 3.759 20 0 BHADMO Cc1ccoc1C[N@H+](CCC(C)C)C1CC1 ZINC000349944230 636539501 /nfs/dbraw/zinc/53/95/01/636539501.db2.gz KCYZQUXZPPPLLA-UHFFFAOYSA-N 1 1 221.344 3.599 20 0 BHADMO CC1CCC([N@@H+](Cc2ccco2)C2CC2)CC1 ZINC000349945422 355533514 /nfs/dbraw/zinc/53/35/14/355533514.db2.gz OBRJZHSCHDMVEQ-UHFFFAOYSA-N 1 1 233.355 3.823 20 0 BHADMO Cc1ccoc1C[N@H+](C)[C@H]1CCc2ccccc21 ZINC000350002048 355573615 /nfs/dbraw/zinc/57/36/15/355573615.db2.gz LLLRQLFCWDVWPU-HNNXBMFYSA-N 1 1 241.334 3.707 20 0 BHADMO Cc1ccoc1C[N@H+](C)[C@@H]1CCc2ccccc21 ZINC000350002049 355573288 /nfs/dbraw/zinc/57/32/88/355573288.db2.gz LLLRQLFCWDVWPU-OAHLLOKOSA-N 1 1 241.334 3.707 20 0 BHADMO C[C@H]1c2ccsc2CC[N@@H+]1Cc1ccsc1 ZINC000350015023 355575822 /nfs/dbraw/zinc/57/58/22/355575822.db2.gz KDLYJTWLQJYUSP-JTQLQIEISA-N 1 1 249.404 3.929 20 0 BHADMO C[C@@H]1c2ccsc2CC[N@@H+]1Cc1ccsc1 ZINC000350015024 355575996 /nfs/dbraw/zinc/57/59/96/355575996.db2.gz KDLYJTWLQJYUSP-SNVBAGLBSA-N 1 1 249.404 3.929 20 0 BHADMO C[C@H]1c2ccsc2CC[N@@H+]1Cc1cccs1 ZINC000350019110 355577134 /nfs/dbraw/zinc/57/71/34/355577134.db2.gz UAZYGALVZHVXFJ-JTQLQIEISA-N 1 1 249.404 3.929 20 0 BHADMO C[C@@H]1c2ccsc2CC[N@@H+]1Cc1cccs1 ZINC000350019112 355576699 /nfs/dbraw/zinc/57/66/99/355576699.db2.gz UAZYGALVZHVXFJ-SNVBAGLBSA-N 1 1 249.404 3.929 20 0 BHADMO Cc1ccc(C[N@H+]2CCc3sccc3[C@H]2C)o1 ZINC000350036682 136353128 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/nfs/dbraw/zinc/99/25/60/355992560.db2.gz FSKWFJRBXMQJTK-HNNXBMFYSA-N 1 1 244.338 3.648 20 0 BHADMO CC[C@H](c1ccccc1)[N@@H+](CC)Cc1ccon1 ZINC000351438860 355992515 /nfs/dbraw/zinc/99/25/15/355992515.db2.gz FSKWFJRBXMQJTK-OAHLLOKOSA-N 1 1 244.338 3.648 20 0 BHADMO CC[C@H](c1ccccc1)[N@H+](CC)Cc1ccon1 ZINC000351438860 355992512 /nfs/dbraw/zinc/99/25/12/355992512.db2.gz FSKWFJRBXMQJTK-OAHLLOKOSA-N 1 1 244.338 3.648 20 0 BHADMO CCC(C)(C)[N@@H+](C)Cc1ccsc1C ZINC000351499845 535355460 /nfs/dbraw/zinc/35/54/60/535355460.db2.gz CVUWJXIBGCTGOE-UHFFFAOYSA-N 1 1 211.374 3.677 20 0 BHADMO c1cc(C[N@@H+]2CCC[C@H]2CCC2CCCC2)no1 ZINC000351531900 356009868 /nfs/dbraw/zinc/00/98/68/356009868.db2.gz FGXBBIMJXGKUQZ-HNNXBMFYSA-N 1 1 248.370 3.609 20 0 BHADMO c1cc(C[N@@H+]2CCC[C@@H]2CCC2CCCC2)no1 ZINC000351531901 356010230 /nfs/dbraw/zinc/01/02/30/356010230.db2.gz FGXBBIMJXGKUQZ-OAHLLOKOSA-N 1 1 248.370 3.609 20 0 BHADMO CCC[C@@H]1CCCC[N@H+]1Cc1scnc1C ZINC000351580943 535411051 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3.534 20 0 BHADMO Cc1sccc1C[N@@H+]1CC[C@@H](C)[C@@H](C)C1 ZINC000351620872 136247859 /nfs/dbraw/zinc/24/78/59/136247859.db2.gz SMDKHSSJJLAGJN-MNOVXSKESA-N 1 1 223.385 3.534 20 0 BHADMO Cc1sccc1C[N@@H+]1CC[C@H](C)[C@@H](C)C1 ZINC000351620873 136248054 /nfs/dbraw/zinc/24/80/54/136248054.db2.gz SMDKHSSJJLAGJN-QWRGUYRKSA-N 1 1 223.385 3.534 20 0 BHADMO Cc1sccc1C[N@@H+]1CC[C@H](C)[C@H](C)C1 ZINC000351620874 136247847 /nfs/dbraw/zinc/24/78/47/136247847.db2.gz SMDKHSSJJLAGJN-WDEREUQCSA-N 1 1 223.385 3.534 20 0 BHADMO CSCC[N@@H+](C)Cc1ccc(C2CCC2)cc1 ZINC000351621942 136248728 /nfs/dbraw/zinc/24/87/28/136248728.db2.gz AOXRNLLDHQRCIX-UHFFFAOYSA-N 1 1 249.423 3.749 20 0 BHADMO Cc1ccc(NCc2ccc3occc3c2)[nH+]c1 ZINC000351621979 356031425 /nfs/dbraw/zinc/03/14/25/356031425.db2.gz AYLAHALGSQIIGJ-UHFFFAOYSA-N 1 1 238.290 3.748 20 0 BHADMO Cc1cccc(NCc2ccc3occc3c2)[nH+]1 ZINC000351625192 356033864 /nfs/dbraw/zinc/03/38/64/356033864.db2.gz SZBAPDXXZWZKIA-UHFFFAOYSA-N 1 1 238.290 3.748 20 0 BHADMO Cc1sccc1C[N@H+]1C[C@H](C)CC[C@H]1C ZINC000351625443 136248837 /nfs/dbraw/zinc/24/88/37/136248837.db2.gz YSMGVBIRKWXKFU-GHMZBOCLSA-N 1 1 223.385 3.677 20 0 BHADMO Cc1sccc1C[N@H+]1C[C@H](C)CC[C@@H]1C ZINC000351625444 136248787 /nfs/dbraw/zinc/24/87/87/136248787.db2.gz YSMGVBIRKWXKFU-MNOVXSKESA-N 1 1 223.385 3.677 20 0 BHADMO Cc1sccc1C[N@H+]1C[C@@H](C)CC[C@@H]1C ZINC000351625445 136248929 /nfs/dbraw/zinc/24/89/29/136248929.db2.gz YSMGVBIRKWXKFU-QWRGUYRKSA-N 1 1 223.385 3.677 20 0 BHADMO Cc1sccc1C[N@H+]1C[C@@H](C)CC[C@H]1C ZINC000351625446 136248659 /nfs/dbraw/zinc/24/86/59/136248659.db2.gz YSMGVBIRKWXKFU-WDEREUQCSA-N 1 1 223.385 3.677 20 0 BHADMO CC[N@@H+](CCc1ccncc1)[C@@H]1CCCC[C@H]1C ZINC000351627561 136248675 /nfs/dbraw/zinc/24/86/75/136248675.db2.gz GSMFNQYNLPEZEM-GDBMZVCRSA-N 1 1 246.398 3.525 20 0 BHADMO CC[N@@H+](CCc1ccncc1)[C@@H]1CCCC[C@@H]1C ZINC000351627562 136248723 /nfs/dbraw/zinc/24/87/23/136248723.db2.gz GSMFNQYNLPEZEM-GOEBONIOSA-N 1 1 246.398 3.525 20 0 BHADMO CC[N@@H+](CCc1ccncc1)[C@H]1CCCC[C@@H]1C ZINC000351627563 136248607 /nfs/dbraw/zinc/24/86/07/136248607.db2.gz GSMFNQYNLPEZEM-HOCLYGCPSA-N 1 1 246.398 3.525 20 0 BHADMO CC[N@@H+](CCc1ccncc1)[C@H]1CCCC[C@H]1C ZINC000351627564 136248664 /nfs/dbraw/zinc/24/86/64/136248664.db2.gz GSMFNQYNLPEZEM-ZBFHGGJFSA-N 1 1 246.398 3.525 20 0 BHADMO Cc1cc[nH+]c(NCc2ccc3occc3c2)c1 ZINC000351640605 356040347 /nfs/dbraw/zinc/04/03/47/356040347.db2.gz IHWOFKFLHYJVHO-UHFFFAOYSA-N 1 1 238.290 3.748 20 0 BHADMO CSCC[C@H](C)[N@@H+](C)Cc1ccsc1C ZINC000351641847 356041124 /nfs/dbraw/zinc/04/11/24/356041124.db2.gz RKPALRRYJMCTPW-JTQLQIEISA-N 1 1 243.441 3.630 20 0 BHADMO CSCC[C@@H](C)[N@@H+](C)Cc1ccsc1C ZINC000351641848 356040823 /nfs/dbraw/zinc/04/08/23/356040823.db2.gz RKPALRRYJMCTPW-SNVBAGLBSA-N 1 1 243.441 3.630 20 0 BHADMO Cc1ccc[nH+]c1NCc1ccc2occc2c1 ZINC000351641997 356040894 /nfs/dbraw/zinc/04/08/94/356040894.db2.gz SHCYWINEORCYHC-UHFFFAOYSA-N 1 1 238.290 3.748 20 0 BHADMO Cc1sccc1C[N@H+](C(C)C)C1CCC1 ZINC000351643869 356042431 /nfs/dbraw/zinc/04/24/31/356042431.db2.gz JPPFXDKUBGHTHH-UHFFFAOYSA-N 1 1 223.385 3.819 20 0 BHADMO CC[N@@H+](CCc1cccs1)Cc1occc1C ZINC000351645873 356043386 /nfs/dbraw/zinc/04/33/86/356043386.db2.gz YLWLKVCXUMHEED-UHFFFAOYSA-N 1 1 249.379 3.714 20 0 BHADMO Cc1ncccc1C[N@H+]1CCCC2(CCCC2)C1 ZINC000351651767 136249168 /nfs/dbraw/zinc/24/91/68/136249168.db2.gz RITIHLXBAGBCCC-UHFFFAOYSA-N 1 1 244.382 3.546 20 0 BHADMO CC[N@@H+](CCc1cccs1)Cc1ccc(C)o1 ZINC000351657643 356046716 /nfs/dbraw/zinc/04/67/16/356046716.db2.gz CEBRDLYGWNADGR-UHFFFAOYSA-N 1 1 249.379 3.714 20 0 BHADMO CC[C@]1(C)CC[N@@H+](Cc2ccsc2C)C1 ZINC000351685056 356057168 /nfs/dbraw/zinc/05/71/68/356057168.db2.gz AWRSXLDOHQWSOW-CYBMUJFWSA-N 1 1 223.385 3.679 20 0 BHADMO CC[C@@]1(C)CC[N@@H+](Cc2ccsc2C)C1 ZINC000351685057 356057400 /nfs/dbraw/zinc/05/74/00/356057400.db2.gz AWRSXLDOHQWSOW-ZDUSSCGKSA-N 1 1 223.385 3.679 20 0 BHADMO Cc1[nH+]ccn1Cc1cc(Cl)cc(Cl)c1 ZINC000351693375 356060134 /nfs/dbraw/zinc/06/01/34/356060134.db2.gz LAQNDCYXBWXHNL-UHFFFAOYSA-N 1 1 241.121 3.547 20 0 BHADMO Cc1[nH]ncc1C[N@H+](CCC(C)C)C1CCCC1 ZINC000351697654 356061475 /nfs/dbraw/zinc/06/14/75/356061475.db2.gz YFNSFQWDAPFXOL-UHFFFAOYSA-N 1 1 249.402 3.509 20 0 BHADMO Cc1[nH]ncc1C[N@@H+](CCC(C)C)C1CCCC1 ZINC000351697654 356061470 /nfs/dbraw/zinc/06/14/70/356061470.db2.gz YFNSFQWDAPFXOL-UHFFFAOYSA-N 1 1 249.402 3.509 20 0 BHADMO Cc1n[nH]cc1C[N@H+](CCC(C)C)C1CCCC1 ZINC000351697654 356061465 /nfs/dbraw/zinc/06/14/65/356061465.db2.gz YFNSFQWDAPFXOL-UHFFFAOYSA-N 1 1 249.402 3.509 20 0 BHADMO C[C@@H](F)CC[N@@H+]([C@H](C)c1ccco1)C1CC1 ZINC000351720529 356070224 /nfs/dbraw/zinc/07/02/24/356070224.db2.gz POPFCKDIWMZPBV-GHMZBOCLSA-N 1 1 225.307 3.553 20 0 BHADMO C[C@@H](F)CC[N@@H+]([C@@H](C)c1ccco1)C1CC1 ZINC000351720530 356070544 /nfs/dbraw/zinc/07/05/44/356070544.db2.gz POPFCKDIWMZPBV-MNOVXSKESA-N 1 1 225.307 3.553 20 0 BHADMO C[C@H](F)CC[N@@H+]([C@@H](C)c1ccco1)C1CC1 ZINC000351720531 356070626 /nfs/dbraw/zinc/07/06/26/356070626.db2.gz POPFCKDIWMZPBV-QWRGUYRKSA-N 1 1 225.307 3.553 20 0 BHADMO C[C@H](c1ccco1)[N@H+](CC[C@H](C)F)C1CC1 ZINC000351720532 356070599 /nfs/dbraw/zinc/07/05/99/356070599.db2.gz POPFCKDIWMZPBV-WDEREUQCSA-N 1 1 225.307 3.553 20 0 BHADMO CCC(CC)[N@H+](Cc1conc1C)CC(C)C ZINC000351721488 356071176 /nfs/dbraw/zinc/07/11/76/356071176.db2.gz SIGQAGBXCAVDPF-UHFFFAOYSA-N 1 1 238.375 3.630 20 0 BHADMO C[N@@H+](CCCCF)Cc1ccc(Cl)c(F)c1 ZINC000351729080 536334768 /nfs/dbraw/zinc/33/47/68/536334768.db2.gz CPNNXVWQDKMZKE-UHFFFAOYSA-N 1 1 247.716 3.661 20 0 BHADMO C[C@@H](F)CC[N@@H+](C)Cc1ccc(Cl)c(F)c1 ZINC000351730489 136250313 /nfs/dbraw/zinc/25/03/13/136250313.db2.gz OXWFETKHCLWUMY-SECBINFHSA-N 1 1 247.716 3.659 20 0 BHADMO C[C@H](F)CC[N@@H+](C)Cc1ccc(Cl)c(F)c1 ZINC000351730490 136250326 /nfs/dbraw/zinc/25/03/26/136250326.db2.gz OXWFETKHCLWUMY-VIFPVBQESA-N 1 1 247.716 3.659 20 0 BHADMO Cc1cc(Cl)cc(C[N@@H+](C)Cc2ccc[nH]2)c1 ZINC000351732871 356073472 /nfs/dbraw/zinc/07/34/72/356073472.db2.gz VBRBXTVRZDIVEI-UHFFFAOYSA-N 1 1 248.757 3.609 20 0 BHADMO Cc1sccc1C[N@H+](C)[C@H](C)C1(C)CC1 ZINC000351772867 356083691 /nfs/dbraw/zinc/08/36/91/356083691.db2.gz AALWPBINFZSLFX-LLVKDONJSA-N 1 1 223.385 3.677 20 0 BHADMO Cc1sccc1C[N@H+](C)[C@@H](C)C1(C)CC1 ZINC000351772868 356083794 /nfs/dbraw/zinc/08/37/94/356083794.db2.gz AALWPBINFZSLFX-NSHDSACASA-N 1 1 223.385 3.677 20 0 BHADMO CCC(C)(C)CC[N@@H+](C)[C@H](C)c1ccccn1 ZINC000351794717 136370431 /nfs/dbraw/zinc/37/04/31/136370431.db2.gz FYZKOPSESKQXBQ-CYBMUJFWSA-N 1 1 234.387 3.901 20 0 BHADMO CCC(C)(C)CC[N@@H+](C)[C@@H](C)c1ccccn1 ZINC000351794719 136370444 /nfs/dbraw/zinc/37/04/44/136370444.db2.gz FYZKOPSESKQXBQ-ZDUSSCGKSA-N 1 1 234.387 3.901 20 0 BHADMO CCCCC[C@H]1CCC[N@H+]1Cc1conc1C ZINC000351808720 356088654 /nfs/dbraw/zinc/08/86/54/356088654.db2.gz KJXSRZLVVKOBJL-AWEZNQCLSA-N 1 1 236.359 3.528 20 0 BHADMO CCCCC[C@@H]1CCC[N@H+]1Cc1conc1C ZINC000351808722 535122802 /nfs/dbraw/zinc/12/28/02/535122802.db2.gz KJXSRZLVVKOBJL-CQSZACIVSA-N 1 1 236.359 3.528 20 0 BHADMO CC[N@@H+](CC[C@@H](C)F)[C@@H](C)Cc1ccsc1 ZINC000351819865 356090046 /nfs/dbraw/zinc/09/00/46/356090046.db2.gz MFMWQLVGZSRYMX-NEPJUHHUSA-N 1 1 243.391 3.749 20 0 BHADMO CC[N@@H+](CC[C@H](C)F)[C@H](C)Cc1ccsc1 ZINC000351819866 356089657 /nfs/dbraw/zinc/08/96/57/356089657.db2.gz MFMWQLVGZSRYMX-NWDGAFQWSA-N 1 1 243.391 3.749 20 0 BHADMO CC[N@@H+](CC[C@H](C)F)[C@@H](C)Cc1ccsc1 ZINC000351819867 133986055 /nfs/dbraw/zinc/98/60/55/133986055.db2.gz MFMWQLVGZSRYMX-RYUDHWBXSA-N 1 1 243.391 3.749 20 0 BHADMO CC[N@@H+](CC[C@@H](C)F)[C@H](C)Cc1ccsc1 ZINC000351819868 356089289 /nfs/dbraw/zinc/08/92/89/356089289.db2.gz MFMWQLVGZSRYMX-VXGBXAGGSA-N 1 1 243.391 3.749 20 0 BHADMO CC[N@@H+](CC[C@@H](C)F)Cc1ccccc1C ZINC000351842850 356096222 /nfs/dbraw/zinc/09/62/22/356096222.db2.gz AFNDFSMJHXIUAY-CYBMUJFWSA-N 1 1 223.335 3.565 20 0 BHADMO CC[N@@H+](CC[C@H](C)F)Cc1ccccc1C ZINC000351842851 356095963 /nfs/dbraw/zinc/09/59/63/356095963.db2.gz AFNDFSMJHXIUAY-ZDUSSCGKSA-N 1 1 223.335 3.565 20 0 BHADMO Cc1ccccc1C[N@H+](CC[C@@H](C)F)C1CC1 ZINC000351843228 133986465 /nfs/dbraw/zinc/98/64/65/133986465.db2.gz CSLINGZCCFIDOR-CYBMUJFWSA-N 1 1 235.346 3.708 20 0 BHADMO Cc1ccccc1C[N@H+](CC[C@H](C)F)C1CC1 ZINC000351843229 356095709 /nfs/dbraw/zinc/09/57/09/356095709.db2.gz CSLINGZCCFIDOR-ZDUSSCGKSA-N 1 1 235.346 3.708 20 0 BHADMO CC1CCC([N@@H+](CCCCF)C2CC2)CC1 ZINC000351843378 356096265 /nfs/dbraw/zinc/09/62/65/356096265.db2.gz DSNUCKGVXBPPAX-UHFFFAOYSA-N 1 1 227.367 3.779 20 0 BHADMO CC[N@@H+](CCCCF)Cc1ccccc1C ZINC000351843407 356095739 /nfs/dbraw/zinc/09/57/39/356095739.db2.gz DYWKNLSNVNSRBG-UHFFFAOYSA-N 1 1 223.335 3.567 20 0 BHADMO CC(C)[N@@H+](CC[C@@H](C)F)Cc1cccs1 ZINC000351843611 535074419 /nfs/dbraw/zinc/07/44/19/535074419.db2.gz GWMDNTJFXGYMTP-LLVKDONJSA-N 1 1 229.364 3.707 20 0 BHADMO CC(C)[N@@H+](CC[C@H](C)F)Cc1cccs1 ZINC000351843613 535073757 /nfs/dbraw/zinc/07/37/57/535073757.db2.gz GWMDNTJFXGYMTP-NSHDSACASA-N 1 1 229.364 3.707 20 0 BHADMO CC(C)[N@@H+](CC[C@@H](C)F)Cc1ccccc1F ZINC000351844521 535073830 /nfs/dbraw/zinc/07/38/30/535073830.db2.gz LTARGMPACYPIKT-GFCCVEGCSA-N 1 1 241.325 3.784 20 0 BHADMO CC(C)[N@@H+](CC[C@H](C)F)Cc1ccccc1F ZINC000351844522 535074427 /nfs/dbraw/zinc/07/44/27/535074427.db2.gz LTARGMPACYPIKT-LBPRGKRZSA-N 1 1 241.325 3.784 20 0 BHADMO CC(C)[N@@H+](CCCCF)Cc1ccccc1F ZINC000351844685 535052333 /nfs/dbraw/zinc/05/23/33/535052333.db2.gz MVPRHXVEPTUBSV-UHFFFAOYSA-N 1 1 241.325 3.786 20 0 BHADMO Cc1ccccc1C[N@@H+](CCCCF)C1CC1 ZINC000351845295 136257325 /nfs/dbraw/zinc/25/73/25/136257325.db2.gz RYJGWBZQKAQLGB-UHFFFAOYSA-N 1 1 235.346 3.709 20 0 BHADMO C[C@@H](F)CC[N@H+]1CCC[C@@H]1c1cccc(F)c1 ZINC000351845308 136257011 /nfs/dbraw/zinc/25/70/11/136257011.db2.gz SDNBCSLVOHGGDB-BXUZGUMPSA-N 1 1 239.309 3.711 20 0 BHADMO C[C@H](F)CC[N@H+]1CCC[C@H]1c1cccc(F)c1 ZINC000351845309 136257401 /nfs/dbraw/zinc/25/74/01/136257401.db2.gz SDNBCSLVOHGGDB-FZMZJTMJSA-N 1 1 239.309 3.711 20 0 BHADMO C[C@@H](F)CC[N@H+]1CCC[C@H]1c1cccc(F)c1 ZINC000351845310 136257204 /nfs/dbraw/zinc/25/72/04/136257204.db2.gz SDNBCSLVOHGGDB-RISCZKNCSA-N 1 1 239.309 3.711 20 0 BHADMO C[C@H](F)CC[N@H+]1CCC[C@@H]1c1cccc(F)c1 ZINC000351845311 136257342 /nfs/dbraw/zinc/25/73/42/136257342.db2.gz SDNBCSLVOHGGDB-SMDDNHRTSA-N 1 1 239.309 3.711 20 0 BHADMO CC(C)[N@@H+](CCCCF)Cc1cccs1 ZINC000351845527 535053153 /nfs/dbraw/zinc/05/31/53/535053153.db2.gz SSEIHVPFRBDFPA-UHFFFAOYSA-N 1 1 229.364 3.708 20 0 BHADMO C[C@H](F)CC[N@@H+](C1CC1)C1CCC(C)CC1 ZINC000351845529 136257105 /nfs/dbraw/zinc/25/71/05/136257105.db2.gz SUSUUUUGDMINRW-CPCZMJQVSA-N 1 1 227.367 3.778 20 0 BHADMO C[C@@H](F)CC[N@@H+](C1CC1)C1CCC(C)CC1 ZINC000351845530 136256992 /nfs/dbraw/zinc/25/69/92/136256992.db2.gz SUSUUUUGDMINRW-OTTFEQOBSA-N 1 1 227.367 3.778 20 0 BHADMO C[N@@H+](CCCCF)Cc1cccc(Cl)c1 ZINC000351852708 536334384 /nfs/dbraw/zinc/33/43/84/536334384.db2.gz KYQSJQRMAGIJOJ-UHFFFAOYSA-N 1 1 229.726 3.522 20 0 BHADMO C[C@H](F)CC[N@H+]1CCC[C@@H]1c1ccsc1 ZINC000351854509 136257988 /nfs/dbraw/zinc/25/79/88/136257988.db2.gz GVWPAQJUBRGDRT-CMPLNLGQSA-N 1 1 227.348 3.633 20 0 BHADMO C[C@H](F)CC[N@H+]1CCC[C@H]1c1ccsc1 ZINC000351854511 136257953 /nfs/dbraw/zinc/25/79/53/136257953.db2.gz GVWPAQJUBRGDRT-JQWIXIFHSA-N 1 1 227.348 3.633 20 0 BHADMO C[C@@H](F)CC[N@H+]1CCC[C@H]1c1ccsc1 ZINC000351854512 136258194 /nfs/dbraw/zinc/25/81/94/136258194.db2.gz GVWPAQJUBRGDRT-PWSUYJOCSA-N 1 1 227.348 3.633 20 0 BHADMO C[C@@H](F)CC[N@H+]1CCC[C@@H]1c1ccsc1 ZINC000351854514 136258236 /nfs/dbraw/zinc/25/82/36/136258236.db2.gz GVWPAQJUBRGDRT-ZYHUDNBSSA-N 1 1 227.348 3.633 20 0 BHADMO C[C@@H](F)CC[N@@H+](C)[C@H](C)c1cc(F)ccc1F ZINC000351854548 136258425 /nfs/dbraw/zinc/25/84/25/136258425.db2.gz DYUFKKSXUDYMON-NXEZZACHSA-N 1 1 245.288 3.706 20 0 BHADMO C[C@H](F)CC[N@@H+](C)[C@@H](C)c1cc(F)ccc1F ZINC000351854554 136258198 /nfs/dbraw/zinc/25/81/98/136258198.db2.gz DYUFKKSXUDYMON-UWVGGRQHSA-N 1 1 245.288 3.706 20 0 BHADMO C[C@H](c1cc(F)ccc1F)[N@H+](C)CC[C@H](C)F ZINC000351854555 136258288 /nfs/dbraw/zinc/25/82/88/136258288.db2.gz DYUFKKSXUDYMON-VHSXEESVSA-N 1 1 245.288 3.706 20 0 BHADMO C[C@@H](F)CC[N@@H+](C)[C@@H](C)c1cc(F)ccc1F ZINC000351854556 136258361 /nfs/dbraw/zinc/25/83/61/136258361.db2.gz DYUFKKSXUDYMON-ZJUUUORDSA-N 1 1 245.288 3.706 20 0 BHADMO CC(C)[N@@H+](CCCCF)Cc1ccccc1 ZINC000351860363 356097810 /nfs/dbraw/zinc/09/78/10/356097810.db2.gz PYMPDFHJCKLOOW-UHFFFAOYSA-N 1 1 223.335 3.647 20 0 BHADMO C[C@H](F)CC[N@@H+](C)Cc1cccc(Cl)c1 ZINC000351860749 356098164 /nfs/dbraw/zinc/09/81/64/356098164.db2.gz YOYDJOSELRSVPU-JTQLQIEISA-N 1 1 229.726 3.520 20 0 BHADMO C[C@@H](F)CC[N@@H+](C)Cc1cccc(Cl)c1 ZINC000351860750 356098188 /nfs/dbraw/zinc/09/81/88/356098188.db2.gz YOYDJOSELRSVPU-SNVBAGLBSA-N 1 1 229.726 3.520 20 0 BHADMO C[C@@H](F)CC[N@@H+](Cc1ccco1)C1CCCC1 ZINC000351861625 356099268 /nfs/dbraw/zinc/09/92/68/356099268.db2.gz NBEADYKMEUBSFJ-GFCCVEGCSA-N 1 1 239.334 3.772 20 0 BHADMO C[C@H](F)CC[N@@H+](Cc1ccco1)C1CCCC1 ZINC000351861626 356099496 /nfs/dbraw/zinc/09/94/96/356099496.db2.gz NBEADYKMEUBSFJ-LBPRGKRZSA-N 1 1 239.334 3.772 20 0 BHADMO C[C@@H](F)CC[N@@H+](C)[C@H](C)c1ccccc1F ZINC000351862966 356100918 /nfs/dbraw/zinc/10/09/18/356100918.db2.gz PULSMDOTZSTPIJ-GHMZBOCLSA-N 1 1 227.298 3.567 20 0 BHADMO C[C@@H](F)CC[N@@H+](C)[C@@H](C)c1ccccc1F ZINC000351862967 356100588 /nfs/dbraw/zinc/10/05/88/356100588.db2.gz PULSMDOTZSTPIJ-MNOVXSKESA-N 1 1 227.298 3.567 20 0 BHADMO C[C@H](F)CC[N@@H+](C)[C@@H](C)c1ccccc1F ZINC000351862968 356100928 /nfs/dbraw/zinc/10/09/28/356100928.db2.gz PULSMDOTZSTPIJ-QWRGUYRKSA-N 1 1 227.298 3.567 20 0 BHADMO C[C@H](c1ccccc1F)[N@H+](C)CC[C@H](C)F ZINC000351862969 356100430 /nfs/dbraw/zinc/10/04/30/356100430.db2.gz PULSMDOTZSTPIJ-WDEREUQCSA-N 1 1 227.298 3.567 20 0 BHADMO CC(C)[N@@H+](CC[C@@H](C)F)Cc1ccccc1 ZINC000351864561 356100227 /nfs/dbraw/zinc/10/02/27/356100227.db2.gz YMGBVFCUUVJVPR-CYBMUJFWSA-N 1 1 223.335 3.645 20 0 BHADMO CC(C)[N@@H+](CC[C@H](C)F)Cc1ccccc1 ZINC000351864562 356100249 /nfs/dbraw/zinc/10/02/49/356100249.db2.gz YMGBVFCUUVJVPR-ZDUSSCGKSA-N 1 1 223.335 3.645 20 0 BHADMO C[C@H](F)CC[N@@H+](C1CC1)[C@@H]1CCc2ccccc21 ZINC000351867220 356102842 /nfs/dbraw/zinc/10/28/42/356102842.db2.gz CFKXGUUKYNYEBC-BLLLJJGKSA-N 1 1 247.357 3.886 20 0 BHADMO C[C@H](F)CC[N@@H+](C1CC1)[C@H]1CCc2ccccc21 ZINC000351867221 356102829 /nfs/dbraw/zinc/10/28/29/356102829.db2.gz CFKXGUUKYNYEBC-LRDDRELGSA-N 1 1 247.357 3.886 20 0 BHADMO C[C@@H](F)CC[N@@H+](C1CC1)[C@@H]1CCc2ccccc21 ZINC000351867222 356102822 /nfs/dbraw/zinc/10/28/22/356102822.db2.gz CFKXGUUKYNYEBC-MLGOLLRUSA-N 1 1 247.357 3.886 20 0 BHADMO C[C@@H](F)CC[N@@H+](C1CC1)[C@H]1CCc2ccccc21 ZINC000351867223 356102791 /nfs/dbraw/zinc/10/27/91/356102791.db2.gz CFKXGUUKYNYEBC-WBMJQRKESA-N 1 1 247.357 3.886 20 0 BHADMO FCCCC[N@@H+](C1CC1)[C@H]1CCc2ccccc21 ZINC000351869355 136259176 /nfs/dbraw/zinc/25/91/76/136259176.db2.gz HUHROBZPSNCMMR-INIZCTEOSA-N 1 1 247.357 3.888 20 0 BHADMO FCCCC[N@@H+](C1CC1)[C@@H]1CCc2ccccc21 ZINC000351869356 136259078 /nfs/dbraw/zinc/25/90/78/136259078.db2.gz HUHROBZPSNCMMR-MRXNPFEDSA-N 1 1 247.357 3.888 20 0 BHADMO CC(C)CC[C@H]1CCC[N@H+]1CCCCF ZINC000351870407 534955744 /nfs/dbraw/zinc/95/57/44/534955744.db2.gz MJNKIJLKUCATBP-CYBMUJFWSA-N 1 1 215.356 3.637 20 0 BHADMO CC(C)CC[C@@H]1CCC[N@H+]1CCCCF ZINC000351870408 534924940 /nfs/dbraw/zinc/92/49/40/534924940.db2.gz MJNKIJLKUCATBP-ZDUSSCGKSA-N 1 1 215.356 3.637 20 0 BHADMO C[N@@H+](CCCCF)C1CCC(C)(C)CC1 ZINC000351871276 136260414 /nfs/dbraw/zinc/26/04/14/136260414.db2.gz SABWWTSLZWAVFQ-UHFFFAOYSA-N 1 1 215.356 3.637 20 0 BHADMO C[C@@H](F)CC[N@@H+](C)C1CCC(C)(C)CC1 ZINC000351871583 386797769 /nfs/dbraw/zinc/79/77/69/386797769.db2.gz UOSWITCMXOGMQA-LLVKDONJSA-N 1 1 215.356 3.635 20 0 BHADMO C[C@H](F)CC[N@@H+](C)C1CCC(C)(C)CC1 ZINC000351871584 386797868 /nfs/dbraw/zinc/79/78/68/386797868.db2.gz UOSWITCMXOGMQA-NSHDSACASA-N 1 1 215.356 3.635 20 0 BHADMO CC[N@@H+](CC[C@@H](C)F)[C@@H](C)c1cccc(O)c1 ZINC000351872235 356105651 /nfs/dbraw/zinc/10/56/51/356105651.db2.gz DBGXBSAXMHUOBY-NEPJUHHUSA-N 1 1 239.334 3.523 20 0 BHADMO CC[N@@H+](CC[C@H](C)F)[C@H](C)c1cccc(O)c1 ZINC000351872236 356105632 /nfs/dbraw/zinc/10/56/32/356105632.db2.gz DBGXBSAXMHUOBY-NWDGAFQWSA-N 1 1 239.334 3.523 20 0 BHADMO CC[N@@H+](CC[C@H](C)F)[C@@H](C)c1cccc(O)c1 ZINC000351872237 356106095 /nfs/dbraw/zinc/10/60/95/356106095.db2.gz DBGXBSAXMHUOBY-RYUDHWBXSA-N 1 1 239.334 3.523 20 0 BHADMO CC[N@@H+](CC[C@@H](C)F)[C@H](C)c1cccc(O)c1 ZINC000351872238 133988144 /nfs/dbraw/zinc/98/81/44/133988144.db2.gz DBGXBSAXMHUOBY-VXGBXAGGSA-N 1 1 239.334 3.523 20 0 BHADMO Cc1ccc(F)cc1C[N@H+]1CCCC2(CC2)C1 ZINC000351874887 136261365 /nfs/dbraw/zinc/26/13/65/136261365.db2.gz ATIQSXFMCSBYDZ-UHFFFAOYSA-N 1 1 233.330 3.510 20 0 BHADMO Cc1ccc(C[N@H+]2CCCC3(CC3)C2)cc1F ZINC000351874901 136261362 /nfs/dbraw/zinc/26/13/62/136261362.db2.gz BDNAWDABYFIYFD-UHFFFAOYSA-N 1 1 233.330 3.510 20 0 BHADMO Clc1cccc(C[N@H+]2CCCC3(CC3)C2)c1 ZINC000351876750 136261716 /nfs/dbraw/zinc/26/17/16/136261716.db2.gz FSUWWWGTVYRBCI-UHFFFAOYSA-N 1 1 235.758 3.716 20 0 BHADMO COCc1cccc(C[N@@H+](CC(C)C)C(C)C)c1 ZINC000351878018 136261852 /nfs/dbraw/zinc/26/18/52/136261852.db2.gz QTXNKUHKLASRCW-UHFFFAOYSA-N 1 1 249.398 3.699 20 0 BHADMO c1cc(C[N@H+]2CCCC3(CC3)C2)cc2c1CCC2 ZINC000351878827 136261890 /nfs/dbraw/zinc/26/18/90/136261890.db2.gz HNFINZRTUNSWTQ-UHFFFAOYSA-N 1 1 241.378 3.551 20 0 BHADMO COc1ccsc1C[N@@H+](CC(C)C)C(C)C ZINC000351885919 356139471 /nfs/dbraw/zinc/13/94/71/356139471.db2.gz ARCWZMHFOMSGMB-UHFFFAOYSA-N 1 1 241.400 3.623 20 0 BHADMO CC(C)[N@@H+](CC[C@@H](C)F)Cc1cccc(F)c1 ZINC000351887446 356146478 /nfs/dbraw/zinc/14/64/78/356146478.db2.gz BQEGFLJRTWADCE-GFCCVEGCSA-N 1 1 241.325 3.784 20 0 BHADMO CC(C)[N@@H+](CC[C@H](C)F)Cc1cccc(F)c1 ZINC000351887448 356146898 /nfs/dbraw/zinc/14/68/98/356146898.db2.gz BQEGFLJRTWADCE-LBPRGKRZSA-N 1 1 241.325 3.784 20 0 BHADMO C[C@@H](F)CC[N@@H+](Cc1cccc(F)c1)C1CC1 ZINC000351889855 356153023 /nfs/dbraw/zinc/15/30/23/356153023.db2.gz CQGLOPNFXUQJJM-LLVKDONJSA-N 1 1 239.309 3.538 20 0 BHADMO C[C@H](F)CC[N@@H+](Cc1cccc(F)c1)C1CC1 ZINC000351889857 356153061 /nfs/dbraw/zinc/15/30/61/356153061.db2.gz CQGLOPNFXUQJJM-NSHDSACASA-N 1 1 239.309 3.538 20 0 BHADMO c1ccc([C@@H]2C[C@@H]2C[N@H+]2CCCC3(CC3)C2)cc1 ZINC000351891013 356155569 /nfs/dbraw/zinc/15/55/69/356155569.db2.gz LKOBZSBVQDERFR-CVEARBPZSA-N 1 1 241.378 3.666 20 0 BHADMO c1ccc([C@@H]2C[C@H]2C[N@H+]2CCCC3(CC3)C2)cc1 ZINC000351891015 356155880 /nfs/dbraw/zinc/15/58/80/356155880.db2.gz LKOBZSBVQDERFR-HOTGVXAUSA-N 1 1 241.378 3.666 20 0 BHADMO c1ccc([C@H]2C[C@@H]2C[N@H+]2CCCC3(CC3)C2)cc1 ZINC000351891017 356155694 /nfs/dbraw/zinc/15/56/94/356155694.db2.gz LKOBZSBVQDERFR-HZPDHXFCSA-N 1 1 241.378 3.666 20 0 BHADMO c1ccc([C@H]2C[C@H]2C[N@H+]2CCCC3(CC3)C2)cc1 ZINC000351891019 356155686 /nfs/dbraw/zinc/15/56/86/356155686.db2.gz LKOBZSBVQDERFR-JKSUJKDBSA-N 1 1 241.378 3.666 20 0 BHADMO Cc1ccc(C[N@H+]2CCCC3(CC3)C2)cc1C ZINC000351891392 356156500 /nfs/dbraw/zinc/15/65/00/356156500.db2.gz MAJHGMVXCWJCKE-UHFFFAOYSA-N 1 1 229.367 3.679 20 0 BHADMO Cc1cc(F)ccc1C[N@H+]1CCCC2(CC2)C1 ZINC000351892237 356158844 /nfs/dbraw/zinc/15/88/44/356158844.db2.gz MQOWCSYVWBOINS-UHFFFAOYSA-N 1 1 233.330 3.510 20 0 BHADMO Cc1cccc(C[N@H+]2CCCC3(CC3)C2)c1C ZINC000351895520 356164500 /nfs/dbraw/zinc/16/45/00/356164500.db2.gz SXQLRJBSCIFJLU-UHFFFAOYSA-N 1 1 229.367 3.679 20 0 BHADMO Cc1ccc(C[N@H+]2CCCC3(CC3)C2)c(C)c1 ZINC000351896155 356165503 /nfs/dbraw/zinc/16/55/03/356165503.db2.gz VWAUGZWNZGXZFN-UHFFFAOYSA-N 1 1 229.367 3.679 20 0 BHADMO C[C@H](F)CC[N@@H+](C)Cc1ccc(Cl)cc1 ZINC000351896716 356166765 /nfs/dbraw/zinc/16/67/65/356166765.db2.gz FFHKWPQLATWLMH-JTQLQIEISA-N 1 1 229.726 3.520 20 0 BHADMO C[C@@H](F)CC[N@@H+](C)Cc1ccc(Cl)cc1 ZINC000351896717 356166598 /nfs/dbraw/zinc/16/65/98/356166598.db2.gz FFHKWPQLATWLMH-SNVBAGLBSA-N 1 1 229.726 3.520 20 0 BHADMO CC(C)[N@@H+](CCCCF)Cc1cccc(F)c1 ZINC000351901641 356173201 /nfs/dbraw/zinc/17/32/01/356173201.db2.gz HPDLMXZJIOACTM-UHFFFAOYSA-N 1 1 241.325 3.786 20 0 BHADMO C[C@@H](F)CC[N@@H+](C)[C@H](C)c1c(F)cccc1F ZINC000351904701 356176356 /nfs/dbraw/zinc/17/63/56/356176356.db2.gz JBZZKRRMVAOYBZ-NXEZZACHSA-N 1 1 245.288 3.706 20 0 BHADMO C[C@@H](F)CC[N@H+](C)[C@H](C)c1c(F)cccc1F ZINC000351904701 356176353 /nfs/dbraw/zinc/17/63/53/356176353.db2.gz JBZZKRRMVAOYBZ-NXEZZACHSA-N 1 1 245.288 3.706 20 0 BHADMO C[C@H](F)CC[N@@H+](C)[C@@H](C)c1c(F)cccc1F ZINC000351904702 356176128 /nfs/dbraw/zinc/17/61/28/356176128.db2.gz JBZZKRRMVAOYBZ-UWVGGRQHSA-N 1 1 245.288 3.706 20 0 BHADMO C[C@H](F)CC[N@H+](C)[C@@H](C)c1c(F)cccc1F ZINC000351904702 356176126 /nfs/dbraw/zinc/17/61/26/356176126.db2.gz JBZZKRRMVAOYBZ-UWVGGRQHSA-N 1 1 245.288 3.706 20 0 BHADMO C[C@H](c1c(F)cccc1F)[N@H+](C)CC[C@H](C)F ZINC000351904703 133997172 /nfs/dbraw/zinc/99/71/72/133997172.db2.gz JBZZKRRMVAOYBZ-VHSXEESVSA-N 1 1 245.288 3.706 20 0 BHADMO C[C@H](c1c(F)cccc1F)[N@@H+](C)CC[C@H](C)F ZINC000351904703 133997171 /nfs/dbraw/zinc/99/71/71/133997171.db2.gz JBZZKRRMVAOYBZ-VHSXEESVSA-N 1 1 245.288 3.706 20 0 BHADMO C[C@@H](F)CC[N@@H+](C)[C@@H](C)c1c(F)cccc1F ZINC000351904704 356176434 /nfs/dbraw/zinc/17/64/34/356176434.db2.gz JBZZKRRMVAOYBZ-ZJUUUORDSA-N 1 1 245.288 3.706 20 0 BHADMO C[C@@H](F)CC[N@H+](C)[C@@H](C)c1c(F)cccc1F ZINC000351904704 356176432 /nfs/dbraw/zinc/17/64/32/356176432.db2.gz JBZZKRRMVAOYBZ-ZJUUUORDSA-N 1 1 245.288 3.706 20 0 BHADMO C[N@@H+](CCCCF)Cc1ccc(Cl)cc1 ZINC000351905356 356179898 /nfs/dbraw/zinc/17/98/98/356179898.db2.gz JVLHNMVCZVSGAU-UHFFFAOYSA-N 1 1 229.726 3.522 20 0 BHADMO FCCCC[N@@H+](Cc1cccc(F)c1)C1CC1 ZINC000351905368 356179857 /nfs/dbraw/zinc/17/98/57/356179857.db2.gz JXVASEIZXPMCFX-UHFFFAOYSA-N 1 1 239.309 3.540 20 0 BHADMO CC(C)[N@@H+](CCCCF)Cc1ccc(F)cc1 ZINC000351908999 356183544 /nfs/dbraw/zinc/18/35/44/356183544.db2.gz NUELYYYKIISHAS-UHFFFAOYSA-N 1 1 241.325 3.786 20 0 BHADMO C[C@@H](c1c(F)cccc1F)[N@@H+](C)CCCCF ZINC000351914231 356198158 /nfs/dbraw/zinc/19/81/58/356198158.db2.gz VZKMOOZWQGMNAN-JTQLQIEISA-N 1 1 245.288 3.707 20 0 BHADMO C[C@H](c1c(F)cccc1F)[N@@H+](C)CCCCF ZINC000351914232 356198594 /nfs/dbraw/zinc/19/85/94/356198594.db2.gz VZKMOOZWQGMNAN-SNVBAGLBSA-N 1 1 245.288 3.707 20 0 BHADMO Cc1cc(C)cc(C[N@H+]2CCCC3(CC3)C2)c1 ZINC000351915634 356205220 /nfs/dbraw/zinc/20/52/20/356205220.db2.gz PUFOKTAVFLCTET-UHFFFAOYSA-N 1 1 229.367 3.679 20 0 BHADMO Cc1ccc(C)c(C[N@H+]2CCCC3(CC3)C2)c1 ZINC000351932063 134012437 /nfs/dbraw/zinc/01/24/37/134012437.db2.gz PKWQKGGQHUMNIM-UHFFFAOYSA-N 1 1 229.367 3.679 20 0 BHADMO c1oc2ccccc2c1C[N@H+]1CCCC2(CC2)C1 ZINC000351941300 134014998 /nfs/dbraw/zinc/01/49/98/134014998.db2.gz PDZNKKSHXRXESI-UHFFFAOYSA-N 1 1 241.334 3.809 20 0 BHADMO c1c2ccccc2oc1C[N@H+]1CCCC2(CC2)C1 ZINC000351941478 134024864 /nfs/dbraw/zinc/02/48/64/134024864.db2.gz RIQZDLMEZVBXGW-UHFFFAOYSA-N 1 1 241.334 3.809 20 0 BHADMO Cc1cc(C[N@H+]2CCCC3(CC3)C2)c(C)s1 ZINC000351941653 134025113 /nfs/dbraw/zinc/02/51/13/134025113.db2.gz USUIMAZEHCPVGN-UHFFFAOYSA-N 1 1 235.396 3.741 20 0 BHADMO Cc1ccc(F)c(C[N@H+]2CCCC3(CC3)C2)c1 ZINC000351941984 134025000 /nfs/dbraw/zinc/02/50/00/134025000.db2.gz ZFYWXJWFJBKUMI-UHFFFAOYSA-N 1 1 233.330 3.510 20 0 BHADMO CSc1ccc(C[N@H+]2CCCC3(CC3)C2)cc1 ZINC000351946635 134015623 /nfs/dbraw/zinc/01/56/23/134015623.db2.gz GFIBIGYEKJEWNU-UHFFFAOYSA-N 1 1 247.407 3.785 20 0 BHADMO Cc1cccc(C)c1C[N@H+]1CCCC2(CC2)C1 ZINC000351947036 134015084 /nfs/dbraw/zinc/01/50/84/134015084.db2.gz LOBFKAFMCHIQPH-UHFFFAOYSA-N 1 1 229.367 3.679 20 0 BHADMO CC[C@H]1CCC[N@@H+](Cc2ccc(Cl)o2)C1 ZINC000351963296 134024391 /nfs/dbraw/zinc/02/43/91/134024391.db2.gz CNOFGANDXOHMIK-JTQLQIEISA-N 1 1 227.735 3.555 20 0 BHADMO CC[C@@H]1CCC[N@@H+](Cc2ccc(Cl)o2)C1 ZINC000351963297 134024671 /nfs/dbraw/zinc/02/46/71/134024671.db2.gz CNOFGANDXOHMIK-SNVBAGLBSA-N 1 1 227.735 3.555 20 0 BHADMO C[N@@H+](CCCCc1ccccc1)Cc1ccoc1 ZINC000351971895 536341794 /nfs/dbraw/zinc/34/17/94/536341794.db2.gz GVCDTQKQVWTLCQ-UHFFFAOYSA-N 1 1 243.350 3.734 20 0 BHADMO Cc1oc2ccccc2c1C[N@H+]1CCC=C(F)C1 ZINC000351981227 134025433 /nfs/dbraw/zinc/02/54/33/134025433.db2.gz JXLMZLQAZXUAFY-UHFFFAOYSA-N 1 1 245.297 3.800 20 0 BHADMO Cc1oc2ccccc2c1C[N@@H+]1CCC=C(F)C1 ZINC000351981227 134025432 /nfs/dbraw/zinc/02/54/32/134025432.db2.gz JXLMZLQAZXUAFY-UHFFFAOYSA-N 1 1 245.297 3.800 20 0 BHADMO CC[C@H]1Cc2ccccc2C[N@H+]1CCCCF ZINC000351987562 134025891 /nfs/dbraw/zinc/02/58/91/134025891.db2.gz WQYLNNNNMYVZNP-HNNXBMFYSA-N 1 1 235.346 3.573 20 0 BHADMO CC[C@@H]1Cc2ccccc2C[N@H+]1CCCCF ZINC000351987563 134026136 /nfs/dbraw/zinc/02/61/36/134026136.db2.gz WQYLNNNNMYVZNP-OAHLLOKOSA-N 1 1 235.346 3.573 20 0 BHADMO CCSc1cccc(C[N@@H+](CC)C2CC2)c1 ZINC000351987810 134026522 /nfs/dbraw/zinc/02/65/22/134026522.db2.gz AVVIVKNXOMTOOJ-UHFFFAOYSA-N 1 1 235.396 3.783 20 0 BHADMO CC[N@@H+](Cc1ncc(Cl)s1)[C@H](C)C(C)C ZINC000351988949 535392522 /nfs/dbraw/zinc/39/25/22/535392522.db2.gz NXHZRKPDHRPZPO-SECBINFHSA-N 1 1 246.807 3.663 20 0 BHADMO CC[N@@H+](Cc1ncc(Cl)s1)[C@@H](C)C(C)C ZINC000351988950 535392705 /nfs/dbraw/zinc/39/27/05/535392705.db2.gz NXHZRKPDHRPZPO-VIFPVBQESA-N 1 1 246.807 3.663 20 0 BHADMO CCCC[N@@H+](Cc1ncc(Cl)s1)C1CC1 ZINC000351989601 134026853 /nfs/dbraw/zinc/02/68/53/134026853.db2.gz VHBOOGHVZJMJRP-UHFFFAOYSA-N 1 1 244.791 3.561 20 0 BHADMO CCCC[N@H+](Cc1ncc(Cl)s1)C1CC1 ZINC000351989601 134026852 /nfs/dbraw/zinc/02/68/52/134026852.db2.gz VHBOOGHVZJMJRP-UHFFFAOYSA-N 1 1 244.791 3.561 20 0 BHADMO CC(C)C[N@@H+](Cc1ncc(Cl)s1)C(C)C ZINC000351989961 134027042 /nfs/dbraw/zinc/02/70/42/134027042.db2.gz XBFBUCVDZVIPRC-UHFFFAOYSA-N 1 1 246.807 3.663 20 0 BHADMO CC[C@@H](C)C[N@@H+](CC)Cc1ncc(Cl)s1 ZINC000351993521 535511441 /nfs/dbraw/zinc/51/14/41/535511441.db2.gz AUKAPZWEALXOSA-SECBINFHSA-N 1 1 246.807 3.665 20 0 BHADMO CC[C@H](C)C[N@@H+](CC)Cc1ncc(Cl)s1 ZINC000351993522 134032820 /nfs/dbraw/zinc/03/28/20/134032820.db2.gz AUKAPZWEALXOSA-VIFPVBQESA-N 1 1 246.807 3.665 20 0 BHADMO CCSc1cccc(C[N@H+]2CCC[C@H]2C)c1 ZINC000351996456 134033088 /nfs/dbraw/zinc/03/30/88/134033088.db2.gz PBIAQIIUFLHXOQ-GFCCVEGCSA-N 1 1 235.396 3.783 20 0 BHADMO CCSc1cccc(C[N@H+]2CCC[C@@H]2C)c1 ZINC000351996457 134033260 /nfs/dbraw/zinc/03/32/60/134033260.db2.gz PBIAQIIUFLHXOQ-LBPRGKRZSA-N 1 1 235.396 3.783 20 0 BHADMO CCSc1cccc(C[N@H+]2CC[C@@H](C)C2)c1 ZINC000352001998 134025161 /nfs/dbraw/zinc/02/51/61/134025161.db2.gz JDDIQTTXSPFRBY-GFCCVEGCSA-N 1 1 235.396 3.640 20 0 BHADMO CCSc1cccc(C[N@H+]2CC[C@H](C)C2)c1 ZINC000352001999 134024948 /nfs/dbraw/zinc/02/49/48/134024948.db2.gz JDDIQTTXSPFRBY-LBPRGKRZSA-N 1 1 235.396 3.640 20 0 BHADMO C[C@@H]1CC[N@@H+](CCCCF)[C@@H](c2ccco2)C1 ZINC000352002643 134034067 /nfs/dbraw/zinc/03/40/67/134034067.db2.gz HZEQZHJERGGSSM-CHWSQXEVSA-N 1 1 239.334 3.802 20 0 BHADMO C[C@@H]1CC[N@@H+](CCCCF)[C@H](c2ccco2)C1 ZINC000352002644 134033576 /nfs/dbraw/zinc/03/35/76/134033576.db2.gz HZEQZHJERGGSSM-OLZOCXBDSA-N 1 1 239.334 3.802 20 0 BHADMO C[C@H]1CC[N@@H+](CCCCF)[C@@H](c2ccco2)C1 ZINC000352002645 134033836 /nfs/dbraw/zinc/03/38/36/134033836.db2.gz HZEQZHJERGGSSM-QWHCGFSZSA-N 1 1 239.334 3.802 20 0 BHADMO C[C@H]1CC[N@@H+](CCCCF)[C@H](c2ccco2)C1 ZINC000352002646 134034074 /nfs/dbraw/zinc/03/40/74/134034074.db2.gz HZEQZHJERGGSSM-STQMWFEESA-N 1 1 239.334 3.802 20 0 BHADMO CCSc1cccc(C[N@H+]2CCC23CCC3)c1 ZINC000352002788 134033599 /nfs/dbraw/zinc/03/35/99/134033599.db2.gz NVRWOMPZUHFFLS-UHFFFAOYSA-N 1 1 247.407 3.927 20 0 BHADMO CCSc1cccc(C[N@@H+](C)CC2CC2)c1 ZINC000352003099 134033977 /nfs/dbraw/zinc/03/39/77/134033977.db2.gz OSOHIEBWOAPVEA-UHFFFAOYSA-N 1 1 235.396 3.640 20 0 BHADMO CCC[N@@H+](C)Cc1cccc(SCC)c1 ZINC000352003996 134034355 /nfs/dbraw/zinc/03/43/55/134034355.db2.gz UQQCGKFPFJMEQR-UHFFFAOYSA-N 1 1 223.385 3.640 20 0 BHADMO C[C@H](F)CC[N@H+]1CC[C@@H](C)C[C@H]1c1ccco1 ZINC000352004194 134034500 /nfs/dbraw/zinc/03/45/00/134034500.db2.gz OPZYTJIWHRNFAC-AGIUHOORSA-N 1 1 239.334 3.801 20 0 BHADMO C[C@H](F)CC[N@H+]1CC[C@H](C)C[C@H]1c1ccco1 ZINC000352004195 134034614 /nfs/dbraw/zinc/03/46/14/134034614.db2.gz OPZYTJIWHRNFAC-AVGNSLFASA-N 1 1 239.334 3.801 20 0 BHADMO C[C@H](F)CC[N@H+]1CC[C@@H](C)C[C@@H]1c1ccco1 ZINC000352004196 134034312 /nfs/dbraw/zinc/03/43/12/134034312.db2.gz OPZYTJIWHRNFAC-FRRDWIJNSA-N 1 1 239.334 3.801 20 0 BHADMO C[C@H](F)CC[N@H+]1CC[C@H](C)C[C@@H]1c1ccco1 ZINC000352004197 134034815 /nfs/dbraw/zinc/03/48/15/134034815.db2.gz OPZYTJIWHRNFAC-RWMBFGLXSA-N 1 1 239.334 3.801 20 0 BHADMO CC(C)[N@@H+](Cc1ncc(Cl)s1)C1CCC1 ZINC000352004283 535121911 /nfs/dbraw/zinc/12/19/11/535121911.db2.gz VRHROUGSLWZULJ-UHFFFAOYSA-N 1 1 244.791 3.559 20 0 BHADMO CC(C)[N@H+](Cc1ncc(Cl)s1)C1CCC1 ZINC000352004283 535121906 /nfs/dbraw/zinc/12/19/06/535121906.db2.gz VRHROUGSLWZULJ-UHFFFAOYSA-N 1 1 244.791 3.559 20 0 BHADMO C[N@@H+](Cc1ncc(Cl)s1)C1CCCCC1 ZINC000352004630 134034482 /nfs/dbraw/zinc/03/44/82/134034482.db2.gz WDTFJGONCHYBMR-UHFFFAOYSA-N 1 1 244.791 3.561 20 0 BHADMO C[N@H+](Cc1ncc(Cl)s1)C1CCCCC1 ZINC000352004630 134034481 /nfs/dbraw/zinc/03/44/81/134034481.db2.gz WDTFJGONCHYBMR-UHFFFAOYSA-N 1 1 244.791 3.561 20 0 BHADMO CCC[N@H+](Cc1ncc(Cl)s1)CC(C)C ZINC000352011082 134035523 /nfs/dbraw/zinc/03/55/23/134035523.db2.gz OGXPAAZEXRJEKV-UHFFFAOYSA-N 1 1 246.807 3.665 20 0 BHADMO Cc1nc(C)c([C@@H](C)[N@H+](C)CC[C@@H](C)F)s1 ZINC000352014498 134035760 /nfs/dbraw/zinc/03/57/60/134035760.db2.gz NIGHCOSDTMLESD-PSASIEDQSA-N 1 1 244.379 3.501 20 0 BHADMO Cc1nc(C)c([C@H](C)[N@H+](C)CC[C@@H](C)F)s1 ZINC000352014503 134035797 /nfs/dbraw/zinc/03/57/97/134035797.db2.gz NIGHCOSDTMLESD-SCZZXKLOSA-N 1 1 244.379 3.501 20 0 BHADMO Cc1nc(C)c([C@@H](C)[N@H+](C)CC[C@H](C)F)s1 ZINC000352014505 134035939 /nfs/dbraw/zinc/03/59/39/134035939.db2.gz NIGHCOSDTMLESD-WCBMZHEXSA-N 1 1 244.379 3.501 20 0 BHADMO Cc1nc(C)c([C@H](C)[N@H+](C)CC[C@H](C)F)s1 ZINC000352014506 134036158 /nfs/dbraw/zinc/03/61/58/134036158.db2.gz NIGHCOSDTMLESD-WPRPVWTQSA-N 1 1 244.379 3.501 20 0 BHADMO Cc1ccc([C@H]2CCC[N@H+]2CCCCF)s1 ZINC000352015210 134035853 /nfs/dbraw/zinc/03/58/53/134035853.db2.gz PNNUQDDEPOGAJS-GFCCVEGCSA-N 1 1 241.375 3.943 20 0 BHADMO Cc1ccc([C@@H]2CCC[N@H+]2CCCCF)s1 ZINC000352015213 134035737 /nfs/dbraw/zinc/03/57/37/134035737.db2.gz PNNUQDDEPOGAJS-LBPRGKRZSA-N 1 1 241.375 3.943 20 0 BHADMO FCCCC[N@H+]1CCCCC[C@@H]1c1ccco1 ZINC000352015726 134036992 /nfs/dbraw/zinc/03/69/92/134036992.db2.gz RQOICBIGUCJTGW-CYBMUJFWSA-N 1 1 239.334 3.946 20 0 BHADMO FCCCC[N@H+]1CCCCC[C@H]1c1ccco1 ZINC000352015727 134036480 /nfs/dbraw/zinc/03/64/80/134036480.db2.gz RQOICBIGUCJTGW-ZDUSSCGKSA-N 1 1 239.334 3.946 20 0 BHADMO C[C@@H](F)CC[N@@H+](C)Cc1cc2ccccc2o1 ZINC000352015881 134036662 /nfs/dbraw/zinc/03/66/62/134036662.db2.gz SRVFTDPSCNMVJF-LLVKDONJSA-N 1 1 235.302 3.613 20 0 BHADMO C[C@H](F)CC[N@@H+](C)Cc1cc2ccccc2o1 ZINC000352015882 134036304 /nfs/dbraw/zinc/03/63/04/134036304.db2.gz SRVFTDPSCNMVJF-NSHDSACASA-N 1 1 235.302 3.613 20 0 BHADMO Cc1ccc([C@H]2CCC[N@@H+]2CC[C@H](C)F)s1 ZINC000352016740 134036734 /nfs/dbraw/zinc/03/67/34/134036734.db2.gz ZKTMBTNVVYRMKU-CMPLNLGQSA-N 1 1 241.375 3.942 20 0 BHADMO Cc1ccc([C@@H]2CCC[N@@H+]2CC[C@H](C)F)s1 ZINC000352016741 134036925 /nfs/dbraw/zinc/03/69/25/134036925.db2.gz ZKTMBTNVVYRMKU-JQWIXIFHSA-N 1 1 241.375 3.942 20 0 BHADMO Cc1ccc([C@@H]2CCC[N@@H+]2CC[C@@H](C)F)s1 ZINC000352016742 134036636 /nfs/dbraw/zinc/03/66/36/134036636.db2.gz ZKTMBTNVVYRMKU-PWSUYJOCSA-N 1 1 241.375 3.942 20 0 BHADMO Cc1ccc([C@H]2CCC[N@@H+]2CC[C@@H](C)F)s1 ZINC000352016743 134036335 /nfs/dbraw/zinc/03/63/35/134036335.db2.gz ZKTMBTNVVYRMKU-ZYHUDNBSSA-N 1 1 241.375 3.942 20 0 BHADMO C[N@@H+](CCCCF)Cc1ccc(F)cc1Cl ZINC000352024256 536334855 /nfs/dbraw/zinc/33/48/55/536334855.db2.gz FGWKQNMLEUXHOE-UHFFFAOYSA-N 1 1 247.716 3.661 20 0 BHADMO FCCCC[N@H+]1CCC[C@@]2(CC=CCC2)C1 ZINC000352024797 134041892 /nfs/dbraw/zinc/04/18/92/134041892.db2.gz IYKTUMUFFBBXEJ-AWEZNQCLSA-N 1 1 225.351 3.558 20 0 BHADMO FCCCC[N@H+]1CCC[C@]2(CC=CCC2)C1 ZINC000352024798 134041852 /nfs/dbraw/zinc/04/18/52/134041852.db2.gz IYKTUMUFFBBXEJ-CQSZACIVSA-N 1 1 225.351 3.558 20 0 BHADMO C[C@H](F)CC[N@H+]1CCC[C@@]2(CC=CCC2)C1 ZINC000352024850 387008991 /nfs/dbraw/zinc/00/89/91/387008991.db2.gz JPHOYEICEJKTBZ-KBPBESRZSA-N 1 1 225.351 3.557 20 0 BHADMO C[C@@H](F)CC[N@H+]1CCC[C@@]2(CC=CCC2)C1 ZINC000352024851 387009030 /nfs/dbraw/zinc/00/90/30/387009030.db2.gz JPHOYEICEJKTBZ-KGLIPLIRSA-N 1 1 225.351 3.557 20 0 BHADMO C[C@H](F)CC[N@H+]1CCC[C@]2(CC=CCC2)C1 ZINC000352024852 387009155 /nfs/dbraw/zinc/00/91/55/387009155.db2.gz JPHOYEICEJKTBZ-UONOGXRCSA-N 1 1 225.351 3.557 20 0 BHADMO C[C@@H](F)CC[N@H+]1CCC[C@]2(CC=CCC2)C1 ZINC000352024853 387008974 /nfs/dbraw/zinc/00/89/74/387008974.db2.gz JPHOYEICEJKTBZ-ZIAGYGMSSA-N 1 1 225.351 3.557 20 0 BHADMO C[C@@H](F)CC[N@@H+](C)Cc1ccc(F)cc1Cl ZINC000352030496 134044563 /nfs/dbraw/zinc/04/45/63/134044563.db2.gz WJWZESWRBWCMMT-SECBINFHSA-N 1 1 247.716 3.659 20 0 BHADMO C[C@H](F)CC[N@@H+](C)Cc1ccc(F)cc1Cl ZINC000352030497 134045120 /nfs/dbraw/zinc/04/51/20/134045120.db2.gz WJWZESWRBWCMMT-VIFPVBQESA-N 1 1 247.716 3.659 20 0 BHADMO Cc1ccc([C@@H]2CCCC[N@@H+]2CC[C@H](C)F)o1 ZINC000352043196 134045661 /nfs/dbraw/zinc/04/56/61/134045661.db2.gz BAHCTURCVMMERU-AAEUAGOBSA-N 1 1 239.334 3.863 20 0 BHADMO Cc1ccc([C@H]2CCCC[N@@H+]2CC[C@@H](C)F)o1 ZINC000352043197 134045345 /nfs/dbraw/zinc/04/53/45/134045345.db2.gz BAHCTURCVMMERU-DGCLKSJQSA-N 1 1 239.334 3.863 20 0 BHADMO Cc1ccc([C@H]2CCCC[N@@H+]2CC[C@H](C)F)o1 ZINC000352043198 134045354 /nfs/dbraw/zinc/04/53/54/134045354.db2.gz BAHCTURCVMMERU-WCQYABFASA-N 1 1 239.334 3.863 20 0 BHADMO Cc1ccc([C@@H]2CCCC[N@@H+]2CC[C@@H](C)F)o1 ZINC000352043199 134045499 /nfs/dbraw/zinc/04/54/99/134045499.db2.gz BAHCTURCVMMERU-YPMHNXCESA-N 1 1 239.334 3.863 20 0 BHADMO C[C@@H](F)CC[N@H+]1CCCC[C@H]1c1ccco1 ZINC000352043841 134045471 /nfs/dbraw/zinc/04/54/71/134045471.db2.gz GPFZFKLBQOZVBD-NEPJUHHUSA-N 1 1 225.307 3.555 20 0 BHADMO C[C@H](F)CC[N@H+]1CCCC[C@@H]1c1ccco1 ZINC000352043842 134045333 /nfs/dbraw/zinc/04/53/33/134045333.db2.gz GPFZFKLBQOZVBD-NWDGAFQWSA-N 1 1 225.307 3.555 20 0 BHADMO C[C@H](F)CC[N@H+]1CCCC[C@H]1c1ccco1 ZINC000352043843 134045786 /nfs/dbraw/zinc/04/57/86/134045786.db2.gz GPFZFKLBQOZVBD-RYUDHWBXSA-N 1 1 225.307 3.555 20 0 BHADMO C[C@@H](F)CC[N@H+]1CCCC[C@@H]1c1ccco1 ZINC000352043844 134045693 /nfs/dbraw/zinc/04/56/93/134045693.db2.gz GPFZFKLBQOZVBD-VXGBXAGGSA-N 1 1 225.307 3.555 20 0 BHADMO CCc1ccc([C@@H]2CCC[N@H+]2CC[C@H](C)F)o1 ZINC000352063163 134054424 /nfs/dbraw/zinc/05/44/24/134054424.db2.gz MJCIINRYJMBDFK-AAEUAGOBSA-N 1 1 239.334 3.727 20 0 BHADMO CCc1ccc([C@H]2CCC[N@H+]2CC[C@@H](C)F)o1 ZINC000352063165 134054449 /nfs/dbraw/zinc/05/44/49/134054449.db2.gz MJCIINRYJMBDFK-DGCLKSJQSA-N 1 1 239.334 3.727 20 0 BHADMO CCc1ccc([C@H]2CCC[N@H+]2CC[C@H](C)F)o1 ZINC000352063167 134054565 /nfs/dbraw/zinc/05/45/65/134054565.db2.gz MJCIINRYJMBDFK-WCQYABFASA-N 1 1 239.334 3.727 20 0 BHADMO CCc1ccc([C@@H]2CCC[N@H+]2CC[C@@H](C)F)o1 ZINC000352063168 134054322 /nfs/dbraw/zinc/05/43/22/134054322.db2.gz MJCIINRYJMBDFK-YPMHNXCESA-N 1 1 239.334 3.727 20 0 BHADMO C[C@@H](F)CC[N@@H+](C)[C@H](C)c1ccc(F)cc1 ZINC000352097013 134063545 /nfs/dbraw/zinc/06/35/45/134063545.db2.gz MHNBFNXWMQAXKO-GHMZBOCLSA-N 1 1 227.298 3.567 20 0 BHADMO C[C@@H](F)CC[N@@H+](C)[C@@H](C)c1ccc(F)cc1 ZINC000352097014 134063500 /nfs/dbraw/zinc/06/35/00/134063500.db2.gz MHNBFNXWMQAXKO-MNOVXSKESA-N 1 1 227.298 3.567 20 0 BHADMO C[C@H](F)CC[N@@H+](C)[C@@H](C)c1ccc(F)cc1 ZINC000352097015 134063696 /nfs/dbraw/zinc/06/36/96/134063696.db2.gz MHNBFNXWMQAXKO-QWRGUYRKSA-N 1 1 227.298 3.567 20 0 BHADMO C[C@H](c1ccc(F)cc1)[N@H+](C)CC[C@H](C)F ZINC000352097017 134063389 /nfs/dbraw/zinc/06/33/89/134063389.db2.gz MHNBFNXWMQAXKO-WDEREUQCSA-N 1 1 227.298 3.567 20 0 BHADMO CCC[N@@H+](CCCCF)Cc1ccccc1 ZINC000352097661 134064184 /nfs/dbraw/zinc/06/41/84/134064184.db2.gz VDUCDGHYDYXMDR-UHFFFAOYSA-N 1 1 223.335 3.648 20 0 BHADMO C[C@H](F)CC[N@@H+](C)Cc1ccccc1Cl ZINC000352101549 134067454 /nfs/dbraw/zinc/06/74/54/134067454.db2.gz AMBDUZDHYNWILI-JTQLQIEISA-N 1 1 229.726 3.520 20 0 BHADMO C[C@@H](F)CC[N@@H+](C)Cc1ccccc1Cl ZINC000352101550 134067564 /nfs/dbraw/zinc/06/75/64/134067564.db2.gz AMBDUZDHYNWILI-SNVBAGLBSA-N 1 1 229.726 3.520 20 0 BHADMO C[C@@H](F)CC[N@H+]1CCC[C@@H]1c1cccs1 ZINC000352101839 134067955 /nfs/dbraw/zinc/06/79/55/134067955.db2.gz FSBSALADLIKCNJ-GHMZBOCLSA-N 1 1 227.348 3.633 20 0 BHADMO C[C@@H](F)CC[N@H+]1CCC[C@H]1c1cccs1 ZINC000352101840 134068109 /nfs/dbraw/zinc/06/81/09/134068109.db2.gz FSBSALADLIKCNJ-MNOVXSKESA-N 1 1 227.348 3.633 20 0 BHADMO C[C@H](F)CC[N@H+]1CCC[C@H]1c1cccs1 ZINC000352101841 134068243 /nfs/dbraw/zinc/06/82/43/134068243.db2.gz FSBSALADLIKCNJ-QWRGUYRKSA-N 1 1 227.348 3.633 20 0 BHADMO C[C@H](F)CC[N@H+]1CCC[C@@H]1c1cccs1 ZINC000352101842 134067841 /nfs/dbraw/zinc/06/78/41/134067841.db2.gz FSBSALADLIKCNJ-WDEREUQCSA-N 1 1 227.348 3.633 20 0 BHADMO C[C@@H](F)CC[N@@H+](Cc1ccccc1F)C1CC1 ZINC000352101917 134068103 /nfs/dbraw/zinc/06/81/03/134068103.db2.gz HDLHABZEYXPIDX-LLVKDONJSA-N 1 1 239.309 3.538 20 0 BHADMO C[C@H](F)CC[N@@H+](Cc1ccccc1F)C1CC1 ZINC000352101918 134068264 /nfs/dbraw/zinc/06/82/64/134068264.db2.gz HDLHABZEYXPIDX-NSHDSACASA-N 1 1 239.309 3.538 20 0 BHADMO C[C@@H](F)CC[N@H+]1CCC[C@@H]1c1ccc(F)cc1 ZINC000352102344 134067807 /nfs/dbraw/zinc/06/78/07/134067807.db2.gz MBLINIMTWSMUQV-BXUZGUMPSA-N 1 1 239.309 3.711 20 0 BHADMO C[C@H](F)CC[N@H+]1CCC[C@H]1c1ccc(F)cc1 ZINC000352102345 134068246 /nfs/dbraw/zinc/06/82/46/134068246.db2.gz MBLINIMTWSMUQV-FZMZJTMJSA-N 1 1 239.309 3.711 20 0 BHADMO C[C@@H](F)CC[N@H+]1CCC[C@H]1c1ccc(F)cc1 ZINC000352102346 134068234 /nfs/dbraw/zinc/06/82/34/134068234.db2.gz MBLINIMTWSMUQV-RISCZKNCSA-N 1 1 239.309 3.711 20 0 BHADMO C[C@H](F)CC[N@H+]1CCC[C@@H]1c1ccc(F)cc1 ZINC000352102347 134067921 /nfs/dbraw/zinc/06/79/21/134067921.db2.gz MBLINIMTWSMUQV-SMDDNHRTSA-N 1 1 239.309 3.711 20 0 BHADMO C[N@@H+](CCCCF)Cc1ccccc1Cl ZINC000352102903 536334618 /nfs/dbraw/zinc/33/46/18/536334618.db2.gz UVLRKWMCWYKULK-UHFFFAOYSA-N 1 1 229.726 3.522 20 0 BHADMO C[C@@H](F)CC[N@@H+](Cc1ccc(F)cc1)C1CC1 ZINC000352102915 134067824 /nfs/dbraw/zinc/06/78/24/134067824.db2.gz VCRFBNGZBYOFGV-LLVKDONJSA-N 1 1 239.309 3.538 20 0 BHADMO C[C@H](F)CC[N@@H+](Cc1ccc(F)cc1)C1CC1 ZINC000352102916 134067898 /nfs/dbraw/zinc/06/78/98/134067898.db2.gz VCRFBNGZBYOFGV-NSHDSACASA-N 1 1 239.309 3.538 20 0 BHADMO C[C@@H](F)CC[N@@H+](C)Cc1c(F)cccc1Cl ZINC000352102944 134068098 /nfs/dbraw/zinc/06/80/98/134068098.db2.gz VTCGMSZGTWVQPA-SECBINFHSA-N 1 1 247.716 3.659 20 0 BHADMO C[C@@H](F)CC[N@H+](C)Cc1c(F)cccc1Cl ZINC000352102944 134068097 /nfs/dbraw/zinc/06/80/97/134068097.db2.gz VTCGMSZGTWVQPA-SECBINFHSA-N 1 1 247.716 3.659 20 0 BHADMO C[C@H](F)CC[N@@H+](C)Cc1c(F)cccc1Cl ZINC000352102945 134068270 /nfs/dbraw/zinc/06/82/70/134068270.db2.gz VTCGMSZGTWVQPA-VIFPVBQESA-N 1 1 247.716 3.659 20 0 BHADMO C[C@H](F)CC[N@H+](C)Cc1c(F)cccc1Cl ZINC000352102945 134068269 /nfs/dbraw/zinc/06/82/69/134068269.db2.gz VTCGMSZGTWVQPA-VIFPVBQESA-N 1 1 247.716 3.659 20 0 BHADMO FCCCC[N@@H+](Cc1ccc(F)cc1)C1CC1 ZINC000352103095 134068165 /nfs/dbraw/zinc/06/81/65/134068165.db2.gz YGSNESJHHCMPAA-UHFFFAOYSA-N 1 1 239.309 3.540 20 0 BHADMO FCCCC[N@@H+](Cc1ccccc1F)C1CC1 ZINC000352103229 134067881 /nfs/dbraw/zinc/06/78/81/134067881.db2.gz YWEQBXGNWVSCOI-UHFFFAOYSA-N 1 1 239.309 3.540 20 0 BHADMO C[N@@H+](CCCCF)Cc1c(F)cccc1Cl ZINC000352103295 536335083 /nfs/dbraw/zinc/33/50/83/536335083.db2.gz ZRJHFZBXICWCHD-UHFFFAOYSA-N 1 1 247.716 3.661 20 0 BHADMO C[N@H+](CCCCF)Cc1c(F)cccc1Cl ZINC000352103295 536335082 /nfs/dbraw/zinc/33/50/82/536335082.db2.gz ZRJHFZBXICWCHD-UHFFFAOYSA-N 1 1 247.716 3.661 20 0 BHADMO C[C@H](F)CC[N@H+]1CCC[C@@H]1c1ccccc1 ZINC000352113765 134068412 /nfs/dbraw/zinc/06/84/12/134068412.db2.gz NLDUEDNQZJKBCB-GXTWGEPZSA-N 1 1 221.319 3.572 20 0 BHADMO C[C@H](F)CC[N@H+]1CCC[C@H]1c1ccccc1 ZINC000352113766 134068440 /nfs/dbraw/zinc/06/84/40/134068440.db2.gz NLDUEDNQZJKBCB-JSGCOSHPSA-N 1 1 221.319 3.572 20 0 BHADMO C[C@@H](F)CC[N@H+]1CCC[C@H]1c1ccccc1 ZINC000352113767 134068574 /nfs/dbraw/zinc/06/85/74/134068574.db2.gz NLDUEDNQZJKBCB-OCCSQVGLSA-N 1 1 221.319 3.572 20 0 BHADMO C[C@@H](F)CC[N@H+]1CCC[C@@H]1c1ccccc1 ZINC000352113768 134068500 /nfs/dbraw/zinc/06/85/00/134068500.db2.gz NLDUEDNQZJKBCB-TZMCWYRMSA-N 1 1 221.319 3.572 20 0 BHADMO C[C@@H](F)CC[N@@H+](C)[C@H](C)c1ccc(F)c(F)c1 ZINC000352113969 134068503 /nfs/dbraw/zinc/06/85/03/134068503.db2.gz QORUWTFNSUBPNN-NXEZZACHSA-N 1 1 245.288 3.706 20 0 BHADMO C[C@H](F)CC[N@@H+](C)[C@@H](C)c1ccc(F)c(F)c1 ZINC000352113970 134068382 /nfs/dbraw/zinc/06/83/82/134068382.db2.gz QORUWTFNSUBPNN-UWVGGRQHSA-N 1 1 245.288 3.706 20 0 BHADMO C[C@H](c1ccc(F)c(F)c1)[N@H+](C)CC[C@H](C)F ZINC000352113971 134068674 /nfs/dbraw/zinc/06/86/74/134068674.db2.gz QORUWTFNSUBPNN-VHSXEESVSA-N 1 1 245.288 3.706 20 0 BHADMO C[C@@H](F)CC[N@@H+](C)[C@@H](C)c1ccc(F)c(F)c1 ZINC000352113972 134068442 /nfs/dbraw/zinc/06/84/42/134068442.db2.gz QORUWTFNSUBPNN-ZJUUUORDSA-N 1 1 245.288 3.706 20 0 BHADMO C[C@@H](F)CC[N@@H+](C)Cc1ccc(Cl)s1 ZINC000352114392 134068378 /nfs/dbraw/zinc/06/83/78/134068378.db2.gz XSINHZIXZIKBNZ-MRVPVSSYSA-N 1 1 235.755 3.581 20 0 BHADMO C[C@H](F)CC[N@@H+](C)Cc1ccc(Cl)s1 ZINC000352114393 134068681 /nfs/dbraw/zinc/06/86/81/134068681.db2.gz XSINHZIXZIKBNZ-QMMMGPOBSA-N 1 1 235.755 3.581 20 0 BHADMO CC[N@@H+](CC[C@H](C)F)Cc1c(F)cccc1F ZINC000352122170 134074304 /nfs/dbraw/zinc/07/43/04/134074304.db2.gz ADONMAAYBVOMKB-JTQLQIEISA-N 1 1 245.288 3.535 20 0 BHADMO CC[N@H+](CC[C@H](C)F)Cc1c(F)cccc1F ZINC000352122170 134074303 /nfs/dbraw/zinc/07/43/03/134074303.db2.gz ADONMAAYBVOMKB-JTQLQIEISA-N 1 1 245.288 3.535 20 0 BHADMO CC[N@@H+](CC[C@@H](C)F)Cc1c(F)cccc1F ZINC000352122171 134074361 /nfs/dbraw/zinc/07/43/61/134074361.db2.gz ADONMAAYBVOMKB-SNVBAGLBSA-N 1 1 245.288 3.535 20 0 BHADMO CC[N@H+](CC[C@@H](C)F)Cc1c(F)cccc1F ZINC000352122171 134074360 /nfs/dbraw/zinc/07/43/60/134074360.db2.gz ADONMAAYBVOMKB-SNVBAGLBSA-N 1 1 245.288 3.535 20 0 BHADMO CC[N@@H+](CCCCF)Cc1c(F)cccc1F ZINC000352123182 134074810 /nfs/dbraw/zinc/07/48/10/134074810.db2.gz LBLYLLQYEVASSN-UHFFFAOYSA-N 1 1 245.288 3.536 20 0 BHADMO Cc1ccccc1[C@H]1CC[N@@H+](CCCCF)C1 ZINC000352123697 134074786 /nfs/dbraw/zinc/07/47/86/134074786.db2.gz PYLDPUZIHNUKCY-AWEZNQCLSA-N 1 1 235.346 3.534 20 0 BHADMO Cc1ccccc1[C@@H]1CC[N@@H+](CCCCF)C1 ZINC000352123698 134074790 /nfs/dbraw/zinc/07/47/90/134074790.db2.gz PYLDPUZIHNUKCY-CQSZACIVSA-N 1 1 235.346 3.534 20 0 BHADMO Cc1ccccc1[C@H]1CC[N@H+](CC[C@H](C)F)C1 ZINC000352124476 134074735 /nfs/dbraw/zinc/07/47/35/134074735.db2.gz ZMACNDSMIBFHEB-KBPBESRZSA-N 1 1 235.346 3.532 20 0 BHADMO Cc1ccccc1[C@H]1CC[N@H+](CC[C@@H](C)F)C1 ZINC000352124477 134074915 /nfs/dbraw/zinc/07/49/15/134074915.db2.gz ZMACNDSMIBFHEB-KGLIPLIRSA-N 1 1 235.346 3.532 20 0 BHADMO Cc1ccccc1[C@@H]1CC[N@H+](CC[C@H](C)F)C1 ZINC000352124478 134075090 /nfs/dbraw/zinc/07/50/90/134075090.db2.gz ZMACNDSMIBFHEB-UONOGXRCSA-N 1 1 235.346 3.532 20 0 BHADMO Cc1ccccc1[C@@H]1CC[N@H+](CC[C@@H](C)F)C1 ZINC000352124479 134075023 /nfs/dbraw/zinc/07/50/23/134075023.db2.gz ZMACNDSMIBFHEB-ZIAGYGMSSA-N 1 1 235.346 3.532 20 0 BHADMO CCC[N@H+](Cc1cn[nH]c1C)CC1CCCCC1 ZINC000352246673 134118776 /nfs/dbraw/zinc/11/87/76/134118776.db2.gz RLTOMPXDZWHJNF-UHFFFAOYSA-N 1 1 249.402 3.510 20 0 BHADMO CCC[N@@H+](Cc1cn[nH]c1C)CC1CCCCC1 ZINC000352246673 134118775 /nfs/dbraw/zinc/11/87/75/134118775.db2.gz RLTOMPXDZWHJNF-UHFFFAOYSA-N 1 1 249.402 3.510 20 0 BHADMO CCC[N@H+](Cc1c[nH]nc1C)CC1CCCCC1 ZINC000352246673 134118774 /nfs/dbraw/zinc/11/87/74/134118774.db2.gz RLTOMPXDZWHJNF-UHFFFAOYSA-N 1 1 249.402 3.510 20 0 BHADMO CSc1ccccc1C[N@H+]1CCCC2(CC2)C1 ZINC000352266798 134128975 /nfs/dbraw/zinc/12/89/75/134128975.db2.gz PBMAWTGWGCOMAY-UHFFFAOYSA-N 1 1 247.407 3.785 20 0 BHADMO CC(C)CSCCC[N@H+]1CCCC2(CC2)C1 ZINC000352278497 134129447 /nfs/dbraw/zinc/12/94/47/134129447.db2.gz BJOSBNHGYKSFKX-UHFFFAOYSA-N 1 1 241.444 3.642 20 0 BHADMO c1cc(CCC[N@H+]2CCCC3(CC3)C2)cs1 ZINC000352279884 134129703 /nfs/dbraw/zinc/12/97/03/134129703.db2.gz NCDOMVNFUVXDDK-UHFFFAOYSA-N 1 1 235.396 3.557 20 0 BHADMO c1ccc(SCC[N@H+]2CCCC3(CC3)C2)cc1 ZINC000352280340 134129876 /nfs/dbraw/zinc/12/98/76/134129876.db2.gz PYJARCVAQXEXFE-UHFFFAOYSA-N 1 1 247.407 3.655 20 0 BHADMO Cn1ccc(C[N@@H+](CC2CCCCC2)C2CC2)c1 ZINC000352298123 134139694 /nfs/dbraw/zinc/13/96/94/134139694.db2.gz TUHCDEQQHYLLDZ-UHFFFAOYSA-N 1 1 246.398 3.570 20 0 BHADMO CC1(C)CCC[N@@H+](Cc2cccc3cc[nH]c32)C1 ZINC000352319595 387077869 /nfs/dbraw/zinc/07/78/69/387077869.db2.gz JWOLFXBOBCYRLD-UHFFFAOYSA-N 1 1 242.366 3.790 20 0 BHADMO CC1(C)CCC[N@@H+](Cc2cccc3[nH]ccc32)C1 ZINC000352327948 387078848 /nfs/dbraw/zinc/07/88/48/387078848.db2.gz FPKMIXRBABUETE-UHFFFAOYSA-N 1 1 242.366 3.790 20 0 BHADMO CC1(C)CCC[N@@H+](Cc2ccc(Cl)o2)C1 ZINC000352337908 387093810 /nfs/dbraw/zinc/09/38/10/387093810.db2.gz MIEPFIKOLZVMDU-UHFFFAOYSA-N 1 1 227.735 3.555 20 0 BHADMO Cc1ccc(C[N@H+]2CCCC(C)(C)C2)s1 ZINC000352345519 387093091 /nfs/dbraw/zinc/09/30/91/387093091.db2.gz MLKPKCPAJQNIBM-UHFFFAOYSA-N 1 1 223.385 3.679 20 0 BHADMO Cc1ncccc1C[N@H+]1CCC[C@H](C(C)(C)C)C1 ZINC000352351661 180219060 /nfs/dbraw/zinc/21/90/60/180219060.db2.gz ZEAKSGYZUCEOHM-HNNXBMFYSA-N 1 1 246.398 3.648 20 0 BHADMO Cc1ncccc1C[N@H+]1CCC[C@@H](C(C)(C)C)C1 ZINC000352351664 180218476 /nfs/dbraw/zinc/21/84/76/180218476.db2.gz ZEAKSGYZUCEOHM-OAHLLOKOSA-N 1 1 246.398 3.648 20 0 BHADMO FCCCC[N@H+]1CCC=C(c2ccccc2)C1 ZINC000352371688 387116368 /nfs/dbraw/zinc/11/63/68/387116368.db2.gz LEQLYNQCGAGVMU-UHFFFAOYSA-N 1 1 233.330 3.525 20 0 BHADMO CC1=C(c2ccco2)C[N@@H+](CC[C@@H](C)F)CC1 ZINC000352371774 168089887 /nfs/dbraw/zinc/08/98/87/168089887.db2.gz LQEBANUEMZYQOO-GFCCVEGCSA-N 1 1 237.318 3.507 20 0 BHADMO CC1=C(c2ccco2)C[N@@H+](CC[C@H](C)F)CC1 ZINC000352371775 168089960 /nfs/dbraw/zinc/08/99/60/168089960.db2.gz LQEBANUEMZYQOO-LBPRGKRZSA-N 1 1 237.318 3.507 20 0 BHADMO C[C@@H](F)CC[N@H+]1CCC=C(c2ccccc2)C1 ZINC000352372010 387116196 /nfs/dbraw/zinc/11/61/96/387116196.db2.gz NVFZWUZATFZDLA-CYBMUJFWSA-N 1 1 233.330 3.524 20 0 BHADMO C[C@H](F)CC[N@H+]1CCC=C(c2ccccc2)C1 ZINC000352372011 387116592 /nfs/dbraw/zinc/11/65/92/387116592.db2.gz NVFZWUZATFZDLA-ZDUSSCGKSA-N 1 1 233.330 3.524 20 0 BHADMO C[N@@H+](Cc1ccc2ncccc2c1)CC(C)(C)C ZINC000352372572 387117215 /nfs/dbraw/zinc/11/72/15/387117215.db2.gz UGNXZKJIPQRTDX-UHFFFAOYSA-N 1 1 242.366 3.713 20 0 BHADMO CCCC[C@H](C)[N@@H+](C)Cc1sc(C)nc1C ZINC000352392448 356336987 /nfs/dbraw/zinc/33/69/87/356336987.db2.gz UDUDSJNDXSNCFE-JTQLQIEISA-N 1 1 240.416 3.770 20 0 BHADMO CCCC[C@@H](C)[N@@H+](C)Cc1sc(C)nc1C ZINC000352392449 356336478 /nfs/dbraw/zinc/33/64/78/356336478.db2.gz UDUDSJNDXSNCFE-SNVBAGLBSA-N 1 1 240.416 3.770 20 0 BHADMO CCCC[C@@H](C)[N@@H+](C)CCc1csc(C)n1 ZINC000352393277 356336805 /nfs/dbraw/zinc/33/68/05/356336805.db2.gz ZTNROTFMYZWGLH-LLVKDONJSA-N 1 1 240.416 3.505 20 0 BHADMO CCCC[C@H](C)[N@@H+](C)CCc1csc(C)n1 ZINC000352393279 356336906 /nfs/dbraw/zinc/33/69/06/356336906.db2.gz ZTNROTFMYZWGLH-NSHDSACASA-N 1 1 240.416 3.505 20 0 BHADMO C[N@@H+](CCCCF)Cc1ccc(F)c(Cl)c1 ZINC000352402987 387147910 /nfs/dbraw/zinc/14/79/10/387147910.db2.gz RCZDLTWBZPIPRB-UHFFFAOYSA-N 1 1 247.716 3.661 20 0 BHADMO C[C@@H](F)CC[N@@H+](C)Cc1ccc(F)c(Cl)c1 ZINC000352403707 387148488 /nfs/dbraw/zinc/14/84/88/387148488.db2.gz XADGRBJWNNVUFY-SECBINFHSA-N 1 1 247.716 3.659 20 0 BHADMO C[C@H](F)CC[N@@H+](C)Cc1ccc(F)c(Cl)c1 ZINC000352403708 387148364 /nfs/dbraw/zinc/14/83/64/387148364.db2.gz XADGRBJWNNVUFY-VIFPVBQESA-N 1 1 247.716 3.659 20 0 BHADMO CCC1(CC)CCC[N@@H+](CCCCOC)CC1 ZINC000352406590 387166043 /nfs/dbraw/zinc/16/60/43/387166043.db2.gz MRLMDTWVHJWMRW-UHFFFAOYSA-N 1 1 241.419 3.705 20 0 BHADMO CCCC[C@@H](C)[N@@H+](C)Cc1ncc(Cl)s1 ZINC000352409895 356341178 /nfs/dbraw/zinc/34/11/78/356341178.db2.gz MYXBKLJDVPKZBM-SECBINFHSA-N 1 1 246.807 3.807 20 0 BHADMO CCCC[C@@H](C)[N@H+](C)Cc1ncc(Cl)s1 ZINC000352409895 356341177 /nfs/dbraw/zinc/34/11/77/356341177.db2.gz MYXBKLJDVPKZBM-SECBINFHSA-N 1 1 246.807 3.807 20 0 BHADMO CCCC[C@H](C)[N@@H+](C)Cc1ncc(Cl)s1 ZINC000352409896 356341165 /nfs/dbraw/zinc/34/11/65/356341165.db2.gz MYXBKLJDVPKZBM-VIFPVBQESA-N 1 1 246.807 3.807 20 0 BHADMO CCCC[C@H](C)[N@H+](C)Cc1ncc(Cl)s1 ZINC000352409896 356341162 /nfs/dbraw/zinc/34/11/62/356341162.db2.gz MYXBKLJDVPKZBM-VIFPVBQESA-N 1 1 246.807 3.807 20 0 BHADMO CCCC[C@@H](C)[N@@H+](C)Cc1ccc(C)nc1C ZINC000352410890 356341556 /nfs/dbraw/zinc/34/15/56/356341556.db2.gz TZYITGVPBSXPCP-CYBMUJFWSA-N 1 1 234.387 3.709 20 0 BHADMO CCCC[C@H](C)[N@@H+](C)Cc1ccc(C)nc1C ZINC000352410891 356341345 /nfs/dbraw/zinc/34/13/45/356341345.db2.gz TZYITGVPBSXPCP-ZDUSSCGKSA-N 1 1 234.387 3.709 20 0 BHADMO CCCC[C@@H](C)[N@@H+](C)Cc1csc(CC)n1 ZINC000352413757 356341855 /nfs/dbraw/zinc/34/18/55/356341855.db2.gz BNNFLGLGSSNWON-LLVKDONJSA-N 1 1 240.416 3.716 20 0 BHADMO CCCC[C@H](C)[N@@H+](C)Cc1csc(CC)n1 ZINC000352413758 356341628 /nfs/dbraw/zinc/34/16/28/356341628.db2.gz BNNFLGLGSSNWON-NSHDSACASA-N 1 1 240.416 3.716 20 0 BHADMO CCCC[C@H](C)[N@@H+](C)Cc1nc(C)c(C)s1 ZINC000352416431 356342592 /nfs/dbraw/zinc/34/25/92/356342592.db2.gz ULUMDFVTIXWNEW-JTQLQIEISA-N 1 1 240.416 3.770 20 0 BHADMO CCCC[C@@H](C)[N@@H+](C)Cc1nc(C)c(C)s1 ZINC000352416432 356342994 /nfs/dbraw/zinc/34/29/94/356342994.db2.gz ULUMDFVTIXWNEW-SNVBAGLBSA-N 1 1 240.416 3.770 20 0 BHADMO CC[N@@H+](CCCCF)Cc1c[nH]c2ccccc12 ZINC000352420235 387179426 /nfs/dbraw/zinc/17/94/26/387179426.db2.gz AMIXUAOGAHTQIE-UHFFFAOYSA-N 1 1 248.345 3.740 20 0 BHADMO C[C@@H](F)CC[N@@H+](C)Cc1cc(Cl)ccc1F ZINC000352420996 387183400 /nfs/dbraw/zinc/18/34/00/387183400.db2.gz JCUQBJYIAGGJSH-SECBINFHSA-N 1 1 247.716 3.659 20 0 BHADMO C[C@H](F)CC[N@@H+](C)Cc1cc(Cl)ccc1F ZINC000352420997 387183201 /nfs/dbraw/zinc/18/32/01/387183201.db2.gz JCUQBJYIAGGJSH-VIFPVBQESA-N 1 1 247.716 3.659 20 0 BHADMO CSc1ccccc1C[N@@H+](C)CCCCF ZINC000352421591 387185167 /nfs/dbraw/zinc/18/51/67/387185167.db2.gz MHGMMSQOJLSLGJ-UHFFFAOYSA-N 1 1 241.375 3.590 20 0 BHADMO CSc1ccccc1C[N@@H+](C)CC[C@@H](C)F ZINC000352421635 387185452 /nfs/dbraw/zinc/18/54/52/387185452.db2.gz MTKWLIDVSIWVPY-LLVKDONJSA-N 1 1 241.375 3.588 20 0 BHADMO CSc1ccccc1C[N@@H+](C)CC[C@H](C)F ZINC000352421636 387185583 /nfs/dbraw/zinc/18/55/83/387185583.db2.gz MTKWLIDVSIWVPY-NSHDSACASA-N 1 1 241.375 3.588 20 0 BHADMO CCCC[C@H](C)[N@@H+](C)Cc1nc(C)sc1C ZINC000352421777 356346946 /nfs/dbraw/zinc/34/69/46/356346946.db2.gz FERRYKAGAIXTJL-JTQLQIEISA-N 1 1 240.416 3.770 20 0 BHADMO CCCC[C@@H](C)[N@@H+](C)Cc1nc(C)sc1C ZINC000352421778 356346676 /nfs/dbraw/zinc/34/66/76/356346676.db2.gz FERRYKAGAIXTJL-SNVBAGLBSA-N 1 1 240.416 3.770 20 0 BHADMO CC[N@@H+](CC[C@@H](C)F)Cc1c[nH]c2ccccc12 ZINC000352422018 387187866 /nfs/dbraw/zinc/18/78/66/387187866.db2.gz PBKBFGVSWHIYAY-GFCCVEGCSA-N 1 1 248.345 3.738 20 0 BHADMO CC[N@@H+](CC[C@H](C)F)Cc1c[nH]c2ccccc12 ZINC000352422019 387187538 /nfs/dbraw/zinc/18/75/38/387187538.db2.gz PBKBFGVSWHIYAY-LBPRGKRZSA-N 1 1 248.345 3.738 20 0 BHADMO C[N@@H+](CCCCF)Cc1cc(Cl)ccc1F ZINC000352422509 387187999 /nfs/dbraw/zinc/18/79/99/387187999.db2.gz SFVLHKVBHNSTTQ-UHFFFAOYSA-N 1 1 247.716 3.661 20 0 BHADMO CCCC[C@@H](C)[N@@H+](C)Cc1c(C)onc1CC ZINC000352424598 356348214 /nfs/dbraw/zinc/34/82/14/356348214.db2.gz UIUCUXXKECIZLD-LLVKDONJSA-N 1 1 238.375 3.556 20 0 BHADMO CCCC[C@H](C)[N@@H+](C)Cc1c(C)onc1CC ZINC000352424599 356348169 /nfs/dbraw/zinc/34/81/69/356348169.db2.gz UIUCUXXKECIZLD-NSHDSACASA-N 1 1 238.375 3.556 20 0 BHADMO CC(C)c1[nH+]ccn1CCCCOC(C)(C)C ZINC000352537499 387301236 /nfs/dbraw/zinc/30/12/36/387301236.db2.gz VXKAPGVOBFJJGO-UHFFFAOYSA-N 1 1 238.375 3.602 20 0 BHADMO c1coc(C2=CCC[N@H+](CC3CCCC3)C2)c1 ZINC000352543513 370688598 /nfs/dbraw/zinc/68/85/98/370688598.db2.gz GBSLGAGBJGYPET-UHFFFAOYSA-N 1 1 231.339 3.559 20 0 BHADMO c1coc(C2=CCC[N@H+](Cc3ccccc3)C2)c1 ZINC000352545360 387306540 /nfs/dbraw/zinc/30/65/40/387306540.db2.gz WWHBYCJHTPBNNZ-UHFFFAOYSA-N 1 1 239.318 3.569 20 0 BHADMO CCC[C@@H](C)[N@H+]1CCC=C(c2ccco2)C1 ZINC000352545375 169367024 /nfs/dbraw/zinc/36/70/24/169367024.db2.gz XBFBNUURESMXNE-GFCCVEGCSA-N 1 1 219.328 3.557 20 0 BHADMO CCC[C@H](C)[N@H+]1CCC=C(c2ccco2)C1 ZINC000352545376 387308104 /nfs/dbraw/zinc/30/81/04/387308104.db2.gz XBFBNUURESMXNE-LBPRGKRZSA-N 1 1 219.328 3.557 20 0 BHADMO CC/C=C\CC[N@H+]1CCC=C(c2ccco2)C1 ZINC000352570860 370687879 /nfs/dbraw/zinc/68/78/79/370687879.db2.gz NBIZEVYXKXAZTD-ARJAWSKDSA-N 1 1 231.339 3.725 20 0 BHADMO CC/C=C/CC[N@H+]1CCC=C(c2ccco2)C1 ZINC000352570861 370689027 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SWPHRNBLDBZCOH-UHFFFAOYSA-N 1 1 247.313 3.668 20 0 BHADMO Cc1occc1C[N@H+](C)Cc1ccc(C)c(F)c1 ZINC000352679331 387434230 /nfs/dbraw/zinc/43/42/30/387434230.db2.gz YYXSNKFVVUKBEZ-UHFFFAOYSA-N 1 1 247.313 3.668 20 0 BHADMO Cc1ccc(F)cc1C[NH+]1Cc2ccccc2C1 ZINC000352692396 387439639 /nfs/dbraw/zinc/43/96/39/387439639.db2.gz OQHFSWUHWOXPSP-UHFFFAOYSA-N 1 1 241.309 3.650 20 0 BHADMO Cc1ccc(F)cc1C[N@@H+](C)CCC(F)(F)F ZINC000352695007 387440162 /nfs/dbraw/zinc/44/01/62/387440162.db2.gz WVBUQVGKWXAOHN-UHFFFAOYSA-N 1 1 249.251 3.518 20 0 BHADMO Clc1ccc(C[N@H+]2CCC[C@@H]3CCC[C@H]32)o1 ZINC000352718109 387460986 /nfs/dbraw/zinc/46/09/86/387460986.db2.gz FYTZKVWILGUNNI-CMPLNLGQSA-N 1 1 239.746 3.698 20 0 BHADMO Clc1ccc(C[N@H+]2CCC[C@H]3CCC[C@H]32)o1 ZINC000352718110 387460495 /nfs/dbraw/zinc/46/04/95/387460495.db2.gz FYTZKVWILGUNNI-ZYHUDNBSSA-N 1 1 239.746 3.698 20 0 BHADMO CCc1ccc(C[N@H+]2CCC[C@H]3CCC[C@@H]32)o1 ZINC000352725104 387463298 /nfs/dbraw/zinc/46/32/98/387463298.db2.gz LSZBWGQRLYLJEE-DOMZBBRYSA-N 1 1 233.355 3.607 20 0 BHADMO CCc1ccc(C[N@H+]2CCC[C@H]3CCC[C@H]32)o1 ZINC000352725105 387463033 /nfs/dbraw/zinc/46/30/33/387463033.db2.gz LSZBWGQRLYLJEE-IUODEOHRSA-N 1 1 233.355 3.607 20 0 BHADMO CCc1ccc(C[N@H+]2CCC[C@@H]3CCC[C@H]32)o1 ZINC000352725106 387462601 /nfs/dbraw/zinc/46/26/01/387462601.db2.gz LSZBWGQRLYLJEE-SWLSCSKDSA-N 1 1 233.355 3.607 20 0 BHADMO CCc1ccc(C[N@H+]2CCC[C@@H]3CCC[C@@H]32)o1 ZINC000352725107 387463231 /nfs/dbraw/zinc/46/32/31/387463231.db2.gz LSZBWGQRLYLJEE-WFASDCNBSA-N 1 1 233.355 3.607 20 0 BHADMO Cc1oc2ccccc2c1C[N@@H+]1CC[C@@H](C)C1 ZINC000352735478 387465143 /nfs/dbraw/zinc/46/51/43/387465143.db2.gz CHZJGYYJQGWRBV-LLVKDONJSA-N 1 1 229.323 3.583 20 0 BHADMO Cc1oc2ccccc2c1C[N@@H+]1CC[C@H](C)C1 ZINC000352735479 387464974 /nfs/dbraw/zinc/46/49/74/387464974.db2.gz CHZJGYYJQGWRBV-NSHDSACASA-N 1 1 229.323 3.583 20 0 BHADMO Cc1ccc(C[N@H+](C)Cc2cc(F)ccc2C)o1 ZINC000352744635 387470236 /nfs/dbraw/zinc/47/02/36/387470236.db2.gz PQZOJBUMAOLBAP-UHFFFAOYSA-N 1 1 247.313 3.668 20 0 BHADMO CCC1(C)CCN(c2cc[nH+]cc2Cl)CC1 ZINC000352747358 132249332 /nfs/dbraw/zinc/24/93/32/132249332.db2.gz BWADYDSMPKRNIY-UHFFFAOYSA-N 1 1 238.762 3.752 20 0 BHADMO CC[C@H]1CCCCC[N@H+]1Cc1cccc(C)n1 ZINC000352761940 387466468 /nfs/dbraw/zinc/46/64/68/387466468.db2.gz VTVUYVGLAOMRST-HNNXBMFYSA-N 1 1 232.371 3.545 20 0 BHADMO CC[C@@H]1CCCCC[N@H+]1Cc1cccc(C)n1 ZINC000352761941 356410111 /nfs/dbraw/zinc/41/01/11/356410111.db2.gz VTVUYVGLAOMRST-OAHLLOKOSA-N 1 1 232.371 3.545 20 0 BHADMO Cc1ccccc1[C@@H](C)[N@H+]1CCC=C(F)C1 ZINC000352781793 179318900 /nfs/dbraw/zinc/31/89/00/179318900.db2.gz ZTNGHORTEYLFST-GFCCVEGCSA-N 1 1 219.303 3.615 20 0 BHADMO Cc1ccccc1[C@H](C)[N@H+]1CCC=C(F)C1 ZINC000352781794 179333752 /nfs/dbraw/zinc/33/37/52/179333752.db2.gz ZTNGHORTEYLFST-LBPRGKRZSA-N 1 1 219.303 3.615 20 0 BHADMO FC1=CCC[N@H+]([C@H]2CCCc3ccccc32)C1 ZINC000352783329 387481025 /nfs/dbraw/zinc/48/10/25/387481025.db2.gz JIJJNPQRHHBVOJ-HNNXBMFYSA-N 1 1 231.314 3.623 20 0 BHADMO FC1=CCC[N@H+]([C@@H]2CCCc3ccccc32)C1 ZINC000352783331 387480887 /nfs/dbraw/zinc/48/08/87/387480887.db2.gz JIJJNPQRHHBVOJ-OAHLLOKOSA-N 1 1 231.314 3.623 20 0 BHADMO FC1=CCC[N@@H+](Cc2csc3ccccc23)C1 ZINC000352783345 387480947 /nfs/dbraw/zinc/48/09/47/387480947.db2.gz JLNWXGHDJNITCA-UHFFFAOYSA-N 1 1 247.338 3.960 20 0 BHADMO FC1=CCC[N@H+](Cc2csc3ccccc23)C1 ZINC000352783345 387480943 /nfs/dbraw/zinc/48/09/43/387480943.db2.gz JLNWXGHDJNITCA-UHFFFAOYSA-N 1 1 247.338 3.960 20 0 BHADMO C[C@H]1CCC[N@@H+](Cc2ccc(Cl)o2)CC1 ZINC000352797638 177101085 /nfs/dbraw/zinc/10/10/85/177101085.db2.gz JHHKCCYVBNDGGM-JTQLQIEISA-N 1 1 227.735 3.555 20 0 BHADMO C[C@@H]1CCC[N@@H+](Cc2ccc(Cl)o2)CC1 ZINC000352798074 176101172 /nfs/dbraw/zinc/10/11/72/176101172.db2.gz JHHKCCYVBNDGGM-SNVBAGLBSA-N 1 1 227.735 3.555 20 0 BHADMO Cc1ccc(C[N@@H+]2CCC[C@@H](C)CC2)s1 ZINC000352799256 387489187 /nfs/dbraw/zinc/48/91/87/387489187.db2.gz LXVYNTDLUDLFHC-LLVKDONJSA-N 1 1 223.385 3.679 20 0 BHADMO Cc1ccc(C[N@@H+]2CCC[C@H](C)CC2)s1 ZINC000352799257 387488989 /nfs/dbraw/zinc/48/89/89/387488989.db2.gz LXVYNTDLUDLFHC-NSHDSACASA-N 1 1 223.385 3.679 20 0 BHADMO Cc1ccsc1C[N@@H+]1CCC[C@@H](C)CC1 ZINC000352799268 179542817 /nfs/dbraw/zinc/54/28/17/179542817.db2.gz LYZQFNWDKVWWQO-LLVKDONJSA-N 1 1 223.385 3.679 20 0 BHADMO Cc1ccsc1C[N@@H+]1CCC[C@H](C)CC1 ZINC000352799269 387489971 /nfs/dbraw/zinc/48/99/71/387489971.db2.gz LYZQFNWDKVWWQO-NSHDSACASA-N 1 1 223.385 3.679 20 0 BHADMO C[C@@H]1CCC[N@@H+](Cc2ccc(F)c(F)c2)CC1 ZINC000352800084 176101096 /nfs/dbraw/zinc/10/10/96/176101096.db2.gz GREFRZMAAPQROL-LLVKDONJSA-N 1 1 239.309 3.587 20 0 BHADMO C[C@H]1CCC[N@@H+](Cc2ccc(F)c(F)c2)CC1 ZINC000352800093 177101534 /nfs/dbraw/zinc/10/15/34/177101534.db2.gz GREFRZMAAPQROL-NSHDSACASA-N 1 1 239.309 3.587 20 0 BHADMO C[C@H]1CCC[N@@H+](Cc2cccc(F)c2F)CC1 ZINC000352801214 177102418 /nfs/dbraw/zinc/10/24/18/177102418.db2.gz RZLUXFISOWUFGS-NSHDSACASA-N 1 1 239.309 3.587 20 0 BHADMO C[C@@H]1CCC[N@@H+](Cc2cccc3[nH]ccc32)CC1 ZINC000352804107 176100731 /nfs/dbraw/zinc/10/07/31/176100731.db2.gz ZKILZSHTSHWUGB-CYBMUJFWSA-N 1 1 242.366 3.790 20 0 BHADMO C[C@H]1CCC[N@@H+](Cc2cccc3[nH]ccc32)CC1 ZINC000352804114 177102279 /nfs/dbraw/zinc/10/22/79/177102279.db2.gz ZKILZSHTSHWUGB-ZDUSSCGKSA-N 1 1 242.366 3.790 20 0 BHADMO C[C@@H]1CCC[N@@H+](Cc2cccc3cc[nH]c32)CC1 ZINC000352807113 176101900 /nfs/dbraw/zinc/10/19/00/176101900.db2.gz WESRBBHOUUGDGD-CYBMUJFWSA-N 1 1 242.366 3.790 20 0 BHADMO C[C@H]1CCC[N@@H+](Cc2cccc3cc[nH]c32)CC1 ZINC000352807115 177101971 /nfs/dbraw/zinc/10/19/71/177101971.db2.gz WESRBBHOUUGDGD-ZDUSSCGKSA-N 1 1 242.366 3.790 20 0 BHADMO CC[N@@H+](Cc1cccc(COC)c1)[C@@H](C)C(C)C ZINC000352816594 356422001 /nfs/dbraw/zinc/42/20/01/356422001.db2.gz OYUQMXOWBXZDFN-AWEZNQCLSA-N 1 1 249.398 3.699 20 0 BHADMO CC[N@@H+](Cc1cccc(COC)c1)[C@H](C)C(C)C ZINC000352816597 356422453 /nfs/dbraw/zinc/42/24/53/356422453.db2.gz OYUQMXOWBXZDFN-CQSZACIVSA-N 1 1 249.398 3.699 20 0 BHADMO CCOCCC[N@@H+]([C@@H](C)c1ccccc1)C1CC1 ZINC000352822875 170372098 /nfs/dbraw/zinc/37/20/98/170372098.db2.gz HVGXQCMWJNUVSP-AWEZNQCLSA-N 1 1 247.382 3.639 20 0 BHADMO CCOCCC[N@@H+]([C@H](C)c1ccccc1)C1CC1 ZINC000352822876 170371782 /nfs/dbraw/zinc/37/17/82/170371782.db2.gz HVGXQCMWJNUVSP-CQSZACIVSA-N 1 1 247.382 3.639 20 0 BHADMO CSCCC[N@@H+]([C@H](C)c1ccccc1)C1CC1 ZINC000352831668 386677388 /nfs/dbraw/zinc/67/73/88/386677388.db2.gz MNJIWUCTGLGAPC-CYBMUJFWSA-N 1 1 249.423 3.965 20 0 BHADMO CSCCC[N@@H+]([C@@H](C)c1ccccc1)C1CC1 ZINC000352831676 386676631 /nfs/dbraw/zinc/67/66/31/386676631.db2.gz MNJIWUCTGLGAPC-ZDUSSCGKSA-N 1 1 249.423 3.965 20 0 BHADMO CC(C)OCC[N@@H+]([C@@H](C)c1ccccc1)C1CC1 ZINC000352834833 167229178 /nfs/dbraw/zinc/22/91/78/167229178.db2.gz XDBNWPMXPPPARR-AWEZNQCLSA-N 1 1 247.382 3.637 20 0 BHADMO CC(C)OCC[N@@H+]([C@H](C)c1ccccc1)C1CC1 ZINC000352834834 167228286 /nfs/dbraw/zinc/22/82/86/167228286.db2.gz XDBNWPMXPPPARR-CQSZACIVSA-N 1 1 247.382 3.637 20 0 BHADMO Cc1sccc1C[N@@H+](C)C[C@@H]1CC=CCC1 ZINC000352855231 386759994 /nfs/dbraw/zinc/75/99/94/386759994.db2.gz BOZLUYNXIZEVDP-CYBMUJFWSA-N 1 1 235.396 3.845 20 0 BHADMO Cc1sccc1C[N@@H+](C)C[C@H]1CC=CCC1 ZINC000352855233 386760274 /nfs/dbraw/zinc/76/02/74/386760274.db2.gz BOZLUYNXIZEVDP-ZDUSSCGKSA-N 1 1 235.396 3.845 20 0 BHADMO CC(C)(C)C[C@H]1CCC[N@H+]1Cc1ccco1 ZINC000352866460 386785439 /nfs/dbraw/zinc/78/54/39/386785439.db2.gz LIAQDNSTUAKREG-GFCCVEGCSA-N 1 1 221.344 3.680 20 0 BHADMO CC(C)(C)C[C@@H]1CCC[N@H+]1Cc1ccco1 ZINC000352866461 386784439 /nfs/dbraw/zinc/78/44/39/386784439.db2.gz LIAQDNSTUAKREG-LBPRGKRZSA-N 1 1 221.344 3.680 20 0 BHADMO CC(C)(C)C[C@H]1CCC[N@H+]1Cc1nccs1 ZINC000352867334 386788146 /nfs/dbraw/zinc/78/81/46/386788146.db2.gz QHLCADQULXCBBD-LLVKDONJSA-N 1 1 238.400 3.544 20 0 BHADMO CC(C)(C)C[C@@H]1CCC[N@H+]1Cc1nccs1 ZINC000352867335 386786867 /nfs/dbraw/zinc/78/68/67/386786867.db2.gz QHLCADQULXCBBD-NSHDSACASA-N 1 1 238.400 3.544 20 0 BHADMO C[N@H+]1CC[C@@H](CSC2CCC(C)(C)CC2)C1 ZINC000352902780 173117212 /nfs/dbraw/zinc/11/72/12/173117212.db2.gz QSPIUGNEXSMIKM-GFCCVEGCSA-N 1 1 241.444 3.640 20 0 BHADMO C[N@H+]1CC[C@H](CSC2CCC(C)(C)CC2)C1 ZINC000352902790 173147535 /nfs/dbraw/zinc/14/75/35/173147535.db2.gz QSPIUGNEXSMIKM-LBPRGKRZSA-N 1 1 241.444 3.640 20 0 BHADMO CCC1(CC)CCC([NH2+]Cc2n[nH]cc2C)CC1 ZINC000352904548 386955963 /nfs/dbraw/zinc/95/59/63/386955963.db2.gz UEAKZZQWPLGUOP-UHFFFAOYSA-N 1 1 249.402 3.557 20 0 BHADMO Cc1ccc(C[N@H+]2CCC[C@H]2C2CCC2)s1 ZINC000352925643 386968042 /nfs/dbraw/zinc/96/80/42/386968042.db2.gz NGVYMBYTJIFTRX-AWEZNQCLSA-N 1 1 235.396 3.821 20 0 BHADMO Cc1ccc(C[N@H+]2CCC[C@@H]2C2CCC2)s1 ZINC000352925644 386969797 /nfs/dbraw/zinc/96/97/97/386969797.db2.gz NGVYMBYTJIFTRX-CQSZACIVSA-N 1 1 235.396 3.821 20 0 BHADMO C[C@@H]1CCC[N@@H+](Cc2c(F)cccc2F)[C@@H]1C ZINC000352926392 176100448 /nfs/dbraw/zinc/10/04/48/176100448.db2.gz OQGBZGBUCVXOKZ-GHMZBOCLSA-N 1 1 239.309 3.585 20 0 BHADMO C[C@@H]1CCC[N@@H+](Cc2c(F)cccc2F)[C@H]1C ZINC000352926393 386969272 /nfs/dbraw/zinc/96/92/72/386969272.db2.gz OQGBZGBUCVXOKZ-MNOVXSKESA-N 1 1 239.309 3.585 20 0 BHADMO C[C@H]1CCC[N@@H+](Cc2c(F)cccc2F)[C@H]1C ZINC000352926394 177099104 /nfs/dbraw/zinc/09/91/04/177099104.db2.gz OQGBZGBUCVXOKZ-QWRGUYRKSA-N 1 1 239.309 3.585 20 0 BHADMO C[C@@H]1[C@@H](C)CCC[N@H+]1Cc1c(F)cccc1F ZINC000352926395 177100152 /nfs/dbraw/zinc/10/01/52/177100152.db2.gz OQGBZGBUCVXOKZ-WDEREUQCSA-N 1 1 239.309 3.585 20 0 BHADMO C[C@@H]1CCC[N@@H+](Cc2ccc(F)cc2F)[C@@H]1C ZINC000352926407 176101933 /nfs/dbraw/zinc/10/19/33/176101933.db2.gz OZSSHADIMCWXDE-GHMZBOCLSA-N 1 1 239.309 3.585 20 0 BHADMO C[C@@H]1CCC[N@@H+](Cc2ccc(F)cc2F)[C@H]1C ZINC000352926408 386967895 /nfs/dbraw/zinc/96/78/95/386967895.db2.gz OZSSHADIMCWXDE-MNOVXSKESA-N 1 1 239.309 3.585 20 0 BHADMO C[C@H]1CCC[N@@H+](Cc2ccc(F)cc2F)[C@H]1C ZINC000352926409 177102188 /nfs/dbraw/zinc/10/21/88/177102188.db2.gz OZSSHADIMCWXDE-QWRGUYRKSA-N 1 1 239.309 3.585 20 0 BHADMO C[C@@H]1[C@@H](C)CCC[N@H+]1Cc1ccc(F)cc1F ZINC000352926410 177102429 /nfs/dbraw/zinc/10/24/29/177102429.db2.gz OZSSHADIMCWXDE-WDEREUQCSA-N 1 1 239.309 3.585 20 0 BHADMO C[C@@H]1CCC[N@@H+](Cc2cc(F)ccc2F)[C@@H]1C ZINC000352926496 176099395 /nfs/dbraw/zinc/09/93/95/176099395.db2.gz PSNGJMKLWROQGU-GHMZBOCLSA-N 1 1 239.309 3.585 20 0 BHADMO C[C@@H]1CCC[N@@H+](Cc2cc(F)ccc2F)[C@H]1C ZINC000352926497 386969379 /nfs/dbraw/zinc/96/93/79/386969379.db2.gz PSNGJMKLWROQGU-MNOVXSKESA-N 1 1 239.309 3.585 20 0 BHADMO C[C@H]1CCC[N@@H+](Cc2cc(F)ccc2F)[C@H]1C ZINC000352926498 177099162 /nfs/dbraw/zinc/09/91/62/177099162.db2.gz PSNGJMKLWROQGU-QWRGUYRKSA-N 1 1 239.309 3.585 20 0 BHADMO C[C@@H]1[C@@H](C)CCC[N@H+]1Cc1cc(F)ccc1F ZINC000352926499 177100551 /nfs/dbraw/zinc/10/05/51/177100551.db2.gz PSNGJMKLWROQGU-WDEREUQCSA-N 1 1 239.309 3.585 20 0 BHADMO Cc1ccsc1C[N@@H+]1CCC[C@H](C)[C@H]1C ZINC000352927250 386969348 /nfs/dbraw/zinc/96/93/48/386969348.db2.gz VNEJVCAOUMQSLG-CMPLNLGQSA-N 1 1 223.385 3.677 20 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20 0 BHADMO C[C@@H]1[C@@H](C)CCC[N@H+]1Cc1ccc(F)c(F)c1 ZINC000352927464 177102421 /nfs/dbraw/zinc/10/24/21/177102421.db2.gz XPBRFBJRGCMEME-WDEREUQCSA-N 1 1 239.309 3.585 20 0 BHADMO C[C@@H]1CCC[N@@H+](Cc2cccc3cc[nH]c32)[C@@H]1C ZINC000352927821 176101395 /nfs/dbraw/zinc/10/13/95/176101395.db2.gz YQCZFCLGCKSZAG-CHWSQXEVSA-N 1 1 242.366 3.788 20 0 BHADMO C[C@@H]1CCC[N@@H+](Cc2cccc3cc[nH]c32)[C@H]1C ZINC000352927822 386968140 /nfs/dbraw/zinc/96/81/40/386968140.db2.gz YQCZFCLGCKSZAG-OLZOCXBDSA-N 1 1 242.366 3.788 20 0 BHADMO C[C@@H]1[C@@H](C)CCC[N@H+]1Cc1cccc2cc[nH]c21 ZINC000352927823 177102324 /nfs/dbraw/zinc/10/23/24/177102324.db2.gz YQCZFCLGCKSZAG-QWHCGFSZSA-N 1 1 242.366 3.788 20 0 BHADMO C[C@H]1CCC[N@@H+](Cc2cccc3cc[nH]c32)[C@H]1C ZINC000352927824 177101265 /nfs/dbraw/zinc/10/12/65/177101265.db2.gz YQCZFCLGCKSZAG-STQMWFEESA-N 1 1 242.366 3.788 20 0 BHADMO Cc1ccc(C[N@H+]2CCCC2(C)C)cc1F ZINC000352933460 386972345 /nfs/dbraw/zinc/97/23/45/386972345.db2.gz CKOHAUDXFVPIOF-UHFFFAOYSA-N 1 1 221.319 3.509 20 0 BHADMO CC1(C)CCC[N@H+]1Cc1cc2cc(F)ccc2o1 ZINC000352935195 356645456 /nfs/dbraw/zinc/64/54/56/356645456.db2.gz NKTPKZGFZXKWNY-UHFFFAOYSA-N 1 1 247.313 3.946 20 0 BHADMO Cc1ccsc1C[N@H+]1CCC[C@@H]1C1CCC1 ZINC000352935895 386971687 /nfs/dbraw/zinc/97/16/87/386971687.db2.gz RVDDRCCIYHBZKJ-CYBMUJFWSA-N 1 1 235.396 3.821 20 0 BHADMO Cc1ccsc1C[N@H+]1CCC[C@H]1C1CCC1 ZINC000352935896 386970316 /nfs/dbraw/zinc/97/03/16/386970316.db2.gz RVDDRCCIYHBZKJ-ZDUSSCGKSA-N 1 1 235.396 3.821 20 0 BHADMO Cc1ccc(F)c(C[N@H+]2CCCC2(C)C)c1 ZINC000352935947 386972075 /nfs/dbraw/zinc/97/20/75/386972075.db2.gz SMNYDOGKZMIOCU-UHFFFAOYSA-N 1 1 221.319 3.509 20 0 BHADMO C[C@H]1C[C@@H]1c1ccc(C[N@H+]2CCCC2(C)C)o1 ZINC000352936067 177351235 /nfs/dbraw/zinc/35/12/35/177351235.db2.gz SXFFHCFBMPKXMU-AAEUAGOBSA-N 1 1 233.355 3.777 20 0 BHADMO C[C@@H]1C[C@H]1c1ccc(C[N@H+]2CCCC2(C)C)o1 ZINC000352936068 187207219 /nfs/dbraw/zinc/20/72/19/187207219.db2.gz SXFFHCFBMPKXMU-DGCLKSJQSA-N 1 1 233.355 3.777 20 0 BHADMO C[C@H]1C[C@H]1c1ccc(C[N@H+]2CCCC2(C)C)o1 ZINC000352936069 386970717 /nfs/dbraw/zinc/97/07/17/386970717.db2.gz SXFFHCFBMPKXMU-WCQYABFASA-N 1 1 233.355 3.777 20 0 BHADMO C[C@@H]1C[C@@H]1c1ccc(C[N@H+]2CCCC2(C)C)o1 ZINC000352936070 386970224 /nfs/dbraw/zinc/97/02/24/386970224.db2.gz SXFFHCFBMPKXMU-YPMHNXCESA-N 1 1 233.355 3.777 20 0 BHADMO C[C@@H]1CCC[N@@H+](Cc2cccc3[nH]ccc32)[C@@H]1C ZINC000352936191 176101991 /nfs/dbraw/zinc/10/19/91/176101991.db2.gz VZUHIQMIPOMLOS-CHWSQXEVSA-N 1 1 242.366 3.788 20 0 BHADMO C[C@@H]1CCC[N@@H+](Cc2cccc3[nH]ccc32)[C@H]1C ZINC000352936192 386972277 /nfs/dbraw/zinc/97/22/77/386972277.db2.gz VZUHIQMIPOMLOS-OLZOCXBDSA-N 1 1 242.366 3.788 20 0 BHADMO C[C@@H]1[C@@H](C)CCC[N@H+]1Cc1cccc2[nH]ccc21 ZINC000352936193 177101205 /nfs/dbraw/zinc/10/12/05/177101205.db2.gz VZUHIQMIPOMLOS-QWHCGFSZSA-N 1 1 242.366 3.788 20 0 BHADMO C[C@H]1CCC[N@@H+](Cc2cccc3[nH]ccc32)[C@H]1C ZINC000352936194 177101093 /nfs/dbraw/zinc/10/10/93/177101093.db2.gz VZUHIQMIPOMLOS-STQMWFEESA-N 1 1 242.366 3.788 20 0 BHADMO CC[C@H]1[C@@H](C)CC[N@H+]1Cc1ccsc1C ZINC000352946566 386974230 /nfs/dbraw/zinc/97/42/30/386974230.db2.gz MOPKIEQZGBAXKL-GWCFXTLKSA-N 1 1 223.385 3.677 20 0 BHADMO CC[C@@H]1[C@@H](C)CC[N@H+]1Cc1ccsc1C ZINC000352946568 171156582 /nfs/dbraw/zinc/15/65/82/171156582.db2.gz MOPKIEQZGBAXKL-GXFFZTMASA-N 1 1 223.385 3.677 20 0 BHADMO CC[C@H]1[C@H](C)CC[N@H+]1Cc1ccsc1C ZINC000352946569 386975017 /nfs/dbraw/zinc/97/50/17/386975017.db2.gz MOPKIEQZGBAXKL-MFKMUULPSA-N 1 1 223.385 3.677 20 0 BHADMO CC[C@@H]1[C@H](C)CC[N@H+]1Cc1ccsc1C ZINC000352946571 171160518 /nfs/dbraw/zinc/16/05/18/171160518.db2.gz MOPKIEQZGBAXKL-ZWNOBZJWSA-N 1 1 223.385 3.677 20 0 BHADMO Cc1sccc1C[N@@H+]1CCCC[C@@H](C)C1 ZINC000352948518 386973611 /nfs/dbraw/zinc/97/36/11/386973611.db2.gz ULGKLNPQNZAQEG-LLVKDONJSA-N 1 1 223.385 3.679 20 0 BHADMO Cc1sccc1C[N@@H+]1CCCC[C@H](C)C1 ZINC000352948520 386973284 /nfs/dbraw/zinc/97/32/84/386973284.db2.gz ULGKLNPQNZAQEG-NSHDSACASA-N 1 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UZPBBSJIJKVACI-UHFFFAOYSA-N 1 1 249.313 3.949 20 0 BHADMO Cc1ccoc1C[N@H+]1CCc2ccccc2[C@H]1C ZINC000353407308 387195659 /nfs/dbraw/zinc/19/56/59/387195659.db2.gz RVFLPMHWXSTZSI-CYBMUJFWSA-N 1 1 241.334 3.707 20 0 BHADMO Cc1ccoc1C[N@H+]1CCc2ccccc2[C@@H]1C ZINC000353407313 387194238 /nfs/dbraw/zinc/19/42/38/387194238.db2.gz RVFLPMHWXSTZSI-ZDUSSCGKSA-N 1 1 241.334 3.707 20 0 BHADMO Cc1ccc(F)c([C@H](C)[C@@H](C)c2[nH]cc[nH+]2)c1 ZINC000353408134 538739118 /nfs/dbraw/zinc/73/91/18/538739118.db2.gz YNZYMMBSWJNHLH-GHMZBOCLSA-N 1 1 232.302 3.764 20 0 BHADMO Cc1ccc(F)c([C@H](C)[C@H](C)c2[nH]cc[nH+]2)c1 ZINC000353408135 538739268 /nfs/dbraw/zinc/73/92/68/538739268.db2.gz YNZYMMBSWJNHLH-MNOVXSKESA-N 1 1 232.302 3.764 20 0 BHADMO Cc1ccc(F)c([C@@H](C)[C@H](C)c2[nH]cc[nH+]2)c1 ZINC000353408136 538739878 /nfs/dbraw/zinc/73/98/78/538739878.db2.gz YNZYMMBSWJNHLH-QWRGUYRKSA-N 1 1 232.302 3.764 20 0 BHADMO Cc1ccc(F)c([C@@H](C)[C@@H](C)c2[nH]cc[nH+]2)c1 ZINC000353408137 538739376 /nfs/dbraw/zinc/73/93/76/538739376.db2.gz YNZYMMBSWJNHLH-WDEREUQCSA-N 1 1 232.302 3.764 20 0 BHADMO C[C@@H]1c2ccccc2CC[N@@H+]1Cc1ccsc1 ZINC000353408560 387197802 /nfs/dbraw/zinc/19/78/02/387197802.db2.gz UABNQCGLLNCBJY-GFCCVEGCSA-N 1 1 243.375 3.867 20 0 BHADMO C[C@H]1c2ccccc2CC[N@@H+]1Cc1ccsc1 ZINC000353408561 387197328 /nfs/dbraw/zinc/19/73/28/387197328.db2.gz UABNQCGLLNCBJY-LBPRGKRZSA-N 1 1 243.375 3.867 20 0 BHADMO Cc1ccoc1C[N@H+]1CCCc2ccccc2C1 ZINC000353416174 387197467 /nfs/dbraw/zinc/19/74/67/387197467.db2.gz LVEKVBGBTYEWPH-UHFFFAOYSA-N 1 1 241.334 3.536 20 0 BHADMO c1cc(C[N@H+]2CCCc3ccccc3C2)cs1 ZINC000353418280 387197910 /nfs/dbraw/zinc/19/79/10/387197910.db2.gz CDJUNINTWVJHEH-UHFFFAOYSA-N 1 1 243.375 3.697 20 0 BHADMO Cc1ccc(C[N@H+]2CCCc3ccccc3C2)o1 ZINC000353419218 487662069 /nfs/dbraw/zinc/66/20/69/487662069.db2.gz BFZSYNNADCZFTR-UHFFFAOYSA-N 1 1 241.334 3.536 20 0 BHADMO Cc1ccc(CCC[N@H+](CC(C)C)C(C)C)cn1 ZINC000353436642 387201386 /nfs/dbraw/zinc/20/13/86/387201386.db2.gz IBTPHYFKSKRNNK-UHFFFAOYSA-N 1 1 248.414 3.689 20 0 BHADMO Cc1ccoc1C[N@H+]1CCC[C@@H]1C(C)(C)C ZINC000353440537 398045727 /nfs/dbraw/zinc/04/57/27/398045727.db2.gz KWQFHKQDQRNUEM-CYBMUJFWSA-N 1 1 221.344 3.599 20 0 BHADMO Cc1ccoc1C[N@H+]1CCC[C@H]1C(C)(C)C ZINC000353440538 398045760 /nfs/dbraw/zinc/04/57/60/398045760.db2.gz KWQFHKQDQRNUEM-ZDUSSCGKSA-N 1 1 221.344 3.599 20 0 BHADMO Cn1ccc(C[N@@H+](CC2CC2)C2CCCCC2)c1 ZINC000353440665 386687857 /nfs/dbraw/zinc/68/78/57/386687857.db2.gz ZQQJKOIBSFSEDH-UHFFFAOYSA-N 1 1 246.398 3.570 20 0 BHADMO CCCC[C@H](CC)C[NH2+][C@@H]1CCCc2[nH]ncc21 ZINC000353442954 642842633 /nfs/dbraw/zinc/84/26/33/642842633.db2.gz DOSQHFXYYBQLLV-GXTWGEPZSA-N 1 1 249.402 3.593 20 0 BHADMO CCCC[C@H](CC)C[NH2+][C@H]1CCCc2[nH]ncc21 ZINC000353442956 642842286 /nfs/dbraw/zinc/84/22/86/642842286.db2.gz DOSQHFXYYBQLLV-JSGCOSHPSA-N 1 1 249.402 3.593 20 0 BHADMO CCCC[C@@H](CC)C[NH2+][C@H]1CCCc2[nH]ncc21 ZINC000353442958 642842298 /nfs/dbraw/zinc/84/22/98/642842298.db2.gz DOSQHFXYYBQLLV-OCCSQVGLSA-N 1 1 249.402 3.593 20 0 BHADMO CCCC[C@@H](CC)C[NH2+][C@@H]1CCCc2[nH]ncc21 ZINC000353442960 642842329 /nfs/dbraw/zinc/84/23/29/642842329.db2.gz DOSQHFXYYBQLLV-TZMCWYRMSA-N 1 1 249.402 3.593 20 0 BHADMO CCC[N@@H+](CCCc1ccc(C)nc1)CC(C)C ZINC000353443417 169156706 /nfs/dbraw/zinc/15/67/06/169156706.db2.gz BUYAXWOPWZRDPH-UHFFFAOYSA-N 1 1 248.414 3.691 20 0 BHADMO CCC(CC)C[N@@H+](CC)Cc1cnccc1C ZINC000353444675 168350153 /nfs/dbraw/zinc/35/01/53/168350153.db2.gz CCQNJHVVGYZTGF-UHFFFAOYSA-N 1 1 234.387 3.648 20 0 BHADMO Cc1ccncc1C[N@H+]1CCC[C@H]1C1CCCC1 ZINC000353444730 387201190 /nfs/dbraw/zinc/20/11/90/387201190.db2.gz CIFZWLMKEDDXHR-INIZCTEOSA-N 1 1 244.382 3.545 20 0 BHADMO Cc1ccncc1C[N@H+]1CCC[C@@H]1C1CCCC1 ZINC000353444732 387202852 /nfs/dbraw/zinc/20/28/52/387202852.db2.gz CIFZWLMKEDDXHR-MRXNPFEDSA-N 1 1 244.382 3.545 20 0 BHADMO c1cc(C[N@H+](CC2CC2)C2CCCCC2)co1 ZINC000353446680 183338647 /nfs/dbraw/zinc/33/86/47/183338647.db2.gz KAGQIOVUHSUAJH-UHFFFAOYSA-N 1 1 233.355 3.824 20 0 BHADMO CC[N@@H+](CCCc1ccc(C)nc1)[C@@H](C)C(C)C ZINC000353448005 387205266 /nfs/dbraw/zinc/20/52/66/387205266.db2.gz MIQUEEGJYDFEOJ-HNNXBMFYSA-N 1 1 248.414 3.689 20 0 BHADMO CC[N@@H+](CCCc1ccc(C)nc1)[C@H](C)C(C)C ZINC000353448008 387204278 /nfs/dbraw/zinc/20/42/78/387204278.db2.gz MIQUEEGJYDFEOJ-OAHLLOKOSA-N 1 1 248.414 3.689 20 0 BHADMO Cc1ccncc1C[N@H+](C(C)C)C1CCCC1 ZINC000353449374 387204619 /nfs/dbraw/zinc/20/46/19/387204619.db2.gz QFZSGEWORTTXAE-UHFFFAOYSA-N 1 1 232.371 3.543 20 0 BHADMO CCCCC[N@@H+](Cc1cnccc1C)C(C)C ZINC000353450964 387205210 /nfs/dbraw/zinc/20/52/10/387205210.db2.gz VZIQEXOOAPTCLM-UHFFFAOYSA-N 1 1 234.387 3.791 20 0 BHADMO Cc1ccc(C[N@H+]2CCC[C@@H]2C(C)(C)C)o1 ZINC000353451766 387205015 /nfs/dbraw/zinc/20/50/15/387205015.db2.gz YFBXMGCQYCYGEJ-CYBMUJFWSA-N 1 1 221.344 3.599 20 0 BHADMO Cc1ccc(C[N@H+]2CCC[C@H]2C(C)(C)C)o1 ZINC000353451767 387205009 /nfs/dbraw/zinc/20/50/09/387205009.db2.gz YFBXMGCQYCYGEJ-ZDUSSCGKSA-N 1 1 221.344 3.599 20 0 BHADMO Cc1ccncc1C[N@H+]1CCC[C@H]1CC(C)(C)C ZINC000353452293 387205114 /nfs/dbraw/zinc/20/51/14/387205114.db2.gz VTCSRLHXQUMKNK-HNNXBMFYSA-N 1 1 246.398 3.791 20 0 BHADMO Cc1ccncc1C[N@H+]1CCC[C@@H]1CC(C)(C)C ZINC000353452296 179483750 /nfs/dbraw/zinc/48/37/50/179483750.db2.gz VTCSRLHXQUMKNK-OAHLLOKOSA-N 1 1 246.398 3.791 20 0 BHADMO Cc1ccncc1C[N@H+](CC(C)C)C1CCCC1 ZINC000353453313 387204638 /nfs/dbraw/zinc/20/46/38/387204638.db2.gz ZBKAKOFUOFIPRQ-UHFFFAOYSA-N 1 1 246.398 3.791 20 0 BHADMO C[C@H](C[N@@H+](C)Cc1ccoc1)c1ccccc1 ZINC000353453677 385682781 /nfs/dbraw/zinc/68/27/81/385682781.db2.gz GNCUBZUAWHMMDG-CYBMUJFWSA-N 1 1 229.323 3.515 20 0 BHADMO C[C@@H](C[N@@H+](C)Cc1ccoc1)c1ccccc1 ZINC000353453678 385682656 /nfs/dbraw/zinc/68/26/56/385682656.db2.gz GNCUBZUAWHMMDG-ZDUSSCGKSA-N 1 1 229.323 3.515 20 0 BHADMO CC(C)(C)[C@H]1CCC[N@H+]1Cc1ccsc1 ZINC000353455682 134163750 /nfs/dbraw/zinc/16/37/50/134163750.db2.gz ROYLFYALNBQKDB-GFCCVEGCSA-N 1 1 223.385 3.759 20 0 BHADMO CC(C)(C)[C@@H]1CCC[N@H+]1Cc1ccsc1 ZINC000353455683 535075547 /nfs/dbraw/zinc/07/55/47/535075547.db2.gz ROYLFYALNBQKDB-LBPRGKRZSA-N 1 1 223.385 3.759 20 0 BHADMO CC(C)CCC[C@H](C)[NH2+][C@@H]1CCCc2[nH]ncc21 ZINC000353457010 642843375 /nfs/dbraw/zinc/84/33/75/642843375.db2.gz XZSQGGHHFHIUOT-GXTWGEPZSA-N 1 1 249.402 3.592 20 0 BHADMO CC(C)CCC[C@H](C)[NH2+][C@H]1CCCc2[nH]ncc21 ZINC000353457011 642843733 /nfs/dbraw/zinc/84/37/33/642843733.db2.gz XZSQGGHHFHIUOT-JSGCOSHPSA-N 1 1 249.402 3.592 20 0 BHADMO CC(C)CCC[C@@H](C)[NH2+][C@H]1CCCc2[nH]ncc21 ZINC000353457012 642843501 /nfs/dbraw/zinc/84/35/01/642843501.db2.gz XZSQGGHHFHIUOT-OCCSQVGLSA-N 1 1 249.402 3.592 20 0 BHADMO CC(C)CCC[C@@H](C)[NH2+][C@@H]1CCCc2[nH]ncc21 ZINC000353457013 642843070 /nfs/dbraw/zinc/84/30/70/642843070.db2.gz XZSQGGHHFHIUOT-TZMCWYRMSA-N 1 1 249.402 3.592 20 0 BHADMO CCc1cccc(F)c1C[N@@H+](C)Cc1ccoc1 ZINC000353460748 171857588 /nfs/dbraw/zinc/85/75/88/171857588.db2.gz QOXTXNRIBIGOPS-UHFFFAOYSA-N 1 1 247.313 3.613 20 0 BHADMO CCc1cccc(F)c1C[N@H+](C)Cc1ccoc1 ZINC000353460748 171857584 /nfs/dbraw/zinc/85/75/84/171857584.db2.gz QOXTXNRIBIGOPS-UHFFFAOYSA-N 1 1 247.313 3.613 20 0 BHADMO COCc1cccc(C[N@H+]2CCCCC[C@@H]2C)c1 ZINC000353463948 387208163 /nfs/dbraw/zinc/20/81/63/387208163.db2.gz OEADIWYYJGYRRB-AWEZNQCLSA-N 1 1 247.382 3.598 20 0 BHADMO COCc1cccc(C[N@H+]2CCCCC[C@H]2C)c1 ZINC000353463951 387206400 /nfs/dbraw/zinc/20/64/00/387206400.db2.gz OEADIWYYJGYRRB-CQSZACIVSA-N 1 1 247.382 3.598 20 0 BHADMO C[C@@H]1CCCCC[N@H+]1Cc1ccsc1 ZINC000353472958 176064115 /nfs/dbraw/zinc/06/41/15/176064115.db2.gz RCMJPFPPCFXTGY-LLVKDONJSA-N 1 1 209.358 3.513 20 0 BHADMO C[C@H]1CCCCC[N@H+]1Cc1ccsc1 ZINC000353472959 177070566 /nfs/dbraw/zinc/07/05/66/177070566.db2.gz RCMJPFPPCFXTGY-NSHDSACASA-N 1 1 209.358 3.513 20 0 BHADMO CC(C)(C)CCCC[NH2+][C@@H]1CCCc2[nH]ncc21 ZINC000353499150 642857816 /nfs/dbraw/zinc/85/78/16/642857816.db2.gz TUYYJCFZFDPIFG-CYBMUJFWSA-N 1 1 249.402 3.593 20 0 BHADMO CC(C)(C)CCCC[NH2+][C@H]1CCCc2[nH]ncc21 ZINC000353499151 642858158 /nfs/dbraw/zinc/85/81/58/642858158.db2.gz TUYYJCFZFDPIFG-ZDUSSCGKSA-N 1 1 249.402 3.593 20 0 BHADMO COc1ccsc1C[N@H+]1CCCCC[C@H]1C ZINC000353505681 175376804 /nfs/dbraw/zinc/37/68/04/175376804.db2.gz LJNBOMBFCOQZJD-LLVKDONJSA-N 1 1 239.384 3.521 20 0 BHADMO COc1ccsc1C[N@H+]1CCCCC[C@@H]1C ZINC000353505682 175377391 /nfs/dbraw/zinc/37/73/91/175377391.db2.gz LJNBOMBFCOQZJD-NSHDSACASA-N 1 1 239.384 3.521 20 0 BHADMO C[C@@H]1CCCCC[N@H+]1Cc1cccs1 ZINC000353508096 176063814 /nfs/dbraw/zinc/06/38/14/176063814.db2.gz PQLIIBQBSIRCEI-LLVKDONJSA-N 1 1 209.358 3.513 20 0 BHADMO C[C@H]1CCCCC[N@H+]1Cc1cccs1 ZINC000353508097 177070265 /nfs/dbraw/zinc/07/02/65/177070265.db2.gz PQLIIBQBSIRCEI-NSHDSACASA-N 1 1 209.358 3.513 20 0 BHADMO Cc1sccc1C[N@H+](C)[C@@H](C)C1CCC1 ZINC000353515288 387219673 /nfs/dbraw/zinc/21/96/73/387219673.db2.gz DMEFGJQZVWTLQH-JTQLQIEISA-N 1 1 223.385 3.677 20 0 BHADMO Cc1sccc1C[N@H+](C)[C@H](C)C1CCC1 ZINC000353515289 387221768 /nfs/dbraw/zinc/22/17/68/387221768.db2.gz DMEFGJQZVWTLQH-SNVBAGLBSA-N 1 1 223.385 3.677 20 0 BHADMO CCCC[C@H](CCC)[NH2+][C@@H]1CCCc2[nH]ncc21 ZINC000353517476 642863665 /nfs/dbraw/zinc/86/36/65/642863665.db2.gz IWAABDGUAVOEGP-GXTWGEPZSA-N 1 1 249.402 3.736 20 0 BHADMO CCCC[C@H](CCC)[NH2+][C@H]1CCCc2[nH]ncc21 ZINC000353517479 642863839 /nfs/dbraw/zinc/86/38/39/642863839.db2.gz IWAABDGUAVOEGP-JSGCOSHPSA-N 1 1 249.402 3.736 20 0 BHADMO CCCC[C@@H](CCC)[NH2+][C@H]1CCCc2[nH]ncc21 ZINC000353517481 642863716 /nfs/dbraw/zinc/86/37/16/642863716.db2.gz IWAABDGUAVOEGP-OCCSQVGLSA-N 1 1 249.402 3.736 20 0 BHADMO CCCC[C@@H](CCC)[NH2+][C@@H]1CCCc2[nH]ncc21 ZINC000353517483 642863748 /nfs/dbraw/zinc/86/37/48/642863748.db2.gz IWAABDGUAVOEGP-TZMCWYRMSA-N 1 1 249.402 3.736 20 0 BHADMO CC[C@H](CSC)[N@@H+](C)Cc1ccsc1C ZINC000353520938 387221806 /nfs/dbraw/zinc/22/18/06/387221806.db2.gz QAVNCWHCSIPGGL-GFCCVEGCSA-N 1 1 243.441 3.630 20 0 BHADMO CC[C@@H](CSC)[N@@H+](C)Cc1ccsc1C ZINC000353520939 387221215 /nfs/dbraw/zinc/22/12/15/387221215.db2.gz QAVNCWHCSIPGGL-LBPRGKRZSA-N 1 1 243.441 3.630 20 0 BHADMO CC[C@H]1CC[C@H](C)[N@H+]1Cc1ccsc1C ZINC000353522039 387221878 /nfs/dbraw/zinc/22/18/78/387221878.db2.gz UADWMUAJBPUUJS-GWCFXTLKSA-N 1 1 223.385 3.819 20 0 BHADMO CC[C@@H]1CC[C@H](C)[N@H+]1Cc1ccsc1C ZINC000353522046 171053076 /nfs/dbraw/zinc/05/30/76/171053076.db2.gz UADWMUAJBPUUJS-GXFFZTMASA-N 1 1 223.385 3.819 20 0 BHADMO CC[C@H]1CC[C@@H](C)[N@H+]1Cc1ccsc1C ZINC000353522048 387219973 /nfs/dbraw/zinc/21/99/73/387219973.db2.gz UADWMUAJBPUUJS-MFKMUULPSA-N 1 1 223.385 3.819 20 0 BHADMO CC[C@@H]1CC[C@@H](C)[N@H+]1Cc1ccsc1C ZINC000353522050 171038188 /nfs/dbraw/zinc/03/81/88/171038188.db2.gz UADWMUAJBPUUJS-ZWNOBZJWSA-N 1 1 223.385 3.819 20 0 BHADMO C[C@@H](CCC(C)(C)C)[NH2+][C@H]1CCCc2[nH]ncc21 ZINC000353529575 642867739 /nfs/dbraw/zinc/86/77/39/642867739.db2.gz QPOKQUYMDUSVFZ-AAEUAGOBSA-N 1 1 249.402 3.592 20 0 BHADMO C[C@H](CCC(C)(C)C)[NH2+][C@@H]1CCCc2[nH]ncc21 ZINC000353529576 642867387 /nfs/dbraw/zinc/86/73/87/642867387.db2.gz QPOKQUYMDUSVFZ-DGCLKSJQSA-N 1 1 249.402 3.592 20 0 BHADMO C[C@@H](CCC(C)(C)C)[NH2+][C@@H]1CCCc2[nH]ncc21 ZINC000353529577 642866381 /nfs/dbraw/zinc/86/63/81/642866381.db2.gz QPOKQUYMDUSVFZ-WCQYABFASA-N 1 1 249.402 3.592 20 0 BHADMO C[C@H](CCC(C)(C)C)[NH2+][C@H]1CCCc2[nH]ncc21 ZINC000353529578 642867549 /nfs/dbraw/zinc/86/75/49/642867549.db2.gz QPOKQUYMDUSVFZ-YPMHNXCESA-N 1 1 249.402 3.592 20 0 BHADMO CCC(C)(C)[N@@H+](C)Cc1ccc2ncccc2c1 ZINC000353533159 168285812 /nfs/dbraw/zinc/28/58/12/168285812.db2.gz XNAUEVBWHKMKID-UHFFFAOYSA-N 1 1 242.366 3.855 20 0 BHADMO c1cc(C2CC2)cc(N[C@H]2CC[C@@H]2C2CCC2)[nH+]1 ZINC000353539233 183334638 /nfs/dbraw/zinc/33/46/38/183334638.db2.gz KLFFUXLUHLGRFE-CABCVRRESA-N 1 1 242.366 3.950 20 0 BHADMO c1cc(C2CC2)cc(N[C@H]2CC[C@H]2C2CCC2)[nH+]1 ZINC000353539234 183334743 /nfs/dbraw/zinc/33/47/43/183334743.db2.gz KLFFUXLUHLGRFE-GJZGRUSLSA-N 1 1 242.366 3.950 20 0 BHADMO c1cc(C2CC2)cc(N[C@@H]2CC[C@@H]2C2CCC2)[nH+]1 ZINC000353539235 183334738 /nfs/dbraw/zinc/33/47/38/183334738.db2.gz KLFFUXLUHLGRFE-HUUCEWRRSA-N 1 1 242.366 3.950 20 0 BHADMO c1cc(C2CC2)cc(N[C@@H]2CC[C@H]2C2CCC2)[nH+]1 ZINC000353539236 183335458 /nfs/dbraw/zinc/33/54/58/183335458.db2.gz KLFFUXLUHLGRFE-LSDHHAIUSA-N 1 1 242.366 3.950 20 0 BHADMO Cc1sccc1C[N@H+]1CCC[C@H](C2CC2)C1 ZINC000353545109 387225475 /nfs/dbraw/zinc/22/54/75/387225475.db2.gz RAQDELCBZWVHBX-AWEZNQCLSA-N 1 1 235.396 3.679 20 0 BHADMO Cc1sccc1C[N@H+]1CCC[C@@H](C2CC2)C1 ZINC000353545111 387226368 /nfs/dbraw/zinc/22/63/68/387226368.db2.gz RAQDELCBZWVHBX-CQSZACIVSA-N 1 1 235.396 3.679 20 0 BHADMO CCC(C)(C)[N@@H+](C)Cc1cc(C)sc1C ZINC000353546913 168286318 /nfs/dbraw/zinc/28/63/18/168286318.db2.gz XSNSGGKBIOTYHZ-UHFFFAOYSA-N 1 1 225.401 3.985 20 0 BHADMO C[C@]12C[C@H]1CCC[C@H]2Nc1cc(C2CC2)cc[nH+]1 ZINC000353548290 386824611 /nfs/dbraw/zinc/82/46/11/386824611.db2.gz LKSCNWFWDQPOMU-FMKPAKJESA-N 1 1 242.366 3.950 20 0 BHADMO C[C@]12C[C@H]1CCC[C@@H]2Nc1cc(C2CC2)cc[nH+]1 ZINC000353548292 386827442 /nfs/dbraw/zinc/82/74/42/386827442.db2.gz LKSCNWFWDQPOMU-YCPHGPKFSA-N 1 1 242.366 3.950 20 0 BHADMO Cc1sccc1C[N@H+]1CCCc2occc2C1 ZINC000353548929 387228293 /nfs/dbraw/zinc/22/82/93/387228293.db2.gz IBVBTVSWEWARPY-UHFFFAOYSA-N 1 1 247.363 3.598 20 0 BHADMO CCCC[C@@H](COC)Nc1cc(C2CC2)cc[nH+]1 ZINC000353552101 356713366 /nfs/dbraw/zinc/71/33/66/356713366.db2.gz XAAWETFYDACNLN-AWEZNQCLSA-N 1 1 248.370 3.576 20 0 BHADMO CCCC[C@H](COC)Nc1cc(C2CC2)cc[nH+]1 ZINC000353552102 169004176 /nfs/dbraw/zinc/00/41/76/169004176.db2.gz XAAWETFYDACNLN-CQSZACIVSA-N 1 1 248.370 3.576 20 0 BHADMO Cc1sccc1C[N@H+]1CC(C)(C)[C@H]1C1CC1 ZINC000353554218 387228581 /nfs/dbraw/zinc/22/85/81/387228581.db2.gz IVELWJNJGDJXMH-CYBMUJFWSA-N 1 1 235.396 3.677 20 0 BHADMO Cc1sccc1C[N@H+]1CC(C)(C)[C@@H]1C1CC1 ZINC000353554219 387227663 /nfs/dbraw/zinc/22/76/63/387227663.db2.gz IVELWJNJGDJXMH-ZDUSSCGKSA-N 1 1 235.396 3.677 20 0 BHADMO CC[N@H+](Cc1ccc([C@@H]2C[C@H]2C)o1)CC1CC1 ZINC000353554394 356713318 /nfs/dbraw/zinc/71/33/18/356713318.db2.gz KCNFJMAGGPLZFC-BXUZGUMPSA-N 1 1 233.355 3.635 20 0 BHADMO CC[N@H+](Cc1ccc([C@H]2C[C@@H]2C)o1)CC1CC1 ZINC000353554395 356712994 /nfs/dbraw/zinc/71/29/94/356712994.db2.gz KCNFJMAGGPLZFC-FZMZJTMJSA-N 1 1 233.355 3.635 20 0 BHADMO CC[N@H+](Cc1ccc([C@H]2C[C@H]2C)o1)CC1CC1 ZINC000353554396 356713971 /nfs/dbraw/zinc/71/39/71/356713971.db2.gz KCNFJMAGGPLZFC-RISCZKNCSA-N 1 1 233.355 3.635 20 0 BHADMO CC[N@H+](Cc1ccc([C@@H]2C[C@@H]2C)o1)CC1CC1 ZINC000353554397 356714039 /nfs/dbraw/zinc/71/40/39/356714039.db2.gz KCNFJMAGGPLZFC-SMDDNHRTSA-N 1 1 233.355 3.635 20 0 BHADMO CC[N@H+](Cc1ccc(SC)cc1)CC1CC1 ZINC000353554427 356714230 /nfs/dbraw/zinc/71/42/30/356714230.db2.gz KNNSKFMNFGRGPH-UHFFFAOYSA-N 1 1 235.396 3.640 20 0 BHADMO c1cc(C2CC2)cc(N[C@H]2CCC[C@@H]2C2CC2)[nH+]1 ZINC000353555512 183335492 /nfs/dbraw/zinc/33/54/92/183335492.db2.gz CKQUAMJSPPAYPY-CABCVRRESA-N 1 1 242.366 3.950 20 0 BHADMO c1cc(C2CC2)cc(N[C@H]2CCC[C@H]2C2CC2)[nH+]1 ZINC000353555513 183334629 /nfs/dbraw/zinc/33/46/29/183334629.db2.gz CKQUAMJSPPAYPY-GJZGRUSLSA-N 1 1 242.366 3.950 20 0 BHADMO c1cc(C2CC2)cc(N[C@@H]2CCC[C@@H]2C2CC2)[nH+]1 ZINC000353555514 183334680 /nfs/dbraw/zinc/33/46/80/183334680.db2.gz CKQUAMJSPPAYPY-HUUCEWRRSA-N 1 1 242.366 3.950 20 0 BHADMO c1cc(C2CC2)cc(N[C@@H]2CCC[C@H]2C2CC2)[nH+]1 ZINC000353555515 183334379 /nfs/dbraw/zinc/33/43/79/183334379.db2.gz CKQUAMJSPPAYPY-LSDHHAIUSA-N 1 1 242.366 3.950 20 0 BHADMO CC[N@H+](Cc1c(C)oc2ccccc21)CC1CC1 ZINC000353556581 356713960 /nfs/dbraw/zinc/71/39/60/356713960.db2.gz RXTSLLUHECWEHT-UHFFFAOYSA-N 1 1 243.350 3.973 20 0 BHADMO Cc1cccc(C[N@H+](CC(C)C)CC(C)(C)C)n1 ZINC000353556804 179071731 /nfs/dbraw/zinc/07/17/31/179071731.db2.gz DDHHBFWSWIWUAW-UHFFFAOYSA-N 1 1 248.414 3.894 20 0 BHADMO Cc1sccc1C[N@H+]1CC2(CCC2)[C@@H]1C1CC1 ZINC000353558838 387230289 /nfs/dbraw/zinc/23/02/89/387230289.db2.gz YFPWBXSHNXRCLC-AWEZNQCLSA-N 1 1 247.407 3.821 20 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c1coc(C[N@H+]2CCCC3(CCCCC3)C2)c1 ZINC000353564016 387231146 /nfs/dbraw/zinc/23/11/46/387231146.db2.gz NVTAJKZGDGFNLK-UHFFFAOYSA-N 1 1 233.355 3.826 20 0 BHADMO C[C@H](CCC1CC1)Nc1cc(C2CC2)cc[nH+]1 ZINC000353565714 387230321 /nfs/dbraw/zinc/23/03/21/387230321.db2.gz XDTNEAVYHOPJAR-LLVKDONJSA-N 1 1 230.355 3.950 20 0 BHADMO C[C@@H](CCC1CC1)Nc1cc(C2CC2)cc[nH+]1 ZINC000353565716 387231275 /nfs/dbraw/zinc/23/12/75/387231275.db2.gz XDTNEAVYHOPJAR-NSHDSACASA-N 1 1 230.355 3.950 20 0 BHADMO c1cncc(C[N@H+]2CCCC3(CCCCC3)C2)c1 ZINC000353568292 385946784 /nfs/dbraw/zinc/94/67/84/385946784.db2.gz TWCRFUCACWVBNR-UHFFFAOYSA-N 1 1 244.382 3.628 20 0 BHADMO Cn1cccc1C[N@H+]1CCCC2(CCCCC2)C1 ZINC000353569136 387234001 /nfs/dbraw/zinc/23/40/01/387234001.db2.gz NKMHZFLLQGIWRM-UHFFFAOYSA-N 1 1 246.398 3.571 20 0 BHADMO CC[N@H+](Cc1cc2cc(F)ccc2o1)CC1CC1 ZINC000353569147 356713675 /nfs/dbraw/zinc/71/36/75/356713675.db2.gz NLZFVLQXEUOJIS-UHFFFAOYSA-N 1 1 247.313 3.804 20 0 BHADMO C[C@@H](Nc1cc(C2CC2)cc[nH+]1)C1CCCC1 ZINC000353570645 387232612 /nfs/dbraw/zinc/23/26/12/387232612.db2.gz FBNINZKSDXMFDO-LLVKDONJSA-N 1 1 230.355 3.950 20 0 BHADMO C[C@H](Nc1cc(C2CC2)cc[nH+]1)C1CCCC1 ZINC000353570646 387233966 /nfs/dbraw/zinc/23/39/66/387233966.db2.gz FBNINZKSDXMFDO-NSHDSACASA-N 1 1 230.355 3.950 20 0 BHADMO Cn1ccc(C[N@H+]2CCCC3(CCCCC3)C2)c1 ZINC000353571153 387232367 /nfs/dbraw/zinc/23/23/67/387232367.db2.gz RCMVBVLJWJSJTN-UHFFFAOYSA-N 1 1 246.398 3.571 20 0 BHADMO CCC(C)(C)[N@@H+](C)Cc1csc(C(C)C)n1 ZINC000353579834 168288520 /nfs/dbraw/zinc/28/85/20/168288520.db2.gz XKLMFIHKSUZPGY-UHFFFAOYSA-N 1 1 240.416 3.887 20 0 BHADMO CC[N@H+](Cc1coc2ccccc12)CC1CC1 ZINC000353584387 169933060 /nfs/dbraw/zinc/93/30/60/169933060.db2.gz GKFYNKGUWBYHFY-UHFFFAOYSA-N 1 1 229.323 3.665 20 0 BHADMO CCC1(CC)CC[N@@H+](Cc2ccsc2)C1 ZINC000353586558 387235959 /nfs/dbraw/zinc/23/59/59/387235959.db2.gz DMJPFACEMBTYIK-UHFFFAOYSA-N 1 1 223.385 3.760 20 0 BHADMO Cc1cc(C[N@H+]2CCC(C)(C)C2)c(C)s1 ZINC000353588071 387236036 /nfs/dbraw/zinc/23/60/36/387236036.db2.gz LCTXCUCUJQAFEM-UHFFFAOYSA-N 1 1 223.385 3.597 20 0 BHADMO Cc1oc2ccccc2c1C[N@@H+]1CCC[C@H]1C ZINC000353589655 386256470 /nfs/dbraw/zinc/25/64/70/386256470.db2.gz RWAQXWLUFPWIKL-LLVKDONJSA-N 1 1 229.323 3.726 20 0 BHADMO Cc1oc2ccccc2c1C[N@@H+]1CCC[C@@H]1C ZINC000353589656 386257694 /nfs/dbraw/zinc/25/76/94/386257694.db2.gz RWAQXWLUFPWIKL-NSHDSACASA-N 1 1 229.323 3.726 20 0 BHADMO CC(C)C[C@H]1CC[N@@H+](Cc2ccsc2)C1 ZINC000353593020 187373247 /nfs/dbraw/zinc/37/32/47/187373247.db2.gz VIIHOTBZCWTVJF-GFCCVEGCSA-N 1 1 223.385 3.616 20 0 BHADMO CC(C)C[C@@H]1CC[N@@H+](Cc2ccsc2)C1 ZINC000353593022 187209700 /nfs/dbraw/zinc/20/97/00/187209700.db2.gz VIIHOTBZCWTVJF-LBPRGKRZSA-N 1 1 223.385 3.616 20 0 BHADMO CC1(C)CC[N@@H+](Cc2cc3cc(F)ccc3o2)C1 ZINC000353593122 356714768 /nfs/dbraw/zinc/71/47/68/356714768.db2.gz WVNRKXSTVFRQCP-UHFFFAOYSA-N 1 1 247.313 3.804 20 0 BHADMO C[C@H]1CCC[N@H+]1Cc1cccc(C(F)(F)F)c1 ZINC000353593141 177110250 /nfs/dbraw/zinc/11/02/50/177110250.db2.gz XHTZERJIQXJUBH-JTQLQIEISA-N 1 1 243.272 3.690 20 0 BHADMO C[C@@H]1CCC[N@H+]1Cc1cccc(C(F)(F)F)c1 ZINC000353593142 176110900 /nfs/dbraw/zinc/11/09/00/176110900.db2.gz XHTZERJIQXJUBH-SNVBAGLBSA-N 1 1 243.272 3.690 20 0 BHADMO CSc1ccc(C[N@H+]2CCC(C)(C)C2)cc1 ZINC000353607856 188061739 /nfs/dbraw/zinc/06/17/39/188061739.db2.gz BRDNKCVDJQZIJS-UHFFFAOYSA-N 1 1 235.396 3.640 20 0 BHADMO CC1(C)CC[N@@H+](Cc2coc3ccccc23)C1 ZINC000353608359 356714692 /nfs/dbraw/zinc/71/46/92/356714692.db2.gz GMKVVZFSLQRMRU-UHFFFAOYSA-N 1 1 229.323 3.665 20 0 BHADMO CC(C)CCn1cccc1C[N@H+]1CCC[C@@H]1C ZINC000353608439 352530910 /nfs/dbraw/zinc/53/09/10/352530910.db2.gz HRXBPQRCYZGKFR-AWEZNQCLSA-N 1 1 234.387 3.519 20 0 BHADMO CC(C)CCn1cccc1C[N@H+]1CCC[C@H]1C ZINC000353608440 352531499 /nfs/dbraw/zinc/53/14/99/352531499.db2.gz HRXBPQRCYZGKFR-CQSZACIVSA-N 1 1 234.387 3.519 20 0 BHADMO CCC1(CC)CC[N@@H+](Cc2ccc(C)o2)C1 ZINC000353608844 387241570 /nfs/dbraw/zinc/24/15/70/387241570.db2.gz JDFHRPNSIHPZTD-UHFFFAOYSA-N 1 1 221.344 3.600 20 0 BHADMO CC[N@H+](Cc1ccccn1)CC1CCC(C)CC1 ZINC000353611265 352547573 /nfs/dbraw/zinc/54/75/73/352547573.db2.gz BOLAHJWOQOOJOD-UHFFFAOYSA-N 1 1 246.398 3.730 20 0 BHADMO C[C@H]1C[C@@H]1c1ccc(C[N@H+]2CCC(C)(C)C2)o1 ZINC000353612726 177351468 /nfs/dbraw/zinc/35/14/68/177351468.db2.gz KKSUTRGJLYQSGP-AAEUAGOBSA-N 1 1 233.355 3.635 20 0 BHADMO C[C@@H]1C[C@H]1c1ccc(C[N@H+]2CCC(C)(C)C2)o1 ZINC000353612728 387241792 /nfs/dbraw/zinc/24/17/92/387241792.db2.gz KKSUTRGJLYQSGP-DGCLKSJQSA-N 1 1 233.355 3.635 20 0 BHADMO C[C@H]1C[C@H]1c1ccc(C[N@H+]2CCC(C)(C)C2)o1 ZINC000353612729 188234743 /nfs/dbraw/zinc/23/47/43/188234743.db2.gz KKSUTRGJLYQSGP-WCQYABFASA-N 1 1 233.355 3.635 20 0 BHADMO C[C@@H]1C[C@@H]1c1ccc(C[N@H+]2CCC(C)(C)C2)o1 ZINC000353612731 387240781 /nfs/dbraw/zinc/24/07/81/387240781.db2.gz KKSUTRGJLYQSGP-YPMHNXCESA-N 1 1 233.355 3.635 20 0 BHADMO C[C@@H]([NH2+]CC(F)(F)c1ccccc1)C1(C)CC1 ZINC000353613374 387241999 /nfs/dbraw/zinc/24/19/99/387241999.db2.gz VEGXGOPXWQJORO-LLVKDONJSA-N 1 1 239.309 3.557 20 0 BHADMO C[C@H]([NH2+]CC(F)(F)c1ccccc1)C1(C)CC1 ZINC000353613375 387240801 /nfs/dbraw/zinc/24/08/01/387240801.db2.gz VEGXGOPXWQJORO-NSHDSACASA-N 1 1 239.309 3.557 20 0 BHADMO CCC1(CC)CC[N@@H+](Cc2occc2C)C1 ZINC000353614648 386582828 /nfs/dbraw/zinc/58/28/28/386582828.db2.gz TXOOQXUDFQRTKE-UHFFFAOYSA-N 1 1 221.344 3.600 20 0 BHADMO C[C@@H]1CCC[N@H+]1Cc1csc2ccccc12 ZINC000353615928 176110166 /nfs/dbraw/zinc/11/01/66/176110166.db2.gz XLJGYUHTJHKMTF-LLVKDONJSA-N 1 1 231.364 3.886 20 0 BHADMO C[C@H]1CCC[N@H+]1Cc1csc2ccccc12 ZINC000353615941 177109958 /nfs/dbraw/zinc/10/99/58/177109958.db2.gz XLJGYUHTJHKMTF-NSHDSACASA-N 1 1 231.364 3.886 20 0 BHADMO CC1CCC(C[N@@H+](CC(F)F)C2CC2)CC1 ZINC000353616306 168152950 /nfs/dbraw/zinc/15/29/50/168152950.db2.gz ZKFABKLDGLIIMZ-UHFFFAOYSA-N 1 1 231.330 3.542 20 0 BHADMO CC1CCC(C[N@H+](CC(F)F)C2CC2)CC1 ZINC000353616306 168152948 /nfs/dbraw/zinc/15/29/48/168152948.db2.gz ZKFABKLDGLIIMZ-UHFFFAOYSA-N 1 1 231.330 3.542 20 0 BHADMO Cc1ccncc1C[N@H+](C)C1CCC(C)(C)CC1 ZINC000353618814 387242512 /nfs/dbraw/zinc/24/25/12/387242512.db2.gz BJISJDVEMVFRJR-UHFFFAOYSA-N 1 1 246.398 3.791 20 0 BHADMO Cc1ccncc1C[N@H+](C)CC1CCC(C)CC1 ZINC000353618868 188234972 /nfs/dbraw/zinc/23/49/72/188234972.db2.gz CAIVNSVMQBNFKX-UHFFFAOYSA-N 1 1 246.398 3.648 20 0 BHADMO CC[C@H](C)[C@@H]1CCCC[N@H+]1Cc1cnccc1C ZINC000353619619 171381603 /nfs/dbraw/zinc/38/16/03/171381603.db2.gz WIYUFNHCLNJWAH-BBRMVZONSA-N 1 1 246.398 3.791 20 0 BHADMO CC[C@@H](C)[C@@H]1CCCC[N@H+]1Cc1cnccc1C ZINC000353619621 387243711 /nfs/dbraw/zinc/24/37/11/387243711.db2.gz WIYUFNHCLNJWAH-CJNGLKHVSA-N 1 1 246.398 3.791 20 0 BHADMO CC[C@@H](C)[C@H]1CCCC[N@H+]1Cc1cnccc1C ZINC000353619622 387243908 /nfs/dbraw/zinc/24/39/08/387243908.db2.gz WIYUFNHCLNJWAH-CZUORRHYSA-N 1 1 246.398 3.791 20 0 BHADMO CC[C@H](C)[C@H]1CCCC[N@H+]1Cc1cnccc1C ZINC000353619624 387242624 /nfs/dbraw/zinc/24/26/24/387242624.db2.gz WIYUFNHCLNJWAH-XJKSGUPXSA-N 1 1 246.398 3.791 20 0 BHADMO CCC[C@@H]1[C@H](C)CCC[N@H+]1Cc1cnccc1C ZINC000353620313 387243671 /nfs/dbraw/zinc/24/36/71/387243671.db2.gz XWFNHIGHCYMVHK-GDBMZVCRSA-N 1 1 246.398 3.791 20 0 BHADMO CCC[C@@H]1[C@@H](C)CCC[N@H+]1Cc1cnccc1C ZINC000353620314 387242838 /nfs/dbraw/zinc/24/28/38/387242838.db2.gz XWFNHIGHCYMVHK-GOEBONIOSA-N 1 1 246.398 3.791 20 0 BHADMO CCC[C@H]1[C@@H](C)CCC[N@H+]1Cc1cnccc1C ZINC000353620315 387243703 /nfs/dbraw/zinc/24/37/03/387243703.db2.gz XWFNHIGHCYMVHK-HOCLYGCPSA-N 1 1 246.398 3.791 20 0 BHADMO CCC[C@H]1[C@H](C)CCC[N@H+]1Cc1cnccc1C ZINC000353620316 387243034 /nfs/dbraw/zinc/24/30/34/387243034.db2.gz XWFNHIGHCYMVHK-ZBFHGGJFSA-N 1 1 246.398 3.791 20 0 BHADMO CCC(C)(C)[C@@H]1CCC[N@H+]1Cc1cnccc1C ZINC000353625307 168304834 /nfs/dbraw/zinc/30/48/34/168304834.db2.gz OEEVAWZVOCBSOY-HNNXBMFYSA-N 1 1 246.398 3.791 20 0 BHADMO CCC(C)(C)[C@H]1CCC[N@H+]1Cc1cnccc1C ZINC000353625309 168305507 /nfs/dbraw/zinc/30/55/07/168305507.db2.gz OEEVAWZVOCBSOY-OAHLLOKOSA-N 1 1 246.398 3.791 20 0 BHADMO Cc1ccc(CCC[N@@H+]2CCCCC[C@@H]2C)cn1 ZINC000353626740 387244710 /nfs/dbraw/zinc/24/47/10/387244710.db2.gz QSJKZIYXIPUQIK-HNNXBMFYSA-N 1 1 246.398 3.587 20 0 BHADMO Cc1ccc(CCC[N@@H+]2CCCCC[C@H]2C)cn1 ZINC000353626743 387246097 /nfs/dbraw/zinc/24/60/97/387246097.db2.gz QSJKZIYXIPUQIK-OAHLLOKOSA-N 1 1 246.398 3.587 20 0 BHADMO c1coc(C[N@H+]2CCC[C@H](c3ccccc3)C2)c1 ZINC000353641522 387244604 /nfs/dbraw/zinc/24/46/04/387244604.db2.gz FMVASTMDBABOEP-HNNXBMFYSA-N 1 1 241.334 3.659 20 0 BHADMO c1coc(C[N@H+]2CCC[C@@H](c3ccccc3)C2)c1 ZINC000353641523 387244681 /nfs/dbraw/zinc/24/46/81/387244681.db2.gz FMVASTMDBABOEP-OAHLLOKOSA-N 1 1 241.334 3.659 20 0 BHADMO Cc1ccc(C[N@H+]2CCC3(C2)CCCCC3)o1 ZINC000353643673 387248333 /nfs/dbraw/zinc/24/83/33/387248333.db2.gz AXYOJAWTHIJEBV-UHFFFAOYSA-N 1 1 233.355 3.744 20 0 BHADMO CC[C@H](C)C[N@@H+](CC)CCCc1ccc(C)nc1 ZINC000353646312 171277739 /nfs/dbraw/zinc/27/77/39/171277739.db2.gz DHKQWGHODDFNGS-AWEZNQCLSA-N 1 1 248.414 3.691 20 0 BHADMO CC[C@@H](C)C[N@@H+](CC)CCCc1ccc(C)nc1 ZINC000353646313 387247339 /nfs/dbraw/zinc/24/73/39/387247339.db2.gz DHKQWGHODDFNGS-CQSZACIVSA-N 1 1 248.414 3.691 20 0 BHADMO Fc1ccc(Cl)cc1C[N@H+]1CCC12CCC2 ZINC000353646907 387248007 /nfs/dbraw/zinc/24/80/07/387248007.db2.gz JZXDOKLWCJLFIU-UHFFFAOYSA-N 1 1 239.721 3.608 20 0 BHADMO Fc1ccc(Cl)cc1C[N@@H+]1CCC12CCC2 ZINC000353646907 387248003 /nfs/dbraw/zinc/24/80/03/387248003.db2.gz JZXDOKLWCJLFIU-UHFFFAOYSA-N 1 1 239.721 3.608 20 0 BHADMO Cc1oc2ccccc2c1C[N@H+]1CCC12CCC2 ZINC000353646970 387247677 /nfs/dbraw/zinc/24/76/77/387247677.db2.gz KKDGHULTJTVKHK-UHFFFAOYSA-N 1 1 241.334 3.870 20 0 BHADMO CC(C)Oc1cccc(C[N@H+]2CCC23CCC3)c1 ZINC000353647225 167304541 /nfs/dbraw/zinc/30/45/41/167304541.db2.gz GNSGNMVHJLZQOS-UHFFFAOYSA-N 1 1 245.366 3.602 20 0 BHADMO C[C@H]1C[C@@H]1c1ccc(C[N@H+]2CCC23CCC3)o1 ZINC000353647813 177352090 /nfs/dbraw/zinc/35/20/90/177352090.db2.gz MIBKKLGDJHXEDL-AAEUAGOBSA-N 1 1 231.339 3.531 20 0 BHADMO C[C@@H]1C[C@H]1c1ccc(C[N@H+]2CCC23CCC3)o1 ZINC000353647814 387248193 /nfs/dbraw/zinc/24/81/93/387248193.db2.gz MIBKKLGDJHXEDL-DGCLKSJQSA-N 1 1 231.339 3.531 20 0 BHADMO C[C@H]1C[C@H]1c1ccc(C[N@H+]2CCC23CCC3)o1 ZINC000353647817 387249140 /nfs/dbraw/zinc/24/91/40/387249140.db2.gz MIBKKLGDJHXEDL-WCQYABFASA-N 1 1 231.339 3.531 20 0 BHADMO C[C@@H]1C[C@@H]1c1ccc(C[N@H+]2CCC23CCC3)o1 ZINC000353647820 387249092 /nfs/dbraw/zinc/24/90/92/387249092.db2.gz MIBKKLGDJHXEDL-YPMHNXCESA-N 1 1 231.339 3.531 20 0 BHADMO Cc1ccoc1C[N@H+]1CCC2(C1)CCCCC2 ZINC000353648026 179516149 /nfs/dbraw/zinc/51/61/49/179516149.db2.gz NVEBOAHVNXOANP-UHFFFAOYSA-N 1 1 233.355 3.744 20 0 BHADMO c1c2ccccc2oc1C[N@H+]1CCC12CCC2 ZINC000353651610 387251343 /nfs/dbraw/zinc/25/13/43/387251343.db2.gz HALLIUSFFDKQND-UHFFFAOYSA-N 1 1 227.307 3.561 20 0 BHADMO CCC[C@@]1(C)CCC[N@@H+](Cc2cnccc2C)C1 ZINC000353653165 387250629 /nfs/dbraw/zinc/25/06/29/387250629.db2.gz SZGHMRTZZUXBOP-INIZCTEOSA-N 1 1 246.398 3.792 20 0 BHADMO CCC[C@]1(C)CCC[N@@H+](Cc2cnccc2C)C1 ZINC000353653166 387251149 /nfs/dbraw/zinc/25/11/49/387251149.db2.gz SZGHMRTZZUXBOP-MRXNPFEDSA-N 1 1 246.398 3.792 20 0 BHADMO Fc1ccc(C[N@H+]2CCC23CCC3)cc1Cl ZINC000353653601 387251382 /nfs/dbraw/zinc/25/13/82/387251382.db2.gz LEMYISDGVKWGBN-UHFFFAOYSA-N 1 1 239.721 3.608 20 0 BHADMO Fc1ccc(C[N@@H+]2CCC23CCC3)cc1Cl ZINC000353653601 387251378 /nfs/dbraw/zinc/25/13/78/387251378.db2.gz LEMYISDGVKWGBN-UHFFFAOYSA-N 1 1 239.721 3.608 20 0 BHADMO Cc1ccncc1C[N@H+]1CCC2(C1)CCCCC2 ZINC000353654235 386811594 /nfs/dbraw/zinc/81/15/94/386811594.db2.gz JLOVWQHAMHAAKO-UHFFFAOYSA-N 1 1 244.382 3.546 20 0 BHADMO Cc1ccncc1C[N@@H+]1CCC[C@@H](CC(C)C)C1 ZINC000353655211 179482740 /nfs/dbraw/zinc/48/27/40/179482740.db2.gz XDTDTUBRKVALGR-HNNXBMFYSA-N 1 1 246.398 3.648 20 0 BHADMO Cc1ccncc1C[N@@H+]1CCC[C@H](CC(C)C)C1 ZINC000353655212 387250801 /nfs/dbraw/zinc/25/08/01/387250801.db2.gz XDTDTUBRKVALGR-OAHLLOKOSA-N 1 1 246.398 3.648 20 0 BHADMO CC[C@H](C)[C@@H](C)[N@@H+](Cc1cnccc1C)C1CC1 ZINC000353655236 171362007 /nfs/dbraw/zinc/36/20/07/171362007.db2.gz XIVOEARFAQBQGH-GXTWGEPZSA-N 1 1 246.398 3.789 20 0 BHADMO CC[C@H](C)[C@H](C)[N@@H+](Cc1cnccc1C)C1CC1 ZINC000353655237 171386386 /nfs/dbraw/zinc/38/63/86/171386386.db2.gz XIVOEARFAQBQGH-JSGCOSHPSA-N 1 1 246.398 3.789 20 0 BHADMO CC[C@@H](C)[C@H](C)[N@@H+](Cc1cnccc1C)C1CC1 ZINC000353655238 387250598 /nfs/dbraw/zinc/25/05/98/387250598.db2.gz XIVOEARFAQBQGH-OCCSQVGLSA-N 1 1 246.398 3.789 20 0 BHADMO CC[C@@H](C)[C@@H](C)[N@@H+](Cc1cnccc1C)C1CC1 ZINC000353655239 387249963 /nfs/dbraw/zinc/24/99/63/387249963.db2.gz XIVOEARFAQBQGH-TZMCWYRMSA-N 1 1 246.398 3.789 20 0 BHADMO c1cc(C2CC2)cc(N[C@H]2CC[C@H]2C2CC2)[nH+]1 ZINC000353655565 538754382 /nfs/dbraw/zinc/75/43/82/538754382.db2.gz HAYRKQKFGBLWGW-KBPBESRZSA-N 1 1 228.339 3.560 20 0 BHADMO c1cc(C2CC2)cc(N[C@H]2CC[C@@H]2C2CC2)[nH+]1 ZINC000353655566 538755564 /nfs/dbraw/zinc/75/55/64/538755564.db2.gz HAYRKQKFGBLWGW-KGLIPLIRSA-N 1 1 228.339 3.560 20 0 BHADMO c1cc(C2CC2)cc(N[C@@H]2CC[C@H]2C2CC2)[nH+]1 ZINC000353655568 538754601 /nfs/dbraw/zinc/75/46/01/538754601.db2.gz HAYRKQKFGBLWGW-UONOGXRCSA-N 1 1 228.339 3.560 20 0 BHADMO c1cc(C2CC2)cc(N[C@@H]2CC[C@@H]2C2CC2)[nH+]1 ZINC000353655569 538755349 /nfs/dbraw/zinc/75/53/49/538755349.db2.gz HAYRKQKFGBLWGW-ZIAGYGMSSA-N 1 1 228.339 3.560 20 0 BHADMO CC[C@H]1CCCCC[N@H+]1Cc1cnccc1C ZINC000353656718 387251467 /nfs/dbraw/zinc/25/14/67/387251467.db2.gz MBRNSAVKCBWZDI-HNNXBMFYSA-N 1 1 232.371 3.545 20 0 BHADMO CC[C@@H]1CCCCC[N@H+]1Cc1cnccc1C ZINC000353656720 356716043 /nfs/dbraw/zinc/71/60/43/356716043.db2.gz MBRNSAVKCBWZDI-OAHLLOKOSA-N 1 1 232.371 3.545 20 0 BHADMO Cc1ccncc1C[N@@H+]1CCCC[C@H]1CC(C)C ZINC000353658030 386856742 /nfs/dbraw/zinc/85/67/42/386856742.db2.gz PAABOKMNGKCJNM-INIZCTEOSA-N 1 1 246.398 3.791 20 0 BHADMO Cc1ccncc1C[N@@H+]1CCCC[C@@H]1CC(C)C ZINC000353658031 386857325 /nfs/dbraw/zinc/85/73/25/386857325.db2.gz PAABOKMNGKCJNM-MRXNPFEDSA-N 1 1 246.398 3.791 20 0 BHADMO Cc1ccncc1C[N@@H+]1CCC[C@H]1CCC(C)C ZINC000353658742 387251701 /nfs/dbraw/zinc/25/17/01/387251701.db2.gz QOXADVLQVMEODV-INIZCTEOSA-N 1 1 246.398 3.791 20 0 BHADMO Cc1ccncc1C[N@@H+]1CCC[C@@H]1CCC(C)C ZINC000353658743 387251535 /nfs/dbraw/zinc/25/15/35/387251535.db2.gz QOXADVLQVMEODV-MRXNPFEDSA-N 1 1 246.398 3.791 20 0 BHADMO CSc1ccc(C[N@H+]2CCC23CCC3)cc1 ZINC000353659645 387251561 /nfs/dbraw/zinc/25/15/61/387251561.db2.gz ZPZWTAOSNDFKRB-UHFFFAOYSA-N 1 1 233.380 3.537 20 0 BHADMO CCC[C@@H](C)[C@H]1CCC[N@H+]1Cc1cnccc1C ZINC000353661287 169374645 /nfs/dbraw/zinc/37/46/45/169374645.db2.gz WCYNPHUENCAFCY-GDBMZVCRSA-N 1 1 246.398 3.791 20 0 BHADMO CCC[C@H](C)[C@H]1CCC[N@H+]1Cc1cnccc1C ZINC000353661288 386911606 /nfs/dbraw/zinc/91/16/06/386911606.db2.gz WCYNPHUENCAFCY-GOEBONIOSA-N 1 1 246.398 3.791 20 0 BHADMO CCC[C@H](C)[C@@H]1CCC[N@H+]1Cc1cnccc1C ZINC000353661289 386912791 /nfs/dbraw/zinc/91/27/91/386912791.db2.gz WCYNPHUENCAFCY-HOCLYGCPSA-N 1 1 246.398 3.791 20 0 BHADMO CCC[C@@H](C)[C@@H]1CCC[N@H+]1Cc1cnccc1C ZINC000353661290 169373649 /nfs/dbraw/zinc/37/36/49/169373649.db2.gz WCYNPHUENCAFCY-ZBFHGGJFSA-N 1 1 246.398 3.791 20 0 BHADMO Cc1ccc(C[N@@H+]2Cc3ccccc3C[C@H]2C)o1 ZINC000353662537 386919533 /nfs/dbraw/zinc/91/95/33/386919533.db2.gz ACQSRPBSSUAOJM-GFCCVEGCSA-N 1 1 241.334 3.535 20 0 BHADMO Cc1ccc(C[N@@H+]2Cc3ccccc3C[C@@H]2C)o1 ZINC000353662543 386918457 /nfs/dbraw/zinc/91/84/57/386918457.db2.gz ACQSRPBSSUAOJM-LBPRGKRZSA-N 1 1 241.334 3.535 20 0 BHADMO CC1(C)CCC[N@@H+](Cc2ccsc2)CC1 ZINC000353663123 387253883 /nfs/dbraw/zinc/25/38/83/387253883.db2.gz BOJGJGXPKNCNGO-UHFFFAOYSA-N 1 1 223.385 3.760 20 0 BHADMO Cc1ccoc1C[N@H+]1CCCC(C)(C)CC1 ZINC000353663636 387253778 /nfs/dbraw/zinc/25/37/78/387253778.db2.gz DOIGMTPWTITBDR-UHFFFAOYSA-N 1 1 221.344 3.600 20 0 BHADMO Fc1ccc2oc(C[N@H+]3CCC34CCC4)cc2c1 ZINC000353663639 387252812 /nfs/dbraw/zinc/25/28/12/387252812.db2.gz DSNTYXRUYYJRMI-UHFFFAOYSA-N 1 1 245.297 3.700 20 0 BHADMO C[C@@H]1Cc2ccccc2C[N@H+]1Cc1cccs1 ZINC000353664208 387252676 /nfs/dbraw/zinc/25/26/76/387252676.db2.gz GGZRFYLOIAOZFC-GFCCVEGCSA-N 1 1 243.375 3.695 20 0 BHADMO C[C@H]1Cc2ccccc2C[N@H+]1Cc1cccs1 ZINC000353664210 177390015 /nfs/dbraw/zinc/39/00/15/177390015.db2.gz GGZRFYLOIAOZFC-LBPRGKRZSA-N 1 1 243.375 3.695 20 0 BHADMO Fc1cc(C[N@H+]2CCC23CCC3)ccc1Cl ZINC000353665274 387253042 /nfs/dbraw/zinc/25/30/42/387253042.db2.gz KGFKWSFBOZVPCV-UHFFFAOYSA-N 1 1 239.721 3.608 20 0 BHADMO Fc1cc(C[N@@H+]2CCC23CCC3)ccc1Cl ZINC000353665274 387253038 /nfs/dbraw/zinc/25/30/38/387253038.db2.gz KGFKWSFBOZVPCV-UHFFFAOYSA-N 1 1 239.721 3.608 20 0 BHADMO CC1(C)CCC[N@@H+](Cc2cccs2)CC1 ZINC000353665542 387252227 /nfs/dbraw/zinc/25/22/27/387252227.db2.gz KXGGPKWFHCGNAV-UHFFFAOYSA-N 1 1 223.385 3.760 20 0 BHADMO Cc1ccc(C[N@H+]2CCCC(C)(C)CC2)o1 ZINC000353667021 178566389 /nfs/dbraw/zinc/56/63/89/178566389.db2.gz RDCTXURHWFHMCX-UHFFFAOYSA-N 1 1 221.344 3.600 20 0 BHADMO Fc1c(Cl)cccc1C[N@H+]1CCC12CCC2 ZINC000353667093 387253451 /nfs/dbraw/zinc/25/34/51/387253451.db2.gz SEYJJNHVPCMZRL-UHFFFAOYSA-N 1 1 239.721 3.608 20 0 BHADMO Fc1c(Cl)cccc1C[N@@H+]1CCC12CCC2 ZINC000353667093 387253448 /nfs/dbraw/zinc/25/34/48/387253448.db2.gz SEYJJNHVPCMZRL-UHFFFAOYSA-N 1 1 239.721 3.608 20 0 BHADMO c1cc(C[N@H+]2CCC3(C2)CCCCC3)cs1 ZINC000353667745 183339700 /nfs/dbraw/zinc/33/97/00/183339700.db2.gz VSIYALVQGIOJHU-UHFFFAOYSA-N 1 1 235.396 3.904 20 0 BHADMO C[C@@H]1Cc2ccccc2C[N@H+]1Cc1ccsc1 ZINC000353669840 387256715 /nfs/dbraw/zinc/25/67/15/387256715.db2.gz JJFAOVYGBVRNFP-GFCCVEGCSA-N 1 1 243.375 3.695 20 0 BHADMO C[C@H]1Cc2ccccc2C[N@H+]1Cc1ccsc1 ZINC000353669841 177389872 /nfs/dbraw/zinc/38/98/72/177389872.db2.gz JJFAOVYGBVRNFP-LBPRGKRZSA-N 1 1 243.375 3.695 20 0 BHADMO Cc1ccc(C[N@H+]2CCC3(CCC3)C2)cc1C ZINC000353670520 387256222 /nfs/dbraw/zinc/25/62/22/387256222.db2.gz LPSDMSSXSTZMPI-UHFFFAOYSA-N 1 1 229.367 3.679 20 0 BHADMO Clc1ccc(C[N@H+]2CCC3(CCC3)C2)cc1 ZINC000353671015 387256238 /nfs/dbraw/zinc/25/62/38/387256238.db2.gz JDRROHPZXCLPAB-UHFFFAOYSA-N 1 1 235.758 3.716 20 0 BHADMO Clc1ccccc1C[N@H+]1CCC2(CCC2)C1 ZINC000353671468 387253832 /nfs/dbraw/zinc/25/38/32/387253832.db2.gz KOQUSBHOWGVOFV-UHFFFAOYSA-N 1 1 235.758 3.716 20 0 BHADMO CC(C)CCn1cccc1C[N@H+]1CCC12CCC2 ZINC000353671503 387255291 /nfs/dbraw/zinc/25/52/91/387255291.db2.gz NTLOUAANUYHBBV-UHFFFAOYSA-N 1 1 246.398 3.663 20 0 BHADMO Cc1ccc(C[N@H+]2CCC3(CCC3)C2)cc1F ZINC000353672283 387254872 /nfs/dbraw/zinc/25/48/72/387254872.db2.gz NKQSGJXVXRHQCU-UHFFFAOYSA-N 1 1 233.330 3.510 20 0 BHADMO Cc1ccoc1C[N@@H+]1Cc2ccccc2C[C@H]1C ZINC000353673727 387255680 /nfs/dbraw/zinc/25/56/80/387255680.db2.gz SJZNOBWJVRVBES-CYBMUJFWSA-N 1 1 241.334 3.535 20 0 BHADMO Cc1ccoc1C[N@@H+]1Cc2ccccc2C[C@@H]1C ZINC000353673728 387256453 /nfs/dbraw/zinc/25/64/53/387256453.db2.gz SJZNOBWJVRVBES-ZDUSSCGKSA-N 1 1 241.334 3.535 20 0 BHADMO CC[C@@H]([NH2+][C@@H](C)c1ccon1)c1cccc(C)c1 ZINC000353674915 387255700 /nfs/dbraw/zinc/25/57/00/387255700.db2.gz VBRUCXSGZARXBA-GXTWGEPZSA-N 1 1 244.338 3.785 20 0 BHADMO CC[C@H]([NH2+][C@@H](C)c1ccon1)c1cccc(C)c1 ZINC000353674917 387255347 /nfs/dbraw/zinc/25/53/47/387255347.db2.gz VBRUCXSGZARXBA-JSGCOSHPSA-N 1 1 244.338 3.785 20 0 BHADMO CC[C@H]([NH2+][C@H](C)c1ccon1)c1cccc(C)c1 ZINC000353674918 387255635 /nfs/dbraw/zinc/25/56/35/387255635.db2.gz VBRUCXSGZARXBA-OCCSQVGLSA-N 1 1 244.338 3.785 20 0 BHADMO CC[C@@H]([NH2+][C@H](C)c1ccon1)c1cccc(C)c1 ZINC000353674920 352736278 /nfs/dbraw/zinc/73/62/78/352736278.db2.gz VBRUCXSGZARXBA-TZMCWYRMSA-N 1 1 244.338 3.785 20 0 BHADMO Cc1cc(C[N@H+]2CCC3(CCC3)C2)c(C)s1 ZINC000353676282 385920788 /nfs/dbraw/zinc/92/07/88/385920788.db2.gz WVDUDHWROZYDES-UHFFFAOYSA-N 1 1 235.396 3.741 20 0 BHADMO Cc1ccc(C)c(C[N@H+]2CCC3(CCC3)C2)c1 ZINC000353676788 387255263 /nfs/dbraw/zinc/25/52/63/387255263.db2.gz WPLOXPPSQQQBIE-UHFFFAOYSA-N 1 1 229.367 3.679 20 0 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223.385 3.677 20 0 BHADMO Cc1ccc(C[N@H+]2C[C@@H](C)CC[C@@H]2C)s1 ZINC000353857891 387287928 /nfs/dbraw/zinc/28/79/28/387287928.db2.gz SXNBCQNZEIOBAD-QWRGUYRKSA-N 1 1 223.385 3.677 20 0 BHADMO Cc1ccc(C[N@H+]2C[C@@H](C)CC[C@H]2C)s1 ZINC000353857892 387284086 /nfs/dbraw/zinc/28/40/86/387284086.db2.gz SXNBCQNZEIOBAD-WDEREUQCSA-N 1 1 223.385 3.677 20 0 BHADMO C[C@@H]1CC[C@@H](C)[N@@H+](Cc2cc(F)ccc2F)C1 ZINC000353862640 176197960 /nfs/dbraw/zinc/19/79/60/176197960.db2.gz DSQOCXAEUISUAQ-GHMZBOCLSA-N 1 1 239.309 3.585 20 0 BHADMO C[C@@H]1CC[C@H](C)[N@@H+](Cc2cc(F)ccc2F)C1 ZINC000353862641 177183090 /nfs/dbraw/zinc/18/30/90/177183090.db2.gz DSQOCXAEUISUAQ-MNOVXSKESA-N 1 1 239.309 3.585 20 0 BHADMO C[C@H]1CC[C@H](C)[N@@H+](Cc2cc(F)ccc2F)C1 ZINC000353862642 177198475 /nfs/dbraw/zinc/19/84/75/177198475.db2.gz DSQOCXAEUISUAQ-QWRGUYRKSA-N 1 1 239.309 3.585 20 0 BHADMO C[C@@H]1CC[C@H](C)C[N@@H+]1Cc1cc(F)ccc1F ZINC000353862643 177184806 /nfs/dbraw/zinc/18/48/06/177184806.db2.gz DSQOCXAEUISUAQ-WDEREUQCSA-N 1 1 239.309 3.585 20 0 BHADMO CCC[C@@]1(C)CCC[N@@H+](Cc2ccco2)C1 ZINC000353862922 387286939 /nfs/dbraw/zinc/28/69/39/387286939.db2.gz FIKPFIJRWGQKAM-AWEZNQCLSA-N 1 1 221.344 3.682 20 0 BHADMO CCC[C@]1(C)CCC[N@@H+](Cc2ccco2)C1 ZINC000353862923 387286951 /nfs/dbraw/zinc/28/69/51/387286951.db2.gz FIKPFIJRWGQKAM-CQSZACIVSA-N 1 1 221.344 3.682 20 0 BHADMO Cc1ccc(C[N@H+](C)C2CCC(C)(C)CC2)nc1 ZINC000353865016 387288414 /nfs/dbraw/zinc/28/84/14/387288414.db2.gz HYOICKJOSJSHTQ-UHFFFAOYSA-N 1 1 246.398 3.791 20 0 BHADMO CC[N@@H+](Cc1cc2ccccc2o1)C1CCC1 ZINC000353867329 356723252 /nfs/dbraw/zinc/72/32/52/356723252.db2.gz KGTWPRFNCRXHCM-UHFFFAOYSA-N 1 1 229.323 3.807 20 0 BHADMO C[C@@H]1CCC[C@H](C)[N@@H+](Cc2ccsc2)C1 ZINC000353871432 177115207 /nfs/dbraw/zinc/11/52/07/177115207.db2.gz LUHBCFSFZJCFCC-NEPJUHHUSA-N 1 1 223.385 3.759 20 0 BHADMO C[C@@H]1CCC[C@H](C)C[N@@H+]1Cc1ccsc1 ZINC000353871433 177114852 /nfs/dbraw/zinc/11/48/52/177114852.db2.gz LUHBCFSFZJCFCC-NWDGAFQWSA-N 1 1 223.385 3.759 20 0 BHADMO C[C@H]1CCC[C@H](C)[N@@H+](Cc2ccsc2)C1 ZINC000353871434 177130603 /nfs/dbraw/zinc/13/06/03/177130603.db2.gz LUHBCFSFZJCFCC-RYUDHWBXSA-N 1 1 223.385 3.759 20 0 BHADMO C[C@@H]1CCC[C@@H](C)[N@@H+](Cc2ccsc2)C1 ZINC000353871435 176114614 /nfs/dbraw/zinc/11/46/14/176114614.db2.gz LUHBCFSFZJCFCC-VXGBXAGGSA-N 1 1 223.385 3.759 20 0 BHADMO CC1=CC[N@@H+](Cc2coc3ccccc23)CC1 ZINC000353872366 168116223 /nfs/dbraw/zinc/11/62/23/168116223.db2.gz VALYYXMDWKPKHU-UHFFFAOYSA-N 1 1 227.307 3.585 20 0 BHADMO Cc1oc2ccccc2c1C[N@@H+]1CC=C(C)CC1 ZINC000353877064 354800277 /nfs/dbraw/zinc/80/02/77/354800277.db2.gz BOJDCKBGCSCHAS-UHFFFAOYSA-N 1 1 241.334 3.893 20 0 BHADMO CC1=CC[N@@H+](Cc2ccc([C@@H]3C[C@@H]3C)o2)CC1 ZINC000353877894 168115540 /nfs/dbraw/zinc/11/55/40/168115540.db2.gz CTTUVDXTTDYNBP-GXTWGEPZSA-N 1 1 231.339 3.555 20 0 BHADMO CC1=CC[N@@H+](Cc2ccc([C@H]3C[C@@H]3C)o2)CC1 ZINC000353877898 168115475 /nfs/dbraw/zinc/11/54/75/168115475.db2.gz CTTUVDXTTDYNBP-JSGCOSHPSA-N 1 1 231.339 3.555 20 0 BHADMO CC1=CC[N@@H+](Cc2ccc([C@H]3C[C@H]3C)o2)CC1 ZINC000353877900 168116250 /nfs/dbraw/zinc/11/62/50/168116250.db2.gz CTTUVDXTTDYNBP-OCCSQVGLSA-N 1 1 231.339 3.555 20 0 BHADMO CC1=CC[N@@H+](Cc2ccc([C@@H]3C[C@H]3C)o2)CC1 ZINC000353877904 168116083 /nfs/dbraw/zinc/11/60/83/168116083.db2.gz CTTUVDXTTDYNBP-TZMCWYRMSA-N 1 1 231.339 3.555 20 0 BHADMO C[C@@H]1CC[C@@H](C)[N@@H+](Cc2c(F)cccc2F)C1 ZINC000353878466 354815977 /nfs/dbraw/zinc/81/59/77/354815977.db2.gz DAIUBGQZXSSAAH-GHMZBOCLSA-N 1 1 239.309 3.585 20 0 BHADMO C[C@@H]1CC[C@H](C)[N@@H+](Cc2c(F)cccc2F)C1 ZINC000353878467 354815892 /nfs/dbraw/zinc/81/58/92/354815892.db2.gz DAIUBGQZXSSAAH-MNOVXSKESA-N 1 1 239.309 3.585 20 0 BHADMO C[C@H]1CC[C@H](C)[N@@H+](Cc2c(F)cccc2F)C1 ZINC000353878468 354815902 /nfs/dbraw/zinc/81/59/02/354815902.db2.gz DAIUBGQZXSSAAH-QWRGUYRKSA-N 1 1 239.309 3.585 20 0 BHADMO C[C@@H]1CC[C@H](C)C[N@@H+]1Cc1c(F)cccc1F ZINC000353878469 354815934 /nfs/dbraw/zinc/81/59/34/354815934.db2.gz DAIUBGQZXSSAAH-WDEREUQCSA-N 1 1 239.309 3.585 20 0 BHADMO CC[N@@H+](Cc1coc2ccccc12)C1CCC1 ZINC000353881054 356723434 /nfs/dbraw/zinc/72/34/34/356723434.db2.gz PMNGKZOVYDYFOA-UHFFFAOYSA-N 1 1 229.323 3.807 20 0 BHADMO C[C@@H]1c2ccccc2C[N@@H+]1Cc1ccsc1 ZINC000353881683 386174144 /nfs/dbraw/zinc/17/41/44/386174144.db2.gz MCTXQBNLXIDLIR-LLVKDONJSA-N 1 1 229.348 3.825 20 0 BHADMO C[C@@H]1c2ccccc2C[N@H+]1Cc1ccsc1 ZINC000353881683 386174140 /nfs/dbraw/zinc/17/41/40/386174140.db2.gz MCTXQBNLXIDLIR-LLVKDONJSA-N 1 1 229.348 3.825 20 0 BHADMO C[C@H]1c2ccccc2C[N@@H+]1Cc1ccsc1 ZINC000353881684 386174018 /nfs/dbraw/zinc/17/40/18/386174018.db2.gz MCTXQBNLXIDLIR-NSHDSACASA-N 1 1 229.348 3.825 20 0 BHADMO C[C@H]1c2ccccc2C[N@H+]1Cc1ccsc1 ZINC000353881684 386174014 /nfs/dbraw/zinc/17/40/14/386174014.db2.gz MCTXQBNLXIDLIR-NSHDSACASA-N 1 1 229.348 3.825 20 0 BHADMO Cc1ccc(C[N@H+]2C[C@H](C)CCC[C@@H]2C)o1 ZINC000353883863 387290104 /nfs/dbraw/zinc/29/01/04/387290104.db2.gz VRKZFVJXWATPPR-NEPJUHHUSA-N 1 1 221.344 3.599 20 0 BHADMO Cc1ccc(C[N@H+]2C[C@@H](C)CCC[C@H]2C)o1 ZINC000353883864 387290098 /nfs/dbraw/zinc/29/00/98/387290098.db2.gz VRKZFVJXWATPPR-NWDGAFQWSA-N 1 1 221.344 3.599 20 0 BHADMO Cc1ccc(C[N@H+]2C[C@@H](C)CCC[C@@H]2C)o1 ZINC000353883865 387290384 /nfs/dbraw/zinc/29/03/84/387290384.db2.gz VRKZFVJXWATPPR-RYUDHWBXSA-N 1 1 221.344 3.599 20 0 BHADMO Cc1ccc(C[N@H+]2C[C@H](C)CCC[C@H]2C)o1 ZINC000353883866 387289788 /nfs/dbraw/zinc/28/97/88/387289788.db2.gz VRKZFVJXWATPPR-VXGBXAGGSA-N 1 1 221.344 3.599 20 0 BHADMO C[C@@H]1CC[C@@H](C)[N@@H+](Cc2cccc3[nH]ccc32)C1 ZINC000353885158 176198202 /nfs/dbraw/zinc/19/82/02/176198202.db2.gz ZEVKIAJJYGUFTH-CHWSQXEVSA-N 1 1 242.366 3.788 20 0 BHADMO C[C@@H]1CC[C@H](C)[N@@H+](Cc2cccc3[nH]ccc32)C1 ZINC000353885159 177184146 /nfs/dbraw/zinc/18/41/46/177184146.db2.gz ZEVKIAJJYGUFTH-OLZOCXBDSA-N 1 1 242.366 3.788 20 0 BHADMO C[C@@H]1CC[C@H](C)C[N@@H+]1Cc1cccc2[nH]ccc21 ZINC000353885160 177185101 /nfs/dbraw/zinc/18/51/01/177185101.db2.gz ZEVKIAJJYGUFTH-QWHCGFSZSA-N 1 1 242.366 3.788 20 0 BHADMO C[C@H]1CC[C@H](C)[N@@H+](Cc2cccc3[nH]ccc32)C1 ZINC000353885161 177198231 /nfs/dbraw/zinc/19/82/31/177198231.db2.gz ZEVKIAJJYGUFTH-STQMWFEESA-N 1 1 242.366 3.788 20 0 BHADMO C[C@H]1C[N@@H+](Cc2ccc(Cl)o2)C(C)(C)C1 ZINC000353885901 177262240 /nfs/dbraw/zinc/26/22/40/177262240.db2.gz UMSHEJFQUPLFPD-SECBINFHSA-N 1 1 227.735 3.553 20 0 BHADMO C[C@@H]1C[N@@H+](Cc2ccc(Cl)o2)C(C)(C)C1 ZINC000353885902 176303122 /nfs/dbraw/zinc/30/31/22/176303122.db2.gz UMSHEJFQUPLFPD-VIFPVBQESA-N 1 1 227.735 3.553 20 0 BHADMO Cc1ccc(C[N@@H+]2CCCC[C@H]2C(C)C)o1 ZINC000353893691 355090462 /nfs/dbraw/zinc/09/04/62/355090462.db2.gz BAWMJOANXPCBBH-AWEZNQCLSA-N 1 1 221.344 3.599 20 0 BHADMO Cc1ccc(C[N@@H+]2CCCC[C@@H]2C(C)C)o1 ZINC000353893692 355090318 /nfs/dbraw/zinc/09/03/18/355090318.db2.gz BAWMJOANXPCBBH-CQSZACIVSA-N 1 1 221.344 3.599 20 0 BHADMO Cc1ccc(C[N@H+]2CCC[C@@H]3CCCC[C@H]32)o1 ZINC000353896418 355148905 /nfs/dbraw/zinc/14/89/05/355148905.db2.gz HGAQSDKQNGOLJQ-DZGCQCFKSA-N 1 1 233.355 3.743 20 0 BHADMO Cc1ccc(C[N@H+]2CCC[C@H]3CCCC[C@@H]32)o1 ZINC000353896434 355149803 /nfs/dbraw/zinc/14/98/03/355149803.db2.gz HGAQSDKQNGOLJQ-HIFRSBDPSA-N 1 1 233.355 3.743 20 0 BHADMO Cc1ccc(C[N@H+]2CCC[C@H]3CCCC[C@H]32)o1 ZINC000353896464 355155267 /nfs/dbraw/zinc/15/52/67/355155267.db2.gz HGAQSDKQNGOLJQ-UKRRQHHQSA-N 1 1 233.355 3.743 20 0 BHADMO Cc1ccc(C[N@H+]2CCC[C@@H]3CCCC[C@@H]32)o1 ZINC000353896486 355156446 /nfs/dbraw/zinc/15/64/46/355156446.db2.gz HGAQSDKQNGOLJQ-ZFWWWQNUSA-N 1 1 233.355 3.743 20 0 BHADMO CC(C)[C@H]1CCCC[N@H+]1Cc1ccsc1 ZINC000353898013 387287207 /nfs/dbraw/zinc/28/72/07/387287207.db2.gz JIIQDEHYGCMFMX-CYBMUJFWSA-N 1 1 223.385 3.759 20 0 BHADMO CC(C)[C@@H]1CCCC[N@H+]1Cc1ccsc1 ZINC000353898014 387288107 /nfs/dbraw/zinc/28/81/07/387288107.db2.gz JIIQDEHYGCMFMX-ZDUSSCGKSA-N 1 1 223.385 3.759 20 0 BHADMO Cc1ccoc1C[N@H+]1CCC[C@@]2(CC=CCC2)C1 ZINC000353899580 179516315 /nfs/dbraw/zinc/51/63/15/179516315.db2.gz LXAIRVPDIJYSBR-INIZCTEOSA-N 1 1 245.366 3.910 20 0 BHADMO Cc1ccoc1C[N@H+]1CCC[C@]2(CC=CCC2)C1 ZINC000353899581 387294981 /nfs/dbraw/zinc/29/49/81/387294981.db2.gz LXAIRVPDIJYSBR-MRXNPFEDSA-N 1 1 245.366 3.910 20 0 BHADMO Cc1ccoc1C[N@@H+]1CCCC[C@@H]1C(C)C ZINC000353900254 387294812 /nfs/dbraw/zinc/29/48/12/387294812.db2.gz NZWMLDBLVYPLCI-CYBMUJFWSA-N 1 1 221.344 3.599 20 0 BHADMO Cc1ccoc1C[N@@H+]1CCCC[C@H]1C(C)C ZINC000353900255 387294111 /nfs/dbraw/zinc/29/41/11/387294111.db2.gz NZWMLDBLVYPLCI-ZDUSSCGKSA-N 1 1 221.344 3.599 20 0 BHADMO CC(C)(C)[C@H]1CCC[N@@H+](Cc2ccncc2)CC1 ZINC000353900860 386257531 /nfs/dbraw/zinc/25/75/31/386257531.db2.gz PSJQMGNJMQVUSV-HNNXBMFYSA-N 1 1 246.398 3.730 20 0 BHADMO CC(C)(C)[C@@H]1CCC[N@@H+](Cc2ccncc2)CC1 ZINC000353900861 386257155 /nfs/dbraw/zinc/25/71/55/386257155.db2.gz PSJQMGNJMQVUSV-OAHLLOKOSA-N 1 1 246.398 3.730 20 0 BHADMO Cc1ccc(C[N@H+]2CCC[C@@]3(CC=CCC3)C2)o1 ZINC000353901010 387293994 /nfs/dbraw/zinc/29/39/94/387293994.db2.gz PBXONUYMDYMMNY-INIZCTEOSA-N 1 1 245.366 3.910 20 0 BHADMO Cc1ccc(C[N@H+]2CCC[C@]3(CC=CCC3)C2)o1 ZINC000353901012 387294036 /nfs/dbraw/zinc/29/40/36/387294036.db2.gz PBXONUYMDYMMNY-MRXNPFEDSA-N 1 1 245.366 3.910 20 0 BHADMO Cc1ccc(C[N@@H+]2CC[C@@H](C)[C@H](C)C2)s1 ZINC000353901739 387294056 /nfs/dbraw/zinc/29/40/56/387294056.db2.gz SDQOPBHWAKGTAR-GHMZBOCLSA-N 1 1 223.385 3.534 20 0 BHADMO Cc1ccc(C[N@@H+]2CC[C@@H](C)[C@@H](C)C2)s1 ZINC000353901744 387294223 /nfs/dbraw/zinc/29/42/23/387294223.db2.gz SDQOPBHWAKGTAR-MNOVXSKESA-N 1 1 223.385 3.534 20 0 BHADMO Cc1ccc(C[N@@H+]2CC[C@H](C)[C@@H](C)C2)s1 ZINC000353901745 387293906 /nfs/dbraw/zinc/29/39/06/387293906.db2.gz SDQOPBHWAKGTAR-QWRGUYRKSA-N 1 1 223.385 3.534 20 0 BHADMO Cc1ccc(C[N@@H+]2CC[C@H](C)[C@H](C)C2)s1 ZINC000353901746 387295326 /nfs/dbraw/zinc/29/53/26/387295326.db2.gz SDQOPBHWAKGTAR-WDEREUQCSA-N 1 1 223.385 3.534 20 0 BHADMO Cc1ccoc1C[N@H+]1C[C@@H](C)CCC[C@@H]1C ZINC000353904003 387293545 /nfs/dbraw/zinc/29/35/45/387293545.db2.gz XETXCQXFHVCSMA-AAEUAGOBSA-N 1 1 221.344 3.599 20 0 BHADMO Cc1ccoc1C[N@H+]1C[C@H](C)CCC[C@H]1C ZINC000353904004 387294392 /nfs/dbraw/zinc/29/43/92/387294392.db2.gz XETXCQXFHVCSMA-DGCLKSJQSA-N 1 1 221.344 3.599 20 0 BHADMO Cc1ccoc1C[N@H+]1C[C@@H](C)CCC[C@H]1C ZINC000353904005 387295273 /nfs/dbraw/zinc/29/52/73/387295273.db2.gz XETXCQXFHVCSMA-WCQYABFASA-N 1 1 221.344 3.599 20 0 BHADMO Cc1ccoc1C[N@H+]1C[C@H](C)CCC[C@@H]1C ZINC000353904009 387294967 /nfs/dbraw/zinc/29/49/67/387294967.db2.gz XETXCQXFHVCSMA-YPMHNXCESA-N 1 1 221.344 3.599 20 0 BHADMO CCC[C@@]1(C)CCC[N@@H+](Cc2ccc(C)cn2)C1 ZINC000353907159 387294544 /nfs/dbraw/zinc/29/45/44/387294544.db2.gz CCINTDLOXJEOCF-INIZCTEOSA-N 1 1 246.398 3.792 20 0 BHADMO CCC[C@]1(C)CCC[N@@H+](Cc2ccc(C)cn2)C1 ZINC000353907161 387293937 /nfs/dbraw/zinc/29/39/37/387293937.db2.gz CCINTDLOXJEOCF-MRXNPFEDSA-N 1 1 246.398 3.792 20 0 BHADMO CCC[C@]1(C)CCC[N@@H+](Cc2nccs2)C1 ZINC000353908709 387294214 /nfs/dbraw/zinc/29/42/14/387294214.db2.gz CYYAYVSLKUBEBN-CYBMUJFWSA-N 1 1 238.400 3.545 20 0 BHADMO CCC[C@@]1(C)CCC[N@@H+](Cc2nccs2)C1 ZINC000353908710 387294665 /nfs/dbraw/zinc/29/46/65/387294665.db2.gz CYYAYVSLKUBEBN-ZDUSSCGKSA-N 1 1 238.400 3.545 20 0 BHADMO CCC[C@@]1(C)CCC[N@@H+](Cc2cccnc2C)C1 ZINC000353910159 387297516 /nfs/dbraw/zinc/29/75/16/387297516.db2.gz FOKHEIVZANCKFN-INIZCTEOSA-N 1 1 246.398 3.792 20 0 BHADMO CCC[C@]1(C)CCC[N@@H+](Cc2cccnc2C)C1 ZINC000353910163 387297058 /nfs/dbraw/zinc/29/70/58/387297058.db2.gz FOKHEIVZANCKFN-MRXNPFEDSA-N 1 1 246.398 3.792 20 0 BHADMO Cc1cc(C[N@H+]2C[C@@H]3CCC[C@@H]3C2)c(C)s1 ZINC000353920989 178007858 /nfs/dbraw/zinc/00/78/58/178007858.db2.gz BRPLSMPQTKRSQW-BETUJISGSA-N 1 1 235.396 3.597 20 0 BHADMO C[C@@H]1CC[C@@H](C)[N@@H+](Cc2ccc(F)cc2F)C1 ZINC000353924240 176197659 /nfs/dbraw/zinc/19/76/59/176197659.db2.gz PVHVQAPKZSSCRJ-GHMZBOCLSA-N 1 1 239.309 3.585 20 0 BHADMO C[C@@H]1CC[C@H](C)[N@@H+](Cc2ccc(F)cc2F)C1 ZINC000353924246 177183212 /nfs/dbraw/zinc/18/32/12/177183212.db2.gz PVHVQAPKZSSCRJ-MNOVXSKESA-N 1 1 239.309 3.585 20 0 BHADMO C[C@H]1CC[C@H](C)[N@@H+](Cc2ccc(F)cc2F)C1 ZINC000353924253 177198127 /nfs/dbraw/zinc/19/81/27/177198127.db2.gz PVHVQAPKZSSCRJ-QWRGUYRKSA-N 1 1 239.309 3.585 20 0 BHADMO C[C@@H]1CC[C@H](C)C[N@@H+]1Cc1ccc(F)cc1F ZINC000353924262 177184614 /nfs/dbraw/zinc/18/46/14/177184614.db2.gz PVHVQAPKZSSCRJ-WDEREUQCSA-N 1 1 239.309 3.585 20 0 BHADMO CCS[C@H]1CC[C@@H]([N@@H+](C)Cc2ccccc2)C1 ZINC000353930431 387300077 /nfs/dbraw/zinc/30/00/77/387300077.db2.gz FRRVFLZSEYSIOQ-CABCVRRESA-N 1 1 249.423 3.793 20 0 BHADMO CCS[C@H]1CC[C@H]([N@@H+](C)Cc2ccccc2)C1 ZINC000353930432 387300207 /nfs/dbraw/zinc/30/02/07/387300207.db2.gz FRRVFLZSEYSIOQ-GJZGRUSLSA-N 1 1 249.423 3.793 20 0 BHADMO CCS[C@@H]1CC[C@@H]([N@@H+](C)Cc2ccccc2)C1 ZINC000353930433 387300335 /nfs/dbraw/zinc/30/03/35/387300335.db2.gz FRRVFLZSEYSIOQ-HUUCEWRRSA-N 1 1 249.423 3.793 20 0 BHADMO CCS[C@@H]1CC[C@H]([N@@H+](C)Cc2ccccc2)C1 ZINC000353930434 387299935 /nfs/dbraw/zinc/29/99/35/387299935.db2.gz FRRVFLZSEYSIOQ-LSDHHAIUSA-N 1 1 249.423 3.793 20 0 BHADMO C[C@@H]1CC[C@@H](C)[N@@H+](Cc2cccc3cc[nH]c32)C1 ZINC000353930826 176198037 /nfs/dbraw/zinc/19/80/37/176198037.db2.gz SQVXGEWKYPSQMX-CHWSQXEVSA-N 1 1 242.366 3.788 20 0 BHADMO C[C@@H]1CC[C@H](C)[N@@H+](Cc2cccc3cc[nH]c32)C1 ZINC000353930828 177183627 /nfs/dbraw/zinc/18/36/27/177183627.db2.gz SQVXGEWKYPSQMX-OLZOCXBDSA-N 1 1 242.366 3.788 20 0 BHADMO C[C@@H]1CC[C@H](C)C[N@@H+]1Cc1cccc2cc[nH]c21 ZINC000353930838 177185284 /nfs/dbraw/zinc/18/52/84/177185284.db2.gz SQVXGEWKYPSQMX-QWHCGFSZSA-N 1 1 242.366 3.788 20 0 BHADMO C[C@H]1CC[C@H](C)[N@@H+](Cc2cccc3cc[nH]c32)C1 ZINC000353930844 177198185 /nfs/dbraw/zinc/19/81/85/177198185.db2.gz SQVXGEWKYPSQMX-STQMWFEESA-N 1 1 242.366 3.788 20 0 BHADMO Cc1ccc([C@H]2C[C@H](C)CC[N@H+]2CC2CC2)o1 ZINC000353931584 136300980 /nfs/dbraw/zinc/30/09/80/136300980.db2.gz IZFMMGDYKWKJRU-BXUZGUMPSA-N 1 1 233.355 3.771 20 0 BHADMO Cc1ccc([C@@H]2C[C@@H](C)CC[N@H+]2CC2CC2)o1 ZINC000353931585 136300969 /nfs/dbraw/zinc/30/09/69/136300969.db2.gz IZFMMGDYKWKJRU-FZMZJTMJSA-N 1 1 233.355 3.771 20 0 BHADMO Cc1ccc([C@@H]2C[C@H](C)CC[N@H+]2CC2CC2)o1 ZINC000353931586 136301277 /nfs/dbraw/zinc/30/12/77/136301277.db2.gz IZFMMGDYKWKJRU-RISCZKNCSA-N 1 1 233.355 3.771 20 0 BHADMO Cc1ccc([C@H]2C[C@@H](C)CC[N@H+]2CC2CC2)o1 ZINC000353931587 136300988 /nfs/dbraw/zinc/30/09/88/136300988.db2.gz IZFMMGDYKWKJRU-SMDDNHRTSA-N 1 1 233.355 3.771 20 0 BHADMO CCSCC[C@@H](C)[N@@H+](C)Cc1ccccc1 ZINC000353934759 170640885 /nfs/dbraw/zinc/64/08/85/170640885.db2.gz RIDRJDWEHZNJCJ-CYBMUJFWSA-N 1 1 237.412 3.650 20 0 BHADMO CCSCC[C@H](C)[N@@H+](C)Cc1ccccc1 ZINC000353934760 387302379 /nfs/dbraw/zinc/30/23/79/387302379.db2.gz RIDRJDWEHZNJCJ-ZDUSSCGKSA-N 1 1 237.412 3.650 20 0 BHADMO C[C@H]1c2ccccc2C[N@@H+]1Cc1ccc(F)cc1 ZINC000353936427 136310582 /nfs/dbraw/zinc/31/05/82/136310582.db2.gz YROLUXAVGMRRFY-LBPRGKRZSA-N 1 1 241.309 3.903 20 0 BHADMO C[C@H]1c2ccccc2C[N@H+]1Cc1ccc(F)cc1 ZINC000353936427 136310581 /nfs/dbraw/zinc/31/05/81/136310581.db2.gz YROLUXAVGMRRFY-LBPRGKRZSA-N 1 1 241.309 3.903 20 0 BHADMO Cc1ncccc1C[N@@H+]1CCC[C@@H](CC(C)C)C1 ZINC000353970100 180218342 /nfs/dbraw/zinc/21/83/42/180218342.db2.gz BUHIVTNWBLHGKU-HNNXBMFYSA-N 1 1 246.398 3.648 20 0 BHADMO Cc1ncccc1C[N@@H+]1CCC[C@H](CC(C)C)C1 ZINC000353970101 180218225 /nfs/dbraw/zinc/21/82/25/180218225.db2.gz BUHIVTNWBLHGKU-OAHLLOKOSA-N 1 1 246.398 3.648 20 0 BHADMO c1cc(C[N@@H+]2CC[C@H]2Cc2ccccc2)cs1 ZINC000353970172 387303672 /nfs/dbraw/zinc/30/36/72/387303672.db2.gz CGNFSSQOPBPLFR-HNNXBMFYSA-N 1 1 243.375 3.565 20 0 BHADMO c1cc(C[N@@H+]2CC[C@@H]2Cc2ccccc2)cs1 ZINC000353970173 387304068 /nfs/dbraw/zinc/30/40/68/387304068.db2.gz CGNFSSQOPBPLFR-OAHLLOKOSA-N 1 1 243.375 3.565 20 0 BHADMO Cc1ncccc1C[N@H+]1CCCC12CCCCC2 ZINC000353971282 180219319 /nfs/dbraw/zinc/21/93/19/180219319.db2.gz JKKXAMOXXBMIIE-UHFFFAOYSA-N 1 1 244.382 3.689 20 0 BHADMO Cc1ccc(C[N@@H+]2CCC[C@@H](CC(C)C)C2)nc1 ZINC000353974882 387305231 /nfs/dbraw/zinc/30/52/31/387305231.db2.gz TWBRYXYJOVUOPO-HNNXBMFYSA-N 1 1 246.398 3.648 20 0 BHADMO Cc1ccc(C[N@@H+]2CCC[C@H](CC(C)C)C2)nc1 ZINC000353974883 387304954 /nfs/dbraw/zinc/30/49/54/387304954.db2.gz TWBRYXYJOVUOPO-OAHLLOKOSA-N 1 1 246.398 3.648 20 0 BHADMO CC(C)C[C@H]1CCC[N@@H+](Cc2ccco2)C1 ZINC000353977823 355715244 /nfs/dbraw/zinc/71/52/44/355715244.db2.gz JNIOQDSPNNNGDC-CYBMUJFWSA-N 1 1 221.344 3.538 20 0 BHADMO CC(C)C[C@@H]1CCC[N@@H+](Cc2ccco2)C1 ZINC000353977824 355715139 /nfs/dbraw/zinc/71/51/39/355715139.db2.gz JNIOQDSPNNNGDC-ZDUSSCGKSA-N 1 1 221.344 3.538 20 0 BHADMO c1ccc([C@@H]2[N@@H+](CC3CC3)CC23CCC3)cc1 ZINC000353985513 387306921 /nfs/dbraw/zinc/30/69/21/387306921.db2.gz CRPGTENOUMOWPX-HNNXBMFYSA-N 1 1 227.351 3.624 20 0 BHADMO c1ccc([C@H]2[N@@H+](CC3CC3)CC23CCC3)cc1 ZINC000353985514 355739574 /nfs/dbraw/zinc/73/95/74/355739574.db2.gz CRPGTENOUMOWPX-OAHLLOKOSA-N 1 1 227.351 3.624 20 0 BHADMO CCC[C@H]1[C@@H](C)CCC[N@H+]1Cc1cccnc1C ZINC000353998354 387308926 /nfs/dbraw/zinc/30/89/26/387308926.db2.gz UFNUFCWKQKSJJT-BBRMVZONSA-N 1 1 246.398 3.791 20 0 BHADMO CCC[C@H]1[C@H](C)CCC[N@H+]1Cc1cccnc1C ZINC000353998355 355797101 /nfs/dbraw/zinc/79/71/01/355797101.db2.gz UFNUFCWKQKSJJT-CJNGLKHVSA-N 1 1 246.398 3.791 20 0 BHADMO CCC[C@@H]1[C@H](C)CCC[N@H+]1Cc1cccnc1C ZINC000353998356 355797366 /nfs/dbraw/zinc/79/73/66/355797366.db2.gz UFNUFCWKQKSJJT-CZUORRHYSA-N 1 1 246.398 3.791 20 0 BHADMO CCC[C@@H]1[C@@H](C)CCC[N@H+]1Cc1cccnc1C ZINC000353998357 355797566 /nfs/dbraw/zinc/79/75/66/355797566.db2.gz UFNUFCWKQKSJJT-XJKSGUPXSA-N 1 1 246.398 3.791 20 0 BHADMO CC(C)C[N@H+]1CC[C@@H](C)C[C@@H]1c1ccco1 ZINC000354007113 356728761 /nfs/dbraw/zinc/72/87/61/356728761.db2.gz BHNKWCXVXAICPW-CHWSQXEVSA-N 1 1 221.344 3.709 20 0 BHADMO CC(C)C[N@H+]1CC[C@@H](C)C[C@H]1c1ccco1 ZINC000354007114 356728510 /nfs/dbraw/zinc/72/85/10/356728510.db2.gz BHNKWCXVXAICPW-OLZOCXBDSA-N 1 1 221.344 3.709 20 0 BHADMO CC(C)C[N@H+]1CC[C@H](C)C[C@@H]1c1ccco1 ZINC000354007115 356728678 /nfs/dbraw/zinc/72/86/78/356728678.db2.gz BHNKWCXVXAICPW-QWHCGFSZSA-N 1 1 221.344 3.709 20 0 BHADMO CC(C)C[N@H+]1CC[C@H](C)C[C@H]1c1ccco1 ZINC000354007116 356728779 /nfs/dbraw/zinc/72/87/79/356728779.db2.gz BHNKWCXVXAICPW-STQMWFEESA-N 1 1 221.344 3.709 20 0 BHADMO CCC(C)(C)[C@H]1CCC[N@H+]1Cc1ccco1 ZINC000354009064 168305909 /nfs/dbraw/zinc/30/59/09/168305909.db2.gz KRIUOTQDUCQSKB-CYBMUJFWSA-N 1 1 221.344 3.680 20 0 BHADMO CCC(C)(C)[C@@H]1CCC[N@H+]1Cc1ccco1 ZINC000354009066 168303691 /nfs/dbraw/zinc/30/36/91/168303691.db2.gz KRIUOTQDUCQSKB-ZDUSSCGKSA-N 1 1 221.344 3.680 20 0 BHADMO CC(C)C[N@@H+](Cc1ccn(C)c1)CC(C)(C)C ZINC000354012330 356729235 /nfs/dbraw/zinc/72/92/35/356729235.db2.gz YTWACXDWAGBYOA-UHFFFAOYSA-N 1 1 236.403 3.529 20 0 BHADMO C[C@H](c1cccnc1)[N@H+]1CC[C@@H](C)C(C)(C)C1 ZINC000354016472 177045763 /nfs/dbraw/zinc/04/57/63/177045763.db2.gz ZVBMVCIPIQBAMY-CHWSQXEVSA-N 1 1 232.371 3.511 20 0 BHADMO C[C@@H](c1cccnc1)[N@H+]1CC[C@@H](C)C(C)(C)C1 ZINC000354016473 176029853 /nfs/dbraw/zinc/02/98/53/176029853.db2.gz ZVBMVCIPIQBAMY-OLZOCXBDSA-N 1 1 232.371 3.511 20 0 BHADMO C[C@H](c1cccnc1)[N@H+]1CC[C@H](C)C(C)(C)C1 ZINC000354016474 177169849 /nfs/dbraw/zinc/16/98/49/177169849.db2.gz ZVBMVCIPIQBAMY-QWHCGFSZSA-N 1 1 232.371 3.511 20 0 BHADMO C[C@@H](c1cccnc1)[N@H+]1CC[C@H](C)C(C)(C)C1 ZINC000354016475 176030614 /nfs/dbraw/zinc/03/06/14/176030614.db2.gz ZVBMVCIPIQBAMY-STQMWFEESA-N 1 1 232.371 3.511 20 0 BHADMO Cc1cc(C)c(C[N@@H+](C)Cc2ccc[nH]2)cc1C ZINC000354025711 387313783 /nfs/dbraw/zinc/31/37/83/387313783.db2.gz IETDFLAFFKMJJW-UHFFFAOYSA-N 1 1 242.366 3.572 20 0 BHADMO Cc1ccc(C[N@@H+]2CCC[C@H]2CCC(C)C)nc1 ZINC000354025724 387313117 /nfs/dbraw/zinc/31/31/17/387313117.db2.gz ILFBRPSGUULXEU-INIZCTEOSA-N 1 1 246.398 3.791 20 0 BHADMO Cc1ccc(C[N@@H+]2CCC[C@@H]2CCC(C)C)nc1 ZINC000354025725 387313229 /nfs/dbraw/zinc/31/32/29/387313229.db2.gz ILFBRPSGUULXEU-MRXNPFEDSA-N 1 1 246.398 3.791 20 0 BHADMO Cc1ncccc1C[N@@H+]1CCC[C@H]1CCC(C)C ZINC000354025793 180220400 /nfs/dbraw/zinc/22/04/00/180220400.db2.gz JMDOJZNJUOULOQ-INIZCTEOSA-N 1 1 246.398 3.791 20 0 BHADMO Cc1ncccc1C[N@@H+]1CCC[C@@H]1CCC(C)C ZINC000354025794 180218228 /nfs/dbraw/zinc/21/82/28/180218228.db2.gz JMDOJZNJUOULOQ-MRXNPFEDSA-N 1 1 246.398 3.791 20 0 BHADMO Cc1cc(C)c(C[N@@H+](C)Cc2ccc[nH]2)c(C)c1 ZINC000354026265 387314123 /nfs/dbraw/zinc/31/41/23/387314123.db2.gz QEISMGNPFZNULV-UHFFFAOYSA-N 1 1 242.366 3.572 20 0 BHADMO CSC1(CNc2cccc(C3CC3)[nH+]2)CCC1 ZINC000354032740 387315858 /nfs/dbraw/zinc/31/58/58/387315858.db2.gz DFBZCQJDFCFBGB-UHFFFAOYSA-N 1 1 248.395 3.657 20 0 BHADMO CCC[C@H](C)[C@@H]1CCC[N@H+]1Cc1cccnc1C ZINC000354034888 387317332 /nfs/dbraw/zinc/31/73/32/387317332.db2.gz UOBGUXIZGLCITB-BBRMVZONSA-N 1 1 246.398 3.791 20 0 BHADMO CCC[C@@H](C)[C@@H]1CCC[N@H+]1Cc1cccnc1C ZINC000354034889 169373198 /nfs/dbraw/zinc/37/31/98/169373198.db2.gz UOBGUXIZGLCITB-CJNGLKHVSA-N 1 1 246.398 3.791 20 0 BHADMO CCC[C@@H](C)[C@H]1CCC[N@H+]1Cc1cccnc1C ZINC000354034890 169374193 /nfs/dbraw/zinc/37/41/93/169374193.db2.gz UOBGUXIZGLCITB-CZUORRHYSA-N 1 1 246.398 3.791 20 0 BHADMO CCC[C@H](C)[C@H]1CCC[N@H+]1Cc1cccnc1C ZINC000354034891 387318256 /nfs/dbraw/zinc/31/82/56/387318256.db2.gz UOBGUXIZGLCITB-XJKSGUPXSA-N 1 1 246.398 3.791 20 0 BHADMO CC(C)(C)CCNc1cccc(C2CC2)[nH+]1 ZINC000354035458 166571681 /nfs/dbraw/zinc/57/16/81/166571681.db2.gz YKRXRINDGAGYIM-UHFFFAOYSA-N 1 1 218.344 3.807 20 0 BHADMO C[C@H](c1ccccn1)[N@H+]1CC[C@@H](C)C(C)(C)C1 ZINC000354042257 177043698 /nfs/dbraw/zinc/04/36/98/177043698.db2.gz MAYOBFYRJKHOTJ-CHWSQXEVSA-N 1 1 232.371 3.511 20 0 BHADMO C[C@@H](c1ccccn1)[N@H+]1CC[C@@H](C)C(C)(C)C1 ZINC000354042258 176027446 /nfs/dbraw/zinc/02/74/46/176027446.db2.gz MAYOBFYRJKHOTJ-OLZOCXBDSA-N 1 1 232.371 3.511 20 0 BHADMO C[C@H](c1ccccn1)[N@H+]1CC[C@H](C)C(C)(C)C1 ZINC000354042259 177170163 /nfs/dbraw/zinc/17/01/63/177170163.db2.gz MAYOBFYRJKHOTJ-QWHCGFSZSA-N 1 1 232.371 3.511 20 0 BHADMO C[C@@H](c1ccccn1)[N@H+]1CC[C@H](C)C(C)(C)C1 ZINC000354042260 176027814 /nfs/dbraw/zinc/02/78/14/176027814.db2.gz MAYOBFYRJKHOTJ-STQMWFEESA-N 1 1 232.371 3.511 20 0 BHADMO CC(C)CC[C@H]1CCC[N@H+]1Cc1ccco1 ZINC000354044544 356729330 /nfs/dbraw/zinc/72/93/30/356729330.db2.gz JPKPXTZEQDNPKE-CYBMUJFWSA-N 1 1 221.344 3.680 20 0 BHADMO CC(C)CC[C@@H]1CCC[N@H+]1Cc1ccco1 ZINC000354044545 387320313 /nfs/dbraw/zinc/32/03/13/387320313.db2.gz JPKPXTZEQDNPKE-ZDUSSCGKSA-N 1 1 221.344 3.680 20 0 BHADMO CC[C@@H](C)C[N@@H+](CC)Cc1ccsc1 ZINC000354045177 170701636 /nfs/dbraw/zinc/70/16/36/170701636.db2.gz RCWGFJRHMSEHEM-LLVKDONJSA-N 1 1 211.374 3.616 20 0 BHADMO CC[C@H](C)C[N@@H+](CC)Cc1ccsc1 ZINC000354045178 171278497 /nfs/dbraw/zinc/27/84/97/171278497.db2.gz RCWGFJRHMSEHEM-NSHDSACASA-N 1 1 211.374 3.616 20 0 BHADMO C[N@H+](Cc1ccc[nH]1)CC1CCC(C)(C)CC1 ZINC000354045694 387319597 /nfs/dbraw/zinc/31/95/97/387319597.db2.gz YEASZSXMYXFNQE-UHFFFAOYSA-N 1 1 234.387 3.663 20 0 BHADMO Cc1ccc(C[N@@H+]2C[C@H](C)[C@@H]2c2ccccc2)o1 ZINC000354045758 387319927 /nfs/dbraw/zinc/31/99/27/387319927.db2.gz ZKSHMERFUPVYJI-BLLLJJGKSA-N 1 1 241.334 3.781 20 0 BHADMO Cc1ccc(C[N@@H+]2C[C@H](C)[C@H]2c2ccccc2)o1 ZINC000354045759 387319614 /nfs/dbraw/zinc/31/96/14/387319614.db2.gz ZKSHMERFUPVYJI-LRDDRELGSA-N 1 1 241.334 3.781 20 0 BHADMO Cc1ccc(C[N@@H+]2C[C@@H](C)[C@@H]2c2ccccc2)o1 ZINC000354045760 387320178 /nfs/dbraw/zinc/32/01/78/387320178.db2.gz ZKSHMERFUPVYJI-MLGOLLRUSA-N 1 1 241.334 3.781 20 0 BHADMO Cc1ccc(C[N@@H+]2C[C@@H](C)[C@H]2c2ccccc2)o1 ZINC000354045761 387319656 /nfs/dbraw/zinc/31/96/56/387319656.db2.gz ZKSHMERFUPVYJI-WBMJQRKESA-N 1 1 241.334 3.781 20 0 BHADMO CSC[C@@H]1CCC[N@H+]1Cc1cc(C)cc(C)c1 ZINC000354078203 387328224 /nfs/dbraw/zinc/32/82/24/387328224.db2.gz ORFJZKYDAVPACE-HNNXBMFYSA-N 1 1 249.423 3.631 20 0 BHADMO CSC[C@H]1CCC[N@H+]1Cc1cc(C)cc(C)c1 ZINC000354078204 387327280 /nfs/dbraw/zinc/32/72/80/387327280.db2.gz ORFJZKYDAVPACE-OAHLLOKOSA-N 1 1 249.423 3.631 20 0 BHADMO CSC[C@@H]1CCC[N@H+]1Cc1cccc(C)c1C ZINC000354097064 387329797 /nfs/dbraw/zinc/32/97/97/387329797.db2.gz MWVQBUSZAPACCA-HNNXBMFYSA-N 1 1 249.423 3.631 20 0 BHADMO CSC[C@H]1CCC[N@H+]1Cc1cccc(C)c1C ZINC000354097065 387330518 /nfs/dbraw/zinc/33/05/18/387330518.db2.gz MWVQBUSZAPACCA-OAHLLOKOSA-N 1 1 249.423 3.631 20 0 BHADMO CSC[C@@H]1CCC[N@H+]1Cc1ccc(C)c(C)c1 ZINC000354100366 386592056 /nfs/dbraw/zinc/59/20/56/386592056.db2.gz LMUDIDJEZPTQNV-HNNXBMFYSA-N 1 1 249.423 3.631 20 0 BHADMO CSC[C@H]1CCC[N@H+]1Cc1ccc(C)c(C)c1 ZINC000354100367 386591477 /nfs/dbraw/zinc/59/14/77/386591477.db2.gz LMUDIDJEZPTQNV-OAHLLOKOSA-N 1 1 249.423 3.631 20 0 BHADMO CC[C@]1(C)CC[N@@H+](Cc2ccc(Cl)o2)C1 ZINC000354100414 387330151 /nfs/dbraw/zinc/33/01/51/387330151.db2.gz MGBUIKTVWSYUFP-GFCCVEGCSA-N 1 1 227.735 3.555 20 0 BHADMO CC[C@@]1(C)CC[N@@H+](Cc2ccc(Cl)o2)C1 ZINC000354100415 171200537 /nfs/dbraw/zinc/20/05/37/171200537.db2.gz MGBUIKTVWSYUFP-LBPRGKRZSA-N 1 1 227.735 3.555 20 0 BHADMO CSC[C@@H]1CCC[N@H+]1Cc1ccc(C)cc1C ZINC000354101297 387329318 /nfs/dbraw/zinc/32/93/18/387329318.db2.gz SGRYIHNVDLNZHB-HNNXBMFYSA-N 1 1 249.423 3.631 20 0 BHADMO CSC[C@H]1CCC[N@H+]1Cc1ccc(C)cc1C ZINC000354101298 387330380 /nfs/dbraw/zinc/33/03/80/387330380.db2.gz SGRYIHNVDLNZHB-OAHLLOKOSA-N 1 1 249.423 3.631 20 0 BHADMO c1oc2ccccc2c1C[N@H+]1CC[C@@H](C2CC2)C1 ZINC000354106731 387329851 /nfs/dbraw/zinc/32/98/51/387329851.db2.gz LHWVUZYMTCKIOE-CYBMUJFWSA-N 1 1 241.334 3.665 20 0 BHADMO c1oc2ccccc2c1C[N@H+]1CC[C@H](C2CC2)C1 ZINC000354106732 387329531 /nfs/dbraw/zinc/32/95/31/387329531.db2.gz LHWVUZYMTCKIOE-ZDUSSCGKSA-N 1 1 241.334 3.665 20 0 BHADMO CC[C@]1(C)CC[N@@H+](Cc2ccc(C)s2)C1 ZINC000354107093 171713763 /nfs/dbraw/zinc/71/37/63/171713763.db2.gz NNHRJTHGAZHPHQ-CYBMUJFWSA-N 1 1 223.385 3.679 20 0 BHADMO CC[C@@]1(C)CC[N@@H+](Cc2ccc(C)s2)C1 ZINC000354107094 171201142 /nfs/dbraw/zinc/20/11/42/171201142.db2.gz NNHRJTHGAZHPHQ-ZDUSSCGKSA-N 1 1 223.385 3.679 20 0 BHADMO CSC[C@@H]1CCC[N@H+]1Cc1cc(C)ccc1C ZINC000354107111 175517466 /nfs/dbraw/zinc/51/74/66/175517466.db2.gz NTINRGPDQGRKGI-HNNXBMFYSA-N 1 1 249.423 3.631 20 0 BHADMO CSC[C@H]1CCC[N@H+]1Cc1cc(C)ccc1C ZINC000354107112 387332758 /nfs/dbraw/zinc/33/27/58/387332758.db2.gz NTINRGPDQGRKGI-OAHLLOKOSA-N 1 1 249.423 3.631 20 0 BHADMO CCC[C@@H]1CCC[N@@H+](Cc2ccc(C)o2)C1 ZINC000354111821 387332274 /nfs/dbraw/zinc/33/22/74/387332274.db2.gz VKVAQTCQSIFUQF-CYBMUJFWSA-N 1 1 221.344 3.600 20 0 BHADMO CCC[C@H]1CCC[N@@H+](Cc2ccc(C)o2)C1 ZINC000354111822 387331446 /nfs/dbraw/zinc/33/14/46/387331446.db2.gz VKVAQTCQSIFUQF-ZDUSSCGKSA-N 1 1 221.344 3.600 20 0 BHADMO c1coc(C[N@H+]2CCCC23CCCCC3)c1 ZINC000354130505 387334485 /nfs/dbraw/zinc/33/44/85/387334485.db2.gz KXMRSCBDBWLBHU-UHFFFAOYSA-N 1 1 219.328 3.578 20 0 BHADMO Cc1cccc(NCc2ccc(C(F)F)cc2)[nH+]1 ZINC000354181386 179147645 /nfs/dbraw/zinc/14/76/45/179147645.db2.gz LZFDPPLUKYZFHF-UHFFFAOYSA-N 1 1 248.276 3.940 20 0 BHADMO CCc1cccc(F)c1CNc1cccc(C)[nH+]1 ZINC000354181585 387343418 /nfs/dbraw/zinc/34/34/18/387343418.db2.gz MQTRNTZTWOGBFO-UHFFFAOYSA-N 1 1 244.313 3.704 20 0 BHADMO CCCC[C@H](C)[N@@H+](CCCC)Cc1cncnc1 ZINC000354476433 356739527 /nfs/dbraw/zinc/73/95/27/356739527.db2.gz KKZBWRSTAIHMRB-AWEZNQCLSA-N 1 1 249.402 3.657 20 0 BHADMO CCCC[C@@H](C)[N@@H+](CCCC)Cc1cncnc1 ZINC000354476436 356739543 /nfs/dbraw/zinc/73/95/43/356739543.db2.gz KKZBWRSTAIHMRB-CQSZACIVSA-N 1 1 249.402 3.657 20 0 BHADMO Cc1cc(Cl)cc(C[N@H+]2CCC[C@@H]2CF)c1 ZINC000354518499 178063233 /nfs/dbraw/zinc/06/32/33/178063233.db2.gz AYTYOXRBLPGWQR-CYBMUJFWSA-N 1 1 241.737 3.582 20 0 BHADMO Cc1cc(Cl)cc(C[N@@H+]2CCC[C@@H]2CF)c1 ZINC000354518499 178063231 /nfs/dbraw/zinc/06/32/31/178063231.db2.gz AYTYOXRBLPGWQR-CYBMUJFWSA-N 1 1 241.737 3.582 20 0 BHADMO Cc1cc(Cl)cc(C[N@H+]2CCC[C@H]2CF)c1 ZINC000354518507 178062936 /nfs/dbraw/zinc/06/29/36/178062936.db2.gz AYTYOXRBLPGWQR-ZDUSSCGKSA-N 1 1 241.737 3.582 20 0 BHADMO Cc1cc(Cl)cc(C[N@@H+]2CCC[C@H]2CF)c1 ZINC000354518507 178062935 /nfs/dbraw/zinc/06/29/35/178062935.db2.gz AYTYOXRBLPGWQR-ZDUSSCGKSA-N 1 1 241.737 3.582 20 0 BHADMO Cc1cc(C[N@H+]2CCC[C@@H]2CF)ccc1Cl ZINC000354520018 387386690 /nfs/dbraw/zinc/38/66/90/387386690.db2.gz IWESMRQBFCBZLR-GFCCVEGCSA-N 1 1 241.737 3.582 20 0 BHADMO Cc1cc(C[N@@H+]2CCC[C@@H]2CF)ccc1Cl ZINC000354520018 387386688 /nfs/dbraw/zinc/38/66/88/387386688.db2.gz IWESMRQBFCBZLR-GFCCVEGCSA-N 1 1 241.737 3.582 20 0 BHADMO Cc1cc(C[N@H+]2CCC[C@H]2CF)ccc1Cl ZINC000354520019 387388013 /nfs/dbraw/zinc/38/80/13/387388013.db2.gz IWESMRQBFCBZLR-LBPRGKRZSA-N 1 1 241.737 3.582 20 0 BHADMO Cc1cc(C[N@@H+]2CCC[C@H]2CF)ccc1Cl ZINC000354520019 387388009 /nfs/dbraw/zinc/38/80/09/387388009.db2.gz IWESMRQBFCBZLR-LBPRGKRZSA-N 1 1 241.737 3.582 20 0 BHADMO Cc1oc2ccccc2c1C[N@H+]1CCC[C@@H]1CF ZINC000354520335 387387357 /nfs/dbraw/zinc/38/73/57/387387357.db2.gz HYQYDPJRGHJLMW-GFCCVEGCSA-N 1 1 247.313 3.675 20 0 BHADMO Cc1oc2ccccc2c1C[N@H+]1CCC[C@H]1CF ZINC000354520337 387386401 /nfs/dbraw/zinc/38/64/01/387386401.db2.gz HYQYDPJRGHJLMW-LBPRGKRZSA-N 1 1 247.313 3.675 20 0 BHADMO Cc1ccc(C[N@H+]2CCC[C@@H]2CF)cc1Cl ZINC000354522858 387389975 /nfs/dbraw/zinc/38/99/75/387389975.db2.gz SPNHYGRWSMDLJA-GFCCVEGCSA-N 1 1 241.737 3.582 20 0 BHADMO Cc1ccc(C[N@@H+]2CCC[C@@H]2CF)cc1Cl ZINC000354522858 387389971 /nfs/dbraw/zinc/38/99/71/387389971.db2.gz SPNHYGRWSMDLJA-GFCCVEGCSA-N 1 1 241.737 3.582 20 0 BHADMO Cc1ccc(C[N@H+]2CCC[C@H]2CF)cc1Cl ZINC000354522860 387389193 /nfs/dbraw/zinc/38/91/93/387389193.db2.gz SPNHYGRWSMDLJA-LBPRGKRZSA-N 1 1 241.737 3.582 20 0 BHADMO Cc1ccc(C[N@@H+]2CCC[C@H]2CF)cc1Cl ZINC000354522860 387389186 /nfs/dbraw/zinc/38/91/86/387389186.db2.gz SPNHYGRWSMDLJA-LBPRGKRZSA-N 1 1 241.737 3.582 20 0 BHADMO Cc1sccc1C[N@H+]1CC[C@H](CC2CC2)C1 ZINC000354524020 387388859 /nfs/dbraw/zinc/38/88/59/387388859.db2.gz FHFBXRHYDVLDCJ-CYBMUJFWSA-N 1 1 235.396 3.679 20 0 BHADMO Cc1sccc1C[N@H+]1CC[C@@H](CC2CC2)C1 ZINC000354524021 387390684 /nfs/dbraw/zinc/39/06/84/387390684.db2.gz FHFBXRHYDVLDCJ-ZDUSSCGKSA-N 1 1 235.396 3.679 20 0 BHADMO Clc1ccc(C[N@H+]2CC[C@H](CC3CC3)C2)o1 ZINC000354529991 385628937 /nfs/dbraw/zinc/62/89/37/385628937.db2.gz UPSUVQZMMUKFRE-LLVKDONJSA-N 1 1 239.746 3.555 20 0 BHADMO Clc1ccc(C[N@H+]2CC[C@@H](CC3CC3)C2)o1 ZINC000354529995 385628662 /nfs/dbraw/zinc/62/86/62/385628662.db2.gz UPSUVQZMMUKFRE-NSHDSACASA-N 1 1 239.746 3.555 20 0 BHADMO c1cc(N[C@H]2CC[C@@H]2C2CC2)[nH+]cc1C1CCC1 ZINC000354556795 183358368 /nfs/dbraw/zinc/35/83/68/183358368.db2.gz BZIMXFOUQRBCKV-CABCVRRESA-N 1 1 242.366 3.950 20 0 BHADMO c1cc(N[C@H]2CC[C@H]2C2CC2)[nH+]cc1C1CCC1 ZINC000354556797 183358862 /nfs/dbraw/zinc/35/88/62/183358862.db2.gz BZIMXFOUQRBCKV-GJZGRUSLSA-N 1 1 242.366 3.950 20 0 BHADMO c1cc(N[C@@H]2CC[C@@H]2C2CC2)[nH+]cc1C1CCC1 ZINC000354556799 183358723 /nfs/dbraw/zinc/35/87/23/183358723.db2.gz BZIMXFOUQRBCKV-HUUCEWRRSA-N 1 1 242.366 3.950 20 0 BHADMO c1cc(N[C@@H]2CC[C@H]2C2CC2)[nH+]cc1C1CCC1 ZINC000354557177 183359261 /nfs/dbraw/zinc/35/92/61/183359261.db2.gz BZIMXFOUQRBCKV-LSDHHAIUSA-N 1 1 242.366 3.950 20 0 BHADMO C[C@H](CC1CC1)Nc1ccc(C2CCC2)c[nH+]1 ZINC000354557246 176614388 /nfs/dbraw/zinc/61/43/88/176614388.db2.gz CZGNWNBAPYMTRY-LLVKDONJSA-N 1 1 230.355 3.950 20 0 BHADMO C[C@@H](CC1CC1)Nc1ccc(C2CCC2)c[nH+]1 ZINC000354557247 387394258 /nfs/dbraw/zinc/39/42/58/387394258.db2.gz CZGNWNBAPYMTRY-NSHDSACASA-N 1 1 230.355 3.950 20 0 BHADMO CSC1(CNc2ccc(C3CCC3)c[nH+]2)CC1 ZINC000354557260 387394233 /nfs/dbraw/zinc/39/42/33/387394233.db2.gz DIEKEZCPYDEKOW-UHFFFAOYSA-N 1 1 248.395 3.657 20 0 BHADMO CC(C)[C@@H](C)Nc1ccc(C2CCC2)c[nH+]1 ZINC000354557872 167385991 /nfs/dbraw/zinc/38/59/91/167385991.db2.gz GCHHOQRQAHCZCV-LLVKDONJSA-N 1 1 218.344 3.806 20 0 BHADMO CC(C)[C@H](C)Nc1ccc(C2CCC2)c[nH+]1 ZINC000354557874 387394569 /nfs/dbraw/zinc/39/45/69/387394569.db2.gz GCHHOQRQAHCZCV-NSHDSACASA-N 1 1 218.344 3.806 20 0 BHADMO CC1CC(Nc2ccc(C3CCC3)c[nH+]2)C1 ZINC000354561056 168148047 /nfs/dbraw/zinc/14/80/47/168148047.db2.gz MXAYFVBKVUXUJI-UHFFFAOYSA-N 1 1 216.328 3.560 20 0 BHADMO C[C@@H](Nc1ccc(C2CCC2)c[nH+]1)C1CCC1 ZINC000354562042 387396506 /nfs/dbraw/zinc/39/65/06/387396506.db2.gz OPMSKOKHVIZBPY-LLVKDONJSA-N 1 1 230.355 3.950 20 0 BHADMO C[C@H](Nc1ccc(C2CCC2)c[nH+]1)C1CCC1 ZINC000354562044 387395656 /nfs/dbraw/zinc/39/56/56/387395656.db2.gz OPMSKOKHVIZBPY-NSHDSACASA-N 1 1 230.355 3.950 20 0 BHADMO Cc1cccc(C)c1[C@@H](C)[NH2+]Cc1cscn1 ZINC000354630748 179049381 /nfs/dbraw/zinc/04/93/81/179049381.db2.gz CYUOCQDLNWLGTP-GFCCVEGCSA-N 1 1 246.379 3.611 20 0 BHADMO Cc1cccc(C)c1[C@H](C)[NH2+]Cc1cscn1 ZINC000354631832 179049702 /nfs/dbraw/zinc/04/97/02/179049702.db2.gz CYUOCQDLNWLGTP-LBPRGKRZSA-N 1 1 246.379 3.611 20 0 BHADMO Cc1cccc(C)c1[C@@H](C)[NH2+]Cc1nccs1 ZINC000354653930 179049891 /nfs/dbraw/zinc/04/98/91/179049891.db2.gz NYPPUBBXLHNGGT-GFCCVEGCSA-N 1 1 246.379 3.611 20 0 BHADMO Cc1cccc(C)c1[C@H](C)[NH2+]Cc1nccs1 ZINC000354653932 179049915 /nfs/dbraw/zinc/04/99/15/179049915.db2.gz NYPPUBBXLHNGGT-LBPRGKRZSA-N 1 1 246.379 3.611 20 0 BHADMO CC(C)[N@@H+](CCCCOC(C)(C)C)C1CCC1 ZINC000354727987 188236852 /nfs/dbraw/zinc/23/68/52/188236852.db2.gz HQONOZJAJYKQNE-UHFFFAOYSA-N 1 1 241.419 3.845 20 0 BHADMO CCC(C)(C)CC[N@@H+](C)[C@H](C)c1ccncc1 ZINC000354782312 168276441 /nfs/dbraw/zinc/27/64/41/168276441.db2.gz KZIDPXNFZYADGU-CYBMUJFWSA-N 1 1 234.387 3.901 20 0 BHADMO CCC(C)(C)CC[N@@H+](C)[C@@H](C)c1ccncc1 ZINC000354782321 168276724 /nfs/dbraw/zinc/27/67/24/168276724.db2.gz KZIDPXNFZYADGU-ZDUSSCGKSA-N 1 1 234.387 3.901 20 0 BHADMO CC[C@@H](C)[N@@H+](C)CC[C@H](C)OCc1ccccc1 ZINC000354807024 387431208 /nfs/dbraw/zinc/43/12/08/387431208.db2.gz NPKIOOOUUAYPIF-CABCVRRESA-N 1 1 249.398 3.712 20 0 BHADMO CC[C@H](C)[N@@H+](C)CC[C@H](C)OCc1ccccc1 ZINC000354807025 171307492 /nfs/dbraw/zinc/30/74/92/171307492.db2.gz NPKIOOOUUAYPIF-GJZGRUSLSA-N 1 1 249.398 3.712 20 0 BHADMO CC[C@@H](C)[N@@H+](C)CC[C@@H](C)OCc1ccccc1 ZINC000354807026 387431770 /nfs/dbraw/zinc/43/17/70/387431770.db2.gz NPKIOOOUUAYPIF-HUUCEWRRSA-N 1 1 249.398 3.712 20 0 BHADMO CC[C@H](C)[N@@H+](C)CC[C@@H](C)OCc1ccccc1 ZINC000354807027 171307324 /nfs/dbraw/zinc/30/73/24/171307324.db2.gz NPKIOOOUUAYPIF-LSDHHAIUSA-N 1 1 249.398 3.712 20 0 BHADMO Cc1ccc(CC[C@@H](C)Nc2cccc(C)[nH+]2)o1 ZINC000354812909 179156139 /nfs/dbraw/zinc/15/61/39/179156139.db2.gz YXEBCWBIPIEWSQ-GFCCVEGCSA-N 1 1 244.338 3.725 20 0 BHADMO Cc1ccc(CC[C@H](C)Nc2cccc(C)[nH+]2)o1 ZINC000354812911 179153450 /nfs/dbraw/zinc/15/34/50/179153450.db2.gz YXEBCWBIPIEWSQ-LBPRGKRZSA-N 1 1 244.338 3.725 20 0 BHADMO C[C@@H]([N@@H+](C)CCCCOC(C)(C)C)C1(C)CC1 ZINC000354839779 387435976 /nfs/dbraw/zinc/43/59/76/387435976.db2.gz QUSJURNMIAAVIU-CYBMUJFWSA-N 1 1 241.419 3.702 20 0 BHADMO C[C@H]([N@@H+](C)CCCCOC(C)(C)C)C1(C)CC1 ZINC000354839782 387435658 /nfs/dbraw/zinc/43/56/58/387435658.db2.gz QUSJURNMIAAVIU-ZDUSSCGKSA-N 1 1 241.419 3.702 20 0 BHADMO CC(C)C[N@@H+](C)CC[C@H](C)OCc1ccccc1 ZINC000354860395 166936820 /nfs/dbraw/zinc/93/68/20/166936820.db2.gz LVQOFZAQGABWEY-HNNXBMFYSA-N 1 1 249.398 3.570 20 0 BHADMO CC(C)C[N@@H+](C)CC[C@@H](C)OCc1ccccc1 ZINC000354860398 356745341 /nfs/dbraw/zinc/74/53/41/356745341.db2.gz LVQOFZAQGABWEY-OAHLLOKOSA-N 1 1 249.398 3.570 20 0 BHADMO C[C@H]1CCC[N@@H+](CCCCOC(C)(C)C)CC1 ZINC000354861197 177098149 /nfs/dbraw/zinc/09/81/49/177098149.db2.gz GFFIBVOBVFJFAT-AWEZNQCLSA-N 1 1 241.419 3.704 20 0 BHADMO C[C@@H]1CCC[N@@H+](CCCCOC(C)(C)C)CC1 ZINC000354861199 176098078 /nfs/dbraw/zinc/09/80/78/176098078.db2.gz GFFIBVOBVFJFAT-CQSZACIVSA-N 1 1 241.419 3.704 20 0 BHADMO C[N@@H+](CCCCOC(C)(C)C)Cc1ccccc1 ZINC000354861850 387438095 /nfs/dbraw/zinc/43/80/95/387438095.db2.gz HGTWDJGDUUWHKU-UHFFFAOYSA-N 1 1 249.398 3.714 20 0 BHADMO CC[C@H](c1ccccc1)[N@@H+](CC)CCC[C@@H](C)O ZINC000354863520 387438146 /nfs/dbraw/zinc/43/81/46/387438146.db2.gz JLBFZXPWNCNQKM-GDBMZVCRSA-N 1 1 249.398 3.621 20 0 BHADMO CC[C@H](c1ccccc1)[N@@H+](CC)CCC[C@H](C)O ZINC000354863521 387438686 /nfs/dbraw/zinc/43/86/86/387438686.db2.gz JLBFZXPWNCNQKM-GOEBONIOSA-N 1 1 249.398 3.621 20 0 BHADMO CC[C@@H](c1ccccc1)[N@@H+](CC)CCC[C@H](C)O ZINC000354863524 356745358 /nfs/dbraw/zinc/74/53/58/356745358.db2.gz JLBFZXPWNCNQKM-HOCLYGCPSA-N 1 1 249.398 3.621 20 0 BHADMO CC[C@@H](c1ccccc1)[N@@H+](CC)CCC[C@@H](C)O ZINC000354863525 356745590 /nfs/dbraw/zinc/74/55/90/356745590.db2.gz JLBFZXPWNCNQKM-ZBFHGGJFSA-N 1 1 249.398 3.621 20 0 BHADMO Cc1cccc(N2CC=C(C(C)(C)C)CC2)[nH+]1 ZINC000354864984 385763519 /nfs/dbraw/zinc/76/35/19/385763519.db2.gz ZZKGQCCAJFTTJU-UHFFFAOYSA-N 1 1 230.355 3.573 20 0 BHADMO CC[N@@H+](CC[C@H](C)OCc1ccccc1)C(C)C ZINC000354871005 385772203 /nfs/dbraw/zinc/77/22/03/385772203.db2.gz LLVHYGVPINLPJQ-HNNXBMFYSA-N 1 1 249.398 3.712 20 0 BHADMO CC[N@@H+](CC[C@@H](C)OCc1ccccc1)C(C)C ZINC000354871006 385771578 /nfs/dbraw/zinc/77/15/78/385771578.db2.gz LLVHYGVPINLPJQ-OAHLLOKOSA-N 1 1 249.398 3.712 20 0 BHADMO CCC[N@@H+](CC)CC[C@H](C)OCc1ccccc1 ZINC000354871563 169123402 /nfs/dbraw/zinc/12/34/02/169123402.db2.gz MZNUUAIBSNIGLC-HNNXBMFYSA-N 1 1 249.398 3.714 20 0 BHADMO CCC[N@@H+](CC)CC[C@@H](C)OCc1ccccc1 ZINC000354871564 169123010 /nfs/dbraw/zinc/12/30/10/169123010.db2.gz MZNUUAIBSNIGLC-OAHLLOKOSA-N 1 1 249.398 3.714 20 0 BHADMO C[C@@H]1CC[N@@H+](Cc2ccsc2)CC12CCC2 ZINC000354907239 176178352 /nfs/dbraw/zinc/17/83/52/176178352.db2.gz DJSMZCLQUNFYCN-GFCCVEGCSA-N 1 1 235.396 3.760 20 0 BHADMO C[C@H]1CC[N@@H+](Cc2ccsc2)CC12CCC2 ZINC000354907252 177166824 /nfs/dbraw/zinc/16/68/24/177166824.db2.gz DJSMZCLQUNFYCN-LBPRGKRZSA-N 1 1 235.396 3.760 20 0 BHADMO C[C@@H]1CC[N@@H+](Cc2cccs2)CC12CCC2 ZINC000354909121 176176132 /nfs/dbraw/zinc/17/61/32/176176132.db2.gz RJZOABVLKSMDEY-GFCCVEGCSA-N 1 1 235.396 3.760 20 0 BHADMO C[C@H]1CC[N@@H+](Cc2cccs2)CC12CCC2 ZINC000354909124 177165572 /nfs/dbraw/zinc/16/55/72/177165572.db2.gz RJZOABVLKSMDEY-LBPRGKRZSA-N 1 1 235.396 3.760 20 0 BHADMO Cc1ccncc1C[N@H+]1CCCC2(CCCC2)C1 ZINC000354931724 387449004 /nfs/dbraw/zinc/44/90/04/387449004.db2.gz CBGYWJQDXLZSFQ-UHFFFAOYSA-N 1 1 244.382 3.546 20 0 BHADMO C[C@@H]1C[C@@H]1c1ccc(C[N@@H+]2[C@H](C)CC[C@@H]2C)o1 ZINC000354990331 177187407 /nfs/dbraw/zinc/18/74/07/177187407.db2.gz ROCREPLXYBYAHO-NMKXLXIOSA-N 1 1 233.355 3.776 20 0 BHADMO C[C@@H]1C[C@H]1c1ccc(C[N@@H+]2[C@H](C)CC[C@@H]2C)o1 ZINC000354990337 177186951 /nfs/dbraw/zinc/18/69/51/177186951.db2.gz ROCREPLXYBYAHO-NRWUCQMLSA-N 1 1 233.355 3.776 20 0 BHADMO C[C@@H]1CC[C@H](C)[N@@H+]1Cc1ccccc1Cl ZINC000354990447 177187758 /nfs/dbraw/zinc/18/77/58/177187758.db2.gz CAZHZGDBNHXQKU-PHIMTYICSA-N 1 1 223.747 3.713 20 0 BHADMO Cc1ccc(C[N@@H+]2[C@H](C)CC[C@@H]2C)cc1F ZINC000354990805 387460556 /nfs/dbraw/zinc/46/05/56/387460556.db2.gz CUKNBVPXVJIARW-TXEJJXNPSA-N 1 1 221.319 3.507 20 0 BHADMO C[C@@H]1CC[C@H](C)[N@@H+]1Cc1coc2ccccc12 ZINC000354991445 177187324 /nfs/dbraw/zinc/18/73/24/177187324.db2.gz HESKKXUVLUBRIG-TXEJJXNPSA-N 1 1 229.323 3.806 20 0 BHADMO C[C@@H]1CC[C@H](C)[N@@H+]1Cc1cccc2cc[nH]c21 ZINC000354992043 177187561 /nfs/dbraw/zinc/18/75/61/177187561.db2.gz JERMXVMWPHMPSP-TXEJJXNPSA-N 1 1 228.339 3.541 20 0 BHADMO C[C@@H]1CC[C@H](C)[N@@H+]1Cc1cc2ccccc2o1 ZINC000354992690 177186155 /nfs/dbraw/zinc/18/61/55/177186155.db2.gz MHHNJRDCKJQZQS-TXEJJXNPSA-N 1 1 229.323 3.806 20 0 BHADMO Cc1ccc(F)c(C[N@@H+]2[C@H](C)CC[C@@H]2C)c1 ZINC000354993390 387461729 /nfs/dbraw/zinc/46/17/29/387461729.db2.gz ONDBFQUSMJYHLI-TXEJJXNPSA-N 1 1 221.319 3.507 20 0 BHADMO C[C@@H]1CC[C@H](C)[N@@H+]1Cc1ccc(Cl)cc1 ZINC000354993991 177187369 /nfs/dbraw/zinc/18/73/69/177187369.db2.gz QKHYCBSTSXMWJP-PHIMTYICSA-N 1 1 223.747 3.713 20 0 BHADMO Cc1cc(C[N@@H+]2[C@H](C)CC[C@@H]2C)c(C)s1 ZINC000354993994 178009517 /nfs/dbraw/zinc/00/95/17/178009517.db2.gz QKTLNWDYHOPWKV-AOOOYVTPSA-N 1 1 223.385 3.738 20 0 BHADMO CSc1ccc(C[N@@H+]2[C@H](C)CC[C@@H]2C)cc1 ZINC000354994591 175575380 /nfs/dbraw/zinc/57/53/80/175575380.db2.gz RMJJMOOVSYWEOP-TXEJJXNPSA-N 1 1 235.396 3.781 20 0 BHADMO C[C@@H]1CC[C@H](C)[N@@H+]1Cc1cccc(Cl)c1 ZINC000354994718 177187416 /nfs/dbraw/zinc/18/74/16/177187416.db2.gz SLJKWRGLPPHCHD-PHIMTYICSA-N 1 1 223.747 3.713 20 0 BHADMO C[C@@H]1CC[C@H](C)[N@@H+]1Cc1cc2cc(F)ccc2o1 ZINC000354995304 177186234 /nfs/dbraw/zinc/18/62/34/177186234.db2.gz UDYDNQBJZQZSSX-PHIMTYICSA-N 1 1 247.313 3.945 20 0 BHADMO C[C@@H]1CC[C@H](C)[N@@H+]1Cc1ccc2ncccc2c1 ZINC000354996008 177187870 /nfs/dbraw/zinc/18/78/70/177187870.db2.gz WCOFWMOQSQDKEK-BETUJISGSA-N 1 1 240.350 3.608 20 0 BHADMO Cc1cc(C[N@@H+]2[C@H](C)CC[C@@H]2C)ccc1F ZINC000354996611 178009934 /nfs/dbraw/zinc/00/99/34/178009934.db2.gz XQYYCWIXPVUNLC-TXEJJXNPSA-N 1 1 221.319 3.507 20 0 BHADMO CC[N@@H+](CCC1CC1)Cc1c(F)cccc1F ZINC000355035840 387468556 /nfs/dbraw/zinc/46/85/56/387468556.db2.gz IOKAGFNKTUSTNA-UHFFFAOYSA-N 1 1 239.309 3.587 20 0 BHADMO CC[N@@H+](CCC1CC1)Cc1cccc(F)c1F ZINC000355060909 387472618 /nfs/dbraw/zinc/47/26/18/387472618.db2.gz OLJMOOAIIXVOBX-UHFFFAOYSA-N 1 1 239.309 3.587 20 0 BHADMO C[C@H]([N@@H+](C)Cc1ccc(F)cc1F)C1(C)CC1 ZINC000355075363 387475808 /nfs/dbraw/zinc/47/58/08/387475808.db2.gz BHVJPGKQCURJAO-JTQLQIEISA-N 1 1 239.309 3.585 20 0 BHADMO C[C@@H]([N@@H+](C)Cc1ccc(F)cc1F)C1(C)CC1 ZINC000355075364 387474524 /nfs/dbraw/zinc/47/45/24/387474524.db2.gz BHVJPGKQCURJAO-SNVBAGLBSA-N 1 1 239.309 3.585 20 0 BHADMO Cc1cc(F)ccc1C[N@H+](C)[C@H](C)C1(C)CC1 ZINC000355077586 178085933 /nfs/dbraw/zinc/08/59/33/178085933.db2.gz GKCUZBBSOFLYCD-GFCCVEGCSA-N 1 1 235.346 3.755 20 0 BHADMO Cc1cc(F)ccc1C[N@H+](C)[C@@H](C)C1(C)CC1 ZINC000355077600 178084879 /nfs/dbraw/zinc/08/48/79/178084879.db2.gz GKCUZBBSOFLYCD-LBPRGKRZSA-N 1 1 235.346 3.755 20 0 BHADMO CC[C@@H]1CC[N@@H+](Cc2coc3ccccc23)C1 ZINC000355077912 171014837 /nfs/dbraw/zinc/01/48/37/171014837.db2.gz HFVWLKOMFXCLEU-GFCCVEGCSA-N 1 1 229.323 3.665 20 0 BHADMO CC[C@H]1CC[N@@H+](Cc2coc3ccccc23)C1 ZINC000355077914 387473922 /nfs/dbraw/zinc/47/39/22/387473922.db2.gz HFVWLKOMFXCLEU-LBPRGKRZSA-N 1 1 229.323 3.665 20 0 BHADMO C[C@H]([N@@H+](C)Cc1cc(F)ccc1F)C1(C)CC1 ZINC000355078600 387474927 /nfs/dbraw/zinc/47/49/27/387474927.db2.gz ILPQWTOYFGWFTF-JTQLQIEISA-N 1 1 239.309 3.585 20 0 BHADMO C[C@@H]([N@@H+](C)Cc1cc(F)ccc1F)C1(C)CC1 ZINC000355078976 387474484 /nfs/dbraw/zinc/47/44/84/387474484.db2.gz ILPQWTOYFGWFTF-SNVBAGLBSA-N 1 1 239.309 3.585 20 0 BHADMO COc1ccc(C)cc1C[N@@H+](C)[C@H](C)C1(C)CC1 ZINC000355079023 175074672 /nfs/dbraw/zinc/07/46/72/175074672.db2.gz JCGMCAXMCJQNPS-CYBMUJFWSA-N 1 1 247.382 3.624 20 0 BHADMO COc1ccc(C)cc1C[N@@H+](C)[C@@H](C)C1(C)CC1 ZINC000355079024 175074974 /nfs/dbraw/zinc/07/49/74/175074974.db2.gz JCGMCAXMCJQNPS-ZDUSSCGKSA-N 1 1 247.382 3.624 20 0 BHADMO COc1ccc(C[N@@H+](C)[C@H](C)C2(C)CC2)cc1C ZINC000355079498 187211856 /nfs/dbraw/zinc/21/18/56/187211856.db2.gz KJGVZQWMCVTTGM-CYBMUJFWSA-N 1 1 247.382 3.624 20 0 BHADMO COc1ccc(C[N@@H+](C)[C@@H](C)C2(C)CC2)cc1C ZINC000355079499 175096516 /nfs/dbraw/zinc/09/65/16/175096516.db2.gz KJGVZQWMCVTTGM-ZDUSSCGKSA-N 1 1 247.382 3.624 20 0 BHADMO CC[C@@H]1CC[N@@H+](Cc2cc3cc(F)ccc3o2)C1 ZINC000355079725 171012534 /nfs/dbraw/zinc/01/25/34/171012534.db2.gz LNONDKINIJIBQT-LLVKDONJSA-N 1 1 247.313 3.804 20 0 BHADMO CC[C@H]1CC[N@@H+](Cc2cc3cc(F)ccc3o2)C1 ZINC000355079726 387478111 /nfs/dbraw/zinc/47/81/11/387478111.db2.gz LNONDKINIJIBQT-NSHDSACASA-N 1 1 247.313 3.804 20 0 BHADMO Cc1cccc(C[N@H+](C)[C@H](C)C2(C)CC2)c1 ZINC000355080152 179068727 /nfs/dbraw/zinc/06/87/27/179068727.db2.gz LTFWKNQTRLICKV-CYBMUJFWSA-N 1 1 217.356 3.615 20 0 BHADMO Cc1cccc(C[N@H+](C)[C@@H](C)C2(C)CC2)c1 ZINC000355080154 179068345 /nfs/dbraw/zinc/06/83/45/179068345.db2.gz LTFWKNQTRLICKV-ZDUSSCGKSA-N 1 1 217.356 3.615 20 0 BHADMO CC[C@@H]1CC[N@@H+](Cc2cc(C)sc2C)C1 ZINC000355080274 171011446 /nfs/dbraw/zinc/01/14/46/171011446.db2.gz MXXDQKDHBHCKMG-GFCCVEGCSA-N 1 1 223.385 3.597 20 0 BHADMO CC[C@H]1CC[N@@H+](Cc2cc(C)sc2C)C1 ZINC000355080275 387476662 /nfs/dbraw/zinc/47/66/62/387476662.db2.gz MXXDQKDHBHCKMG-LBPRGKRZSA-N 1 1 223.385 3.597 20 0 BHADMO C[C@@H]1C[C@H](C)[C@@H](C)[N@@H+](Cc2ccsc2)C1 ZINC000355080368 177314819 /nfs/dbraw/zinc/31/48/19/177314819.db2.gz FEHPXUCLQWMMNN-GRYCIOLGSA-N 1 1 223.385 3.615 20 0 BHADMO C[C@@H]1C[C@@H](C)[C@@H](C)[N@@H+](Cc2ccsc2)C1 ZINC000355080370 176365707 /nfs/dbraw/zinc/36/57/07/176365707.db2.gz FEHPXUCLQWMMNN-IJLUTSLNSA-N 1 1 223.385 3.615 20 0 BHADMO C[C@@H]1C[C@@H](C)[C@H](C)[N@@H+](Cc2ccsc2)C1 ZINC000355080372 387478462 /nfs/dbraw/zinc/47/84/62/387478462.db2.gz FEHPXUCLQWMMNN-UTUOFQBUSA-N 1 1 223.385 3.615 20 0 BHADMO C[C@@H]1C[C@H](C)[C@H](C)[N@@H+](Cc2ccsc2)C1 ZINC000355080373 177314333 /nfs/dbraw/zinc/31/43/33/177314333.db2.gz FEHPXUCLQWMMNN-WOPDTQHZSA-N 1 1 223.385 3.615 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@H](C)C2(C)CC2)cc1 ZINC000355080870 387478089 /nfs/dbraw/zinc/47/80/89/387478089.db2.gz NDZHARUARONRDV-CYBMUJFWSA-N 1 1 217.356 3.615 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@@H](C)C2(C)CC2)cc1 ZINC000355080871 387478368 /nfs/dbraw/zinc/47/83/68/387478368.db2.gz NDZHARUARONRDV-ZDUSSCGKSA-N 1 1 217.356 3.615 20 0 BHADMO Cc1cc(C[N@H+](C)[C@H](C)C2(C)CC2)ccc1F ZINC000355080880 387478279 /nfs/dbraw/zinc/47/82/79/387478279.db2.gz NHAKBWAEWBYWGG-GFCCVEGCSA-N 1 1 235.346 3.755 20 0 BHADMO Cc1cc(C[N@H+](C)[C@@H](C)C2(C)CC2)ccc1F ZINC000355080881 387477857 /nfs/dbraw/zinc/47/78/57/387477857.db2.gz NHAKBWAEWBYWGG-LBPRGKRZSA-N 1 1 235.346 3.755 20 0 BHADMO Cc1cc(C[N@H+](C)[C@H](C)C2(C)CC2)c(C)s1 ZINC000355080903 387477248 /nfs/dbraw/zinc/47/72/48/387477248.db2.gz NOVYKHLHJIHNIQ-GFCCVEGCSA-N 1 1 237.412 3.985 20 0 BHADMO Cc1cc(C[N@H+](C)[C@@H](C)C2(C)CC2)c(C)s1 ZINC000355080904 387477407 /nfs/dbraw/zinc/47/74/07/387477407.db2.gz NOVYKHLHJIHNIQ-LBPRGKRZSA-N 1 1 237.412 3.985 20 0 BHADMO C[C@@H]([N@@H+](C)Cc1cccc2cc[nH]c21)C1(C)CC1 ZINC000355083774 387477637 /nfs/dbraw/zinc/47/76/37/387477637.db2.gz TZCVJPPOEJIHLD-GFCCVEGCSA-N 1 1 242.366 3.788 20 0 BHADMO C[C@H]([N@@H+](C)Cc1cccc2cc[nH]c21)C1(C)CC1 ZINC000355083775 387477081 /nfs/dbraw/zinc/47/70/81/387477081.db2.gz TZCVJPPOEJIHLD-LBPRGKRZSA-N 1 1 242.366 3.788 20 0 BHADMO CCOc1ccccc1C[N@@H+](C)[C@H](C)C1(C)CC1 ZINC000355083952 387476965 /nfs/dbraw/zinc/47/69/65/387476965.db2.gz VCPBCCDZZZUQDH-CYBMUJFWSA-N 1 1 247.382 3.706 20 0 BHADMO CCOc1ccccc1C[N@@H+](C)[C@@H](C)C1(C)CC1 ZINC000355083955 387478040 /nfs/dbraw/zinc/47/80/40/387478040.db2.gz VCPBCCDZZZUQDH-ZDUSSCGKSA-N 1 1 247.382 3.706 20 0 BHADMO CCOc1ccc(C[N@@H+](C)[C@H](C)C2(C)CC2)cc1 ZINC000355084834 387476475 /nfs/dbraw/zinc/47/64/75/387476475.db2.gz ITEGIQQQEIHCBT-CYBMUJFWSA-N 1 1 247.382 3.706 20 0 BHADMO CCOc1ccc(C[N@@H+](C)[C@@H](C)C2(C)CC2)cc1 ZINC000355084836 387477158 /nfs/dbraw/zinc/47/71/58/387477158.db2.gz ITEGIQQQEIHCBT-ZDUSSCGKSA-N 1 1 247.382 3.706 20 0 BHADMO Cc1ccccc1C[N@H+](C)[C@H](C)C1(C)CC1 ZINC000355088948 179270124 /nfs/dbraw/zinc/27/01/24/179270124.db2.gz OZNCYRROELGITK-CYBMUJFWSA-N 1 1 217.356 3.615 20 0 BHADMO Cc1ccccc1C[N@H+](C)[C@@H](C)C1(C)CC1 ZINC000355088949 179270067 /nfs/dbraw/zinc/27/00/67/179270067.db2.gz OZNCYRROELGITK-ZDUSSCGKSA-N 1 1 217.356 3.615 20 0 BHADMO CCOc1cccc(C[N@@H+](C)[C@H](C)C2(C)CC2)c1 ZINC000355088992 387478146 /nfs/dbraw/zinc/47/81/46/387478146.db2.gz PIANDWKJTKTSIB-CYBMUJFWSA-N 1 1 247.382 3.706 20 0 BHADMO CCOc1cccc(C[N@@H+](C)[C@@H](C)C2(C)CC2)c1 ZINC000355088993 387477550 /nfs/dbraw/zinc/47/75/50/387477550.db2.gz PIANDWKJTKTSIB-ZDUSSCGKSA-N 1 1 247.382 3.706 20 0 BHADMO Cc1ccc(F)c(C[N@H+](C)[C@H](C)C2(C)CC2)c1 ZINC000355090122 387477936 /nfs/dbraw/zinc/47/79/36/387477936.db2.gz RMYONFDJRNUAED-GFCCVEGCSA-N 1 1 235.346 3.755 20 0 BHADMO Cc1ccc(F)c(C[N@H+](C)[C@@H](C)C2(C)CC2)c1 ZINC000355090123 387478198 /nfs/dbraw/zinc/47/81/98/387478198.db2.gz RMYONFDJRNUAED-LBPRGKRZSA-N 1 1 235.346 3.755 20 0 BHADMO C[C@H]([N@@H+](C)Cc1c(F)cccc1F)C1(C)CC1 ZINC000355093474 387480274 /nfs/dbraw/zinc/48/02/74/387480274.db2.gz XJFGYCUYZAOYOQ-JTQLQIEISA-N 1 1 239.309 3.585 20 0 BHADMO C[C@@H]([N@@H+](C)Cc1c(F)cccc1F)C1(C)CC1 ZINC000355093476 387479733 /nfs/dbraw/zinc/47/97/33/387479733.db2.gz XJFGYCUYZAOYOQ-SNVBAGLBSA-N 1 1 239.309 3.585 20 0 BHADMO C[C@H]([N@@H+](C)Cc1cc(F)cc(F)c1)C1(C)CC1 ZINC000355093501 387479149 /nfs/dbraw/zinc/47/91/49/387479149.db2.gz XLCXNFNJFAQPKM-JTQLQIEISA-N 1 1 239.309 3.585 20 0 BHADMO C[C@@H]([N@@H+](C)Cc1cc(F)cc(F)c1)C1(C)CC1 ZINC000355093502 387479575 /nfs/dbraw/zinc/47/95/75/387479575.db2.gz XLCXNFNJFAQPKM-SNVBAGLBSA-N 1 1 239.309 3.585 20 0 BHADMO C[C@@H]1CC[N@@H+](Cc2ccsc2)C[C@@H](C)C1 ZINC000355103188 176177473 /nfs/dbraw/zinc/17/74/73/176177473.db2.gz DQOBTCFRQAKLHJ-NEPJUHHUSA-N 1 1 223.385 3.616 20 0 BHADMO C[C@H]1CC[N@@H+](Cc2ccsc2)C[C@H](C)C1 ZINC000355103202 177166303 /nfs/dbraw/zinc/16/63/03/177166303.db2.gz DQOBTCFRQAKLHJ-NWDGAFQWSA-N 1 1 223.385 3.616 20 0 BHADMO C[C@H]1CC[N@@H+](Cc2ccsc2)C[C@@H](C)C1 ZINC000355103209 177310598 /nfs/dbraw/zinc/31/05/98/177310598.db2.gz DQOBTCFRQAKLHJ-RYUDHWBXSA-N 1 1 223.385 3.616 20 0 BHADMO C[C@@H]1C[C@H](C)CC[N@@H+](Cc2ccsc2)C1 ZINC000355103210 176178247 /nfs/dbraw/zinc/17/82/47/176178247.db2.gz DQOBTCFRQAKLHJ-VXGBXAGGSA-N 1 1 223.385 3.616 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@H](C)C2(C)CC2)cc1F ZINC000355108713 411301614 /nfs/dbraw/zinc/30/16/14/411301614.db2.gz OTTARPBAYIJDAF-GFCCVEGCSA-N 1 1 235.346 3.755 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@@H](C)C2(C)CC2)cc1F ZINC000355108715 411301579 /nfs/dbraw/zinc/30/15/79/411301579.db2.gz OTTARPBAYIJDAF-LBPRGKRZSA-N 1 1 235.346 3.755 20 0 BHADMO C[C@@H]1CC[N@@H+](Cc2cc3cc(F)ccc3o2)[C@@H]1C ZINC000355112192 176173971 /nfs/dbraw/zinc/17/39/71/176173971.db2.gz NJASYTQWAPAAKU-GHMZBOCLSA-N 1 1 247.313 3.802 20 0 BHADMO C[C@@H]1CC[N@@H+](Cc2cc3cc(F)ccc3o2)[C@H]1C ZINC000355112200 385909527 /nfs/dbraw/zinc/90/95/27/385909527.db2.gz NJASYTQWAPAAKU-MNOVXSKESA-N 1 1 247.313 3.802 20 0 BHADMO C[C@H]1CC[N@@H+](Cc2cc3cc(F)ccc3o2)[C@H]1C ZINC000355112204 177163896 /nfs/dbraw/zinc/16/38/96/177163896.db2.gz NJASYTQWAPAAKU-QWRGUYRKSA-N 1 1 247.313 3.802 20 0 BHADMO C[C@@H]1[C@@H](C)CC[N@H+]1Cc1cc2cc(F)ccc2o1 ZINC000355112212 177162982 /nfs/dbraw/zinc/16/29/82/177162982.db2.gz NJASYTQWAPAAKU-WDEREUQCSA-N 1 1 247.313 3.802 20 0 BHADMO C[C@@H]1CC[N@@H+](Cc2coc3ccccc23)[C@H]1C ZINC000355116047 398331522 /nfs/dbraw/zinc/33/15/22/398331522.db2.gz RZKPXFKHAHQYJS-NEPJUHHUSA-N 1 1 229.323 3.663 20 0 BHADMO C[C@@H]1[C@@H](C)CC[N@H+]1Cc1coc2ccccc12 ZINC000355116048 177166607 /nfs/dbraw/zinc/16/66/07/177166607.db2.gz RZKPXFKHAHQYJS-NWDGAFQWSA-N 1 1 229.323 3.663 20 0 BHADMO C[C@H]1CC[N@@H+](Cc2coc3ccccc23)[C@H]1C ZINC000355116049 177167168 /nfs/dbraw/zinc/16/71/68/177167168.db2.gz RZKPXFKHAHQYJS-RYUDHWBXSA-N 1 1 229.323 3.663 20 0 BHADMO C[C@@H]1CC[N@@H+](Cc2coc3ccccc23)[C@@H]1C ZINC000355116055 176177770 /nfs/dbraw/zinc/17/77/70/176177770.db2.gz RZKPXFKHAHQYJS-VXGBXAGGSA-N 1 1 229.323 3.663 20 0 BHADMO Cc1[nH+]ccn1CCCSCC1CCCC1 ZINC000355122653 180248710 /nfs/dbraw/zinc/24/87/10/180248710.db2.gz YKGHDTPZOVHJSK-UHFFFAOYSA-N 1 1 238.400 3.505 20 0 BHADMO C[N@@H+](Cc1ccc(C(F)F)cc1)[C@@H]1CC1(C)C ZINC000355125315 387482153 /nfs/dbraw/zinc/48/21/53/387482153.db2.gz PZKFPBGQZXBPNM-GFCCVEGCSA-N 1 1 239.309 3.855 20 0 BHADMO C[N@@H+](Cc1ccc(C(F)F)cc1)[C@H]1CC1(C)C ZINC000355125328 387483034 /nfs/dbraw/zinc/48/30/34/387483034.db2.gz PZKFPBGQZXBPNM-LBPRGKRZSA-N 1 1 239.309 3.855 20 0 BHADMO CSc1ccc(C[N@H+]2CC[C@@H](C)[C@@H]2C)cc1 ZINC000355132253 387485302 /nfs/dbraw/zinc/48/53/02/387485302.db2.gz JNTGFWBCUTUFCW-NEPJUHHUSA-N 1 1 235.396 3.639 20 0 BHADMO CSc1ccc(C[N@H+]2CC[C@H](C)[C@H]2C)cc1 ZINC000355132254 387484556 /nfs/dbraw/zinc/48/45/56/387484556.db2.gz JNTGFWBCUTUFCW-NWDGAFQWSA-N 1 1 235.396 3.639 20 0 BHADMO CSc1ccc(C[N@H+]2CC[C@H](C)[C@@H]2C)cc1 ZINC000355132255 387484681 /nfs/dbraw/zinc/48/46/81/387484681.db2.gz JNTGFWBCUTUFCW-RYUDHWBXSA-N 1 1 235.396 3.639 20 0 BHADMO CSc1ccc(C[N@H+]2CC[C@@H](C)[C@H]2C)cc1 ZINC000355132256 385927217 /nfs/dbraw/zinc/92/72/17/385927217.db2.gz JNTGFWBCUTUFCW-VXGBXAGGSA-N 1 1 235.396 3.639 20 0 BHADMO Cc1ccc(CCC[N@H+](C)C2(C)CCCC2)cn1 ZINC000355132978 387484909 /nfs/dbraw/zinc/48/49/09/387484909.db2.gz ATNKENRLKWKFCT-UHFFFAOYSA-N 1 1 246.398 3.587 20 0 BHADMO Cc1cc(C[N@@H+]2CC[C@H](C)[C@H]2C)c(C)s1 ZINC000355136587 178000818 /nfs/dbraw/zinc/00/08/18/178000818.db2.gz PKHNBMXRQHKWIP-GXSJLCMTSA-N 1 1 223.385 3.595 20 0 BHADMO Cc1cc(C[N@@H+]2CC[C@@H](C)[C@@H]2C)c(C)s1 ZINC000355136591 387484326 /nfs/dbraw/zinc/48/43/26/387484326.db2.gz PKHNBMXRQHKWIP-KOLCDFICSA-N 1 1 223.385 3.595 20 0 BHADMO Cc1cc(C[N@@H+]2CC[C@@H](C)[C@H]2C)c(C)s1 ZINC000355136594 178001167 /nfs/dbraw/zinc/00/11/67/178001167.db2.gz PKHNBMXRQHKWIP-MWLCHTKSSA-N 1 1 223.385 3.595 20 0 BHADMO Cc1cc(C[N@@H+]2CC[C@H](C)[C@@H]2C)c(C)s1 ZINC000355136597 178001487 /nfs/dbraw/zinc/00/14/87/178001487.db2.gz PKHNBMXRQHKWIP-ONGXEEELSA-N 1 1 223.385 3.595 20 0 BHADMO C[C@@H]1C[C@@H]1c1ccc(C[N@H+]2CC[C@@H](C)[C@H]2C)o1 ZINC000355137065 387485575 /nfs/dbraw/zinc/48/55/75/387485575.db2.gz QMQHHVDFAUVDRT-BYNQJWBRSA-N 1 1 233.355 3.633 20 0 BHADMO C[C@@H]1C[C@@H]1c1ccc(C[N@H+]2CC[C@@H](C)[C@@H]2C)o1 ZINC000355137069 387484606 /nfs/dbraw/zinc/48/46/06/387484606.db2.gz QMQHHVDFAUVDRT-NMKXLXIOSA-N 1 1 233.355 3.633 20 0 BHADMO C[C@@H]1C[C@@H]1c1ccc(C[N@H+]2CC[C@H](C)[C@@H]2C)o1 ZINC000355137070 177163471 /nfs/dbraw/zinc/16/34/71/177163471.db2.gz QMQHHVDFAUVDRT-OPDFLTKYSA-N 1 1 233.355 3.633 20 0 BHADMO C[C@@H]1C[C@@H]1c1ccc(C[N@H+]2CC[C@H](C)[C@H]2C)o1 ZINC000355137072 177164206 /nfs/dbraw/zinc/16/42/06/177164206.db2.gz QMQHHVDFAUVDRT-SFTQSGBHSA-N 1 1 233.355 3.633 20 0 BHADMO CC(C)CC[C@@H]1CCCC[N@H+]1Cc1ccccn1 ZINC000355164953 166899051 /nfs/dbraw/zinc/89/90/51/166899051.db2.gz LJNLEPZNULLXFX-INIZCTEOSA-N 1 1 246.398 3.872 20 0 BHADMO CC(C)CC[C@H]1CCCC[N@H+]1Cc1ccccn1 ZINC000355164964 356751666 /nfs/dbraw/zinc/75/16/66/356751666.db2.gz LJNLEPZNULLXFX-MRXNPFEDSA-N 1 1 246.398 3.872 20 0 BHADMO CC(C)CC[C@@H]1CCCC[N@H+]1Cc1cccnc1 ZINC000355165824 398108395 /nfs/dbraw/zinc/10/83/95/398108395.db2.gz LTLJCYOQOHJQOC-INIZCTEOSA-N 1 1 246.398 3.872 20 0 BHADMO CC(C)CC[C@H]1CCCC[N@H+]1Cc1cccnc1 ZINC000355165826 398108585 /nfs/dbraw/zinc/10/85/85/398108585.db2.gz LTLJCYOQOHJQOC-MRXNPFEDSA-N 1 1 246.398 3.872 20 0 BHADMO CC(C)CC[C@@H]1CCCC[N@H+]1Cc1ccncc1 ZINC000355179231 387494283 /nfs/dbraw/zinc/49/42/83/387494283.db2.gz VRRCBGSKVIHSGC-INIZCTEOSA-N 1 1 246.398 3.872 20 0 BHADMO CC(C)CC[C@H]1CCCC[N@H+]1Cc1ccncc1 ZINC000355179232 356751901 /nfs/dbraw/zinc/75/19/01/356751901.db2.gz VRRCBGSKVIHSGC-MRXNPFEDSA-N 1 1 246.398 3.872 20 0 BHADMO Cc1ccsc1C[N@H+]1CCCC2(CCC2)C1 ZINC000355190654 387494523 /nfs/dbraw/zinc/49/45/23/387494523.db2.gz AFBZSHAVWOSIKR-UHFFFAOYSA-N 1 1 235.396 3.823 20 0 BHADMO Cc1ncccc1C[N@@H+]1CC=C(C(C)(C)C)CC1 ZINC000355197773 180219541 /nfs/dbraw/zinc/21/95/41/180219541.db2.gz MNCNDKYRHPUFMS-UHFFFAOYSA-N 1 1 244.382 3.568 20 0 BHADMO C[N@@H+](CCC1CC1)Cc1coc2ccccc12 ZINC000355203921 398332085 /nfs/dbraw/zinc/33/20/85/398332085.db2.gz FYUGGIGLCZDGRT-UHFFFAOYSA-N 1 1 229.323 3.665 20 0 BHADMO CCCCC[C@H]1CCC[N@H+]1Cc1ccccn1 ZINC000355206379 387497670 /nfs/dbraw/zinc/49/76/70/387497670.db2.gz ALQGOQJGSGNHIX-HNNXBMFYSA-N 1 1 232.371 3.626 20 0 BHADMO CCCCC[C@@H]1CCC[N@H+]1Cc1ccccn1 ZINC000355206382 387498291 /nfs/dbraw/zinc/49/82/91/387498291.db2.gz ALQGOQJGSGNHIX-OAHLLOKOSA-N 1 1 232.371 3.626 20 0 BHADMO CCCCC[C@H]1CCC[N@H+]1Cc1cccnc1 ZINC000355206555 387497396 /nfs/dbraw/zinc/49/73/96/387497396.db2.gz BOPFCGXSHGIXKD-HNNXBMFYSA-N 1 1 232.371 3.626 20 0 BHADMO CCCCC[C@@H]1CCC[N@H+]1Cc1cccnc1 ZINC000355206556 387497447 /nfs/dbraw/zinc/49/74/47/387497447.db2.gz BOPFCGXSHGIXKD-OAHLLOKOSA-N 1 1 232.371 3.626 20 0 BHADMO CCCCC[C@H]1CCC[N@H+]1Cc1c(C)n[nH]c1C ZINC000355206908 387498144 /nfs/dbraw/zinc/49/81/44/387498144.db2.gz CMSZXBANJHTQPM-AWEZNQCLSA-N 1 1 249.402 3.571 20 0 BHADMO CCCCC[C@@H]1CCC[N@H+]1Cc1c(C)n[nH]c1C ZINC000355206909 387496216 /nfs/dbraw/zinc/49/62/16/387496216.db2.gz CMSZXBANJHTQPM-CQSZACIVSA-N 1 1 249.402 3.571 20 0 BHADMO CCCCC[C@H]1CCC[N@H+]1Cc1ccn(C)c1 ZINC000355206958 387497987 /nfs/dbraw/zinc/49/79/87/387497987.db2.gz DCDRISSUNSRWLH-HNNXBMFYSA-N 1 1 234.387 3.570 20 0 BHADMO CCCCC[C@@H]1CCC[N@H+]1Cc1ccn(C)c1 ZINC000355206959 168740597 /nfs/dbraw/zinc/74/05/97/168740597.db2.gz DCDRISSUNSRWLH-OAHLLOKOSA-N 1 1 234.387 3.570 20 0 BHADMO C[C@@H]1C[C@H]1c1ccc(C[N@@H+](C)CCC2CC2)o1 ZINC000355207015 387497005 /nfs/dbraw/zinc/49/70/05/387497005.db2.gz DRADRJSHEAIYSS-BXUZGUMPSA-N 1 1 233.355 3.635 20 0 BHADMO C[C@H]1C[C@@H]1c1ccc(C[N@@H+](C)CCC2CC2)o1 ZINC000355207022 177352096 /nfs/dbraw/zinc/35/20/96/177352096.db2.gz DRADRJSHEAIYSS-FZMZJTMJSA-N 1 1 233.355 3.635 20 0 BHADMO C[C@@H]1C[C@@H]1c1ccc(C[N@@H+](C)CCC2CC2)o1 ZINC000355207024 387497073 /nfs/dbraw/zinc/49/70/73/387497073.db2.gz DRADRJSHEAIYSS-RISCZKNCSA-N 1 1 233.355 3.635 20 0 BHADMO C[C@H]1C[C@H]1c1ccc(C[N@@H+](C)CCC2CC2)o1 ZINC000355207027 387497561 /nfs/dbraw/zinc/49/75/61/387497561.db2.gz DRADRJSHEAIYSS-SMDDNHRTSA-N 1 1 233.355 3.635 20 0 BHADMO Cc1ccc(C[N@H+]2CCCC3(CCC3)C2)s1 ZINC000355207754 387496772 /nfs/dbraw/zinc/49/67/72/387496772.db2.gz YFRLORRAIUYMIQ-UHFFFAOYSA-N 1 1 235.396 3.823 20 0 BHADMO Cc1oc2ccccc2c1C[N@@H+](C)CCC1CC1 ZINC000355209790 385975378 /nfs/dbraw/zinc/97/53/78/385975378.db2.gz KIJKEFNRHJCFGX-UHFFFAOYSA-N 1 1 243.350 3.973 20 0 BHADMO C[C@@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1ccsc1 ZINC000355210319 387498242 /nfs/dbraw/zinc/49/82/42/387498242.db2.gz BVSNYXWIONRYML-PSASIEDQSA-N 1 1 249.301 3.521 20 0 BHADMO C[C@@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1ccsc1 ZINC000355210322 387497780 /nfs/dbraw/zinc/49/77/80/387497780.db2.gz BVSNYXWIONRYML-SCZZXKLOSA-N 1 1 249.301 3.521 20 0 BHADMO C[C@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1ccsc1 ZINC000355210325 387498435 /nfs/dbraw/zinc/49/84/35/387498435.db2.gz BVSNYXWIONRYML-WCBMZHEXSA-N 1 1 249.301 3.521 20 0 BHADMO C[C@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1ccsc1 ZINC000355210329 387497578 /nfs/dbraw/zinc/49/75/78/387497578.db2.gz BVSNYXWIONRYML-WPRPVWTQSA-N 1 1 249.301 3.521 20 0 BHADMO CSc1ccc(C[N@@H+](C)CCC2CC2)cc1 ZINC000355210799 188236499 /nfs/dbraw/zinc/23/64/99/188236499.db2.gz LYFGFTRAPVJIQG-UHFFFAOYSA-N 1 1 235.396 3.640 20 0 BHADMO C[N@@H+](CCC1CC1)Cc1cc2cc(F)ccc2o1 ZINC000355210976 387498099 /nfs/dbraw/zinc/49/80/99/387498099.db2.gz SVWFECVJVHOOEZ-UHFFFAOYSA-N 1 1 247.313 3.804 20 0 BHADMO C[N@@H+](Cc1cccs1)[C@H]1C[C@@H]1c1ccccc1 ZINC000355211935 387496532 /nfs/dbraw/zinc/49/65/32/387496532.db2.gz UOFCXVQEBXPSMC-CABCVRRESA-N 1 1 243.375 3.736 20 0 BHADMO C[N@@H+](Cc1cccs1)[C@H]1C[C@H]1c1ccccc1 ZINC000355211936 387496938 /nfs/dbraw/zinc/49/69/38/387496938.db2.gz UOFCXVQEBXPSMC-GJZGRUSLSA-N 1 1 243.375 3.736 20 0 BHADMO C[N@@H+](Cc1cccs1)[C@@H]1C[C@@H]1c1ccccc1 ZINC000355211937 387497761 /nfs/dbraw/zinc/49/77/61/387497761.db2.gz UOFCXVQEBXPSMC-HUUCEWRRSA-N 1 1 243.375 3.736 20 0 BHADMO C[N@@H+](Cc1cccs1)[C@@H]1C[C@H]1c1ccccc1 ZINC000355211938 387497275 /nfs/dbraw/zinc/49/72/75/387497275.db2.gz UOFCXVQEBXPSMC-LSDHHAIUSA-N 1 1 243.375 3.736 20 0 BHADMO C[N@@H+](CCC1CC1)Cc1cc2ccccc2o1 ZINC000355211952 387497457 /nfs/dbraw/zinc/49/74/57/387497457.db2.gz URAAOOLAHGUWGX-UHFFFAOYSA-N 1 1 229.323 3.665 20 0 BHADMO C1=CC[C@H](C[N@H+]2CCCC3(CCC3)C2)CC1 ZINC000355213058 188063934 /nfs/dbraw/zinc/06/39/34/188063934.db2.gz KUNTTYWDWKXYCJ-AWEZNQCLSA-N 1 1 219.372 3.609 20 0 BHADMO C1=CC[C@@H](C[N@H+]2CCCC3(CCC3)C2)CC1 ZINC000355213061 387497382 /nfs/dbraw/zinc/49/73/82/387497382.db2.gz KUNTTYWDWKXYCJ-CQSZACIVSA-N 1 1 219.372 3.609 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@H]2C[C@@H]2c2ccccc2)o1 ZINC000355214137 387496735 /nfs/dbraw/zinc/49/67/35/387496735.db2.gz XFQQPIHSIQETOE-CVEARBPZSA-N 1 1 241.334 3.576 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@H]2C[C@H]2c2ccccc2)o1 ZINC000355214140 178555121 /nfs/dbraw/zinc/55/51/21/178555121.db2.gz XFQQPIHSIQETOE-HOTGVXAUSA-N 1 1 241.334 3.576 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@@H]2C[C@@H]2c2ccccc2)o1 ZINC000355214143 387498521 /nfs/dbraw/zinc/49/85/21/387498521.db2.gz XFQQPIHSIQETOE-HZPDHXFCSA-N 1 1 241.334 3.576 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@@H]2C[C@H]2c2ccccc2)o1 ZINC000355214146 387497641 /nfs/dbraw/zinc/49/76/41/387497641.db2.gz XFQQPIHSIQETOE-JKSUJKDBSA-N 1 1 241.334 3.576 20 0 BHADMO Cc1ccoc1C[N@H+](C)[C@H]1C[C@@H]1c1ccccc1 ZINC000355217525 387498262 /nfs/dbraw/zinc/49/82/62/387498262.db2.gz XFRTVLLUKZOMQT-CABCVRRESA-N 1 1 241.334 3.576 20 0 BHADMO Cc1ccoc1C[N@H+](C)[C@H]1C[C@H]1c1ccccc1 ZINC000355217526 387498164 /nfs/dbraw/zinc/49/81/64/387498164.db2.gz XFRTVLLUKZOMQT-GJZGRUSLSA-N 1 1 241.334 3.576 20 0 BHADMO Cc1ccoc1C[N@H+](C)[C@@H]1C[C@@H]1c1ccccc1 ZINC000355217527 387498079 /nfs/dbraw/zinc/49/80/79/387498079.db2.gz XFRTVLLUKZOMQT-HUUCEWRRSA-N 1 1 241.334 3.576 20 0 BHADMO Cc1ccoc1C[N@H+](C)[C@@H]1C[C@H]1c1ccccc1 ZINC000355218491 387497728 /nfs/dbraw/zinc/49/77/28/387497728.db2.gz XFRTVLLUKZOMQT-LSDHHAIUSA-N 1 1 241.334 3.576 20 0 BHADMO CCCCC[C@H]1CCC[N@H+]1Cc1ccncc1 ZINC000355218750 387499203 /nfs/dbraw/zinc/49/92/03/387499203.db2.gz YNDGFZZPHSPJAK-HNNXBMFYSA-N 1 1 232.371 3.626 20 0 BHADMO CCCCC[C@@H]1CCC[N@H+]1Cc1ccncc1 ZINC000355218755 168740055 /nfs/dbraw/zinc/74/00/55/168740055.db2.gz YNDGFZZPHSPJAK-OAHLLOKOSA-N 1 1 232.371 3.626 20 0 BHADMO C[N@@H+](Cc1ccccc1)[C@@H]1C[C@H]1c1ccccc1 ZINC000355220315 387499615 /nfs/dbraw/zinc/49/96/15/387499615.db2.gz KTGBJTMLWNRCPM-DLBZAZTESA-N 1 1 237.346 3.675 20 0 BHADMO C[N@@H+](Cc1ccccc1)[C@@H]1C[C@@H]1c1ccccc1 ZINC000355220330 387499758 /nfs/dbraw/zinc/49/97/58/387499758.db2.gz KTGBJTMLWNRCPM-IAGOWNOFSA-N 1 1 237.346 3.675 20 0 BHADMO C[N@@H+](Cc1ccccc1)[C@H]1C[C@H]1c1ccccc1 ZINC000355220332 387500214 /nfs/dbraw/zinc/50/02/14/387500214.db2.gz KTGBJTMLWNRCPM-IRXDYDNUSA-N 1 1 237.346 3.675 20 0 BHADMO C[N@@H+](Cc1ccccc1)[C@H]1C[C@@H]1c1ccccc1 ZINC000355220333 387500108 /nfs/dbraw/zinc/50/01/08/387500108.db2.gz KTGBJTMLWNRCPM-SJORKVTESA-N 1 1 237.346 3.675 20 0 BHADMO Cc1cc(C[N@@H+](C)CCC2CC2)c(C)s1 ZINC000355221534 387499626 /nfs/dbraw/zinc/49/96/26/387499626.db2.gz MSOODIVKYLFZFE-UHFFFAOYSA-N 1 1 223.385 3.597 20 0 BHADMO c1cc(C[N@H+]2CCCC3(CCC3)C2)cs1 ZINC000355225345 183340307 /nfs/dbraw/zinc/34/03/07/183340307.db2.gz RZQQHJARAYWMRE-UHFFFAOYSA-N 1 1 221.369 3.514 20 0 BHADMO Fc1ccccc1C[N@@H+](CC1CC1)C1CCC1 ZINC000355253445 181011749 /nfs/dbraw/zinc/01/17/49/181011749.db2.gz LAKLNDQXJCVESQ-UHFFFAOYSA-N 1 1 233.330 3.590 20 0 BHADMO C[C@H](C1CCC1)[N@@H+](C)CCCCOC(C)(C)C ZINC000355278302 387511402 /nfs/dbraw/zinc/51/14/02/387511402.db2.gz KSAQOCSRSOVGOP-CYBMUJFWSA-N 1 1 241.419 3.702 20 0 BHADMO C[C@@H](C1CCC1)[N@@H+](C)CCCCOC(C)(C)C ZINC000355278303 387512045 /nfs/dbraw/zinc/51/20/45/387512045.db2.gz KSAQOCSRSOVGOP-ZDUSSCGKSA-N 1 1 241.419 3.702 20 0 BHADMO CCC(C)(C)[N@@H+](C)Cc1scnc1C1CC1 ZINC000355288219 538793579 /nfs/dbraw/zinc/79/35/79/538793579.db2.gz XFFIIPYFKOWZSZ-UHFFFAOYSA-N 1 1 238.400 3.641 20 0 BHADMO CCCc1csc(C[N@@H+](C)C(C)(C)CC)n1 ZINC000355291804 188237066 /nfs/dbraw/zinc/23/70/66/188237066.db2.gz NWFKZJUUDBBCLU-UHFFFAOYSA-N 1 1 240.416 3.716 20 0 BHADMO 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CCCc1[nH+]ccn1C[C@@H]1CCc2ccccc21 ZINC000355458487 386139299 /nfs/dbraw/zinc/13/92/99/386139299.db2.gz JHXDNHQPAISFGB-AWEZNQCLSA-N 1 1 240.350 3.566 20 0 BHADMO CCCc1[nH+]ccn1C[C@H]1CCc2ccccc21 ZINC000355458488 386139076 /nfs/dbraw/zinc/13/90/76/386139076.db2.gz JHXDNHQPAISFGB-CQSZACIVSA-N 1 1 240.350 3.566 20 0 BHADMO CCC(C)(C)CCn1cc[nH+]c1C(C)C ZINC000355460081 168278013 /nfs/dbraw/zinc/27/80/13/168278013.db2.gz MMNCYNWWPVNYFR-UHFFFAOYSA-N 1 1 208.349 3.833 20 0 BHADMO CC[N@@H+](CCC1CC1)Cc1cccc2[nH]ccc21 ZINC000355499322 387542840 /nfs/dbraw/zinc/54/28/40/387542840.db2.gz BQTGXBKPJOCJHV-UHFFFAOYSA-N 1 1 242.366 3.790 20 0 BHADMO CC[N@@H+](CCC1CC1)Cc1ccc(C)s1 ZINC000355503244 387544268 /nfs/dbraw/zinc/54/42/68/387544268.db2.gz FGKMUKRVOHXCKL-UHFFFAOYSA-N 1 1 223.385 3.679 20 0 BHADMO CC[N@@H+](CCC1CC1)Cc1cccc2cc[nH]c21 ZINC000355512179 387545764 /nfs/dbraw/zinc/54/57/64/387545764.db2.gz NXTUGVHWUUDUEA-UHFFFAOYSA-N 1 1 242.366 3.790 20 0 BHADMO CC[N@@H+](CCC1CC1)Cc1ccc(Cl)o1 ZINC000355513015 387545965 /nfs/dbraw/zinc/54/59/65/387545965.db2.gz MQYTXWPWILVSGX-UHFFFAOYSA-N 1 1 227.735 3.555 20 0 BHADMO C[C@@H]1CC[N@@H+](Cc2ccsc2)CC1(C)C ZINC000355513052 176177787 /nfs/dbraw/zinc/17/77/87/176177787.db2.gz MYNMXFYFKBTWQM-LLVKDONJSA-N 1 1 223.385 3.616 20 0 BHADMO C[C@H]1CC[N@@H+](Cc2ccsc2)CC1(C)C ZINC000355513054 177167346 /nfs/dbraw/zinc/16/73/46/177167346.db2.gz MYNMXFYFKBTWQM-NSHDSACASA-N 1 1 223.385 3.616 20 0 BHADMO CC[N@H+](Cc1cc(F)ccc1F)CC1CCC1 ZINC000355575664 356764601 /nfs/dbraw/zinc/76/46/01/356764601.db2.gz AROIZRJLKGFNHU-UHFFFAOYSA-N 1 1 239.309 3.587 20 0 BHADMO CC[N@H+](Cc1ccc(C)s1)CC1CCC1 ZINC000355581699 356765570 /nfs/dbraw/zinc/76/55/70/356765570.db2.gz JYCRCYMYZDZFBC-UHFFFAOYSA-N 1 1 223.385 3.679 20 0 BHADMO C[N@@H+](C/C=C\c1ccncc1)[C@@H]1CCC(C)(C)C1 ZINC000355583853 387554914 /nfs/dbraw/zinc/55/49/14/387554914.db2.gz NNKCLYQLXQIWJG-FOSCPCJNSA-N 1 1 244.382 3.605 20 0 BHADMO C[N@@H+](C/C=C/c1ccncc1)[C@@H]1CCC(C)(C)C1 ZINC000355583871 387554588 /nfs/dbraw/zinc/55/45/88/387554588.db2.gz NNKCLYQLXQIWJG-MBVDDHJVSA-N 1 1 244.382 3.605 20 0 BHADMO C[N@@H+](C/C=C/c1ccncc1)[C@H]1CCC(C)(C)C1 ZINC000355583873 387555007 /nfs/dbraw/zinc/55/50/07/387555007.db2.gz NNKCLYQLXQIWJG-RGDDUWESSA-N 1 1 244.382 3.605 20 0 BHADMO C[N@@H+](C/C=C\c1ccncc1)[C@H]1CCC(C)(C)C1 ZINC000355583875 387555068 /nfs/dbraw/zinc/55/50/68/387555068.db2.gz NNKCLYQLXQIWJG-XVWMLYKFSA-N 1 1 244.382 3.605 20 0 BHADMO CC[N@H+](Cc1sccc1C)CC1CCC1 ZINC000355584966 356765653 /nfs/dbraw/zinc/76/56/53/356765653.db2.gz QSRHGEQBIRARDU-UHFFFAOYSA-N 1 1 223.385 3.679 20 0 BHADMO Cc1ccoc1C[N@H+](C)[C@@H]1CCC(C)(C)C1 ZINC000355590298 387554831 /nfs/dbraw/zinc/55/48/31/387554831.db2.gz ZTONCIHPTCTBNC-GFCCVEGCSA-N 1 1 221.344 3.599 20 0 BHADMO Cc1ccoc1C[N@H+](C)[C@H]1CCC(C)(C)C1 ZINC000355590299 387554676 /nfs/dbraw/zinc/55/46/76/387554676.db2.gz ZTONCIHPTCTBNC-LBPRGKRZSA-N 1 1 221.344 3.599 20 0 BHADMO CC[N@H+](Cc1cccc(F)c1F)CC1CCC1 ZINC000355599695 411303556 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CC[C@H]1CC[C@H](C)[N@H+]1Cc1nc(C)c(C)s1 ZINC000357525606 397937461 /nfs/dbraw/zinc/93/74/61/397937461.db2.gz DVUGZDUTRXZHRR-CABZTGNLSA-N 1 1 238.400 3.523 20 0 BHADMO CC[C@@H]1CC[C@H](C)[N@H+]1Cc1nc(C)c(C)s1 ZINC000357525608 171053519 /nfs/dbraw/zinc/05/35/19/171053519.db2.gz DVUGZDUTRXZHRR-JOYOIKCWSA-N 1 1 238.400 3.523 20 0 BHADMO CC[C@H]1CC[C@@H](C)[N@H+]1Cc1nc(C)c(C)s1 ZINC000357525609 397937831 /nfs/dbraw/zinc/93/78/31/397937831.db2.gz DVUGZDUTRXZHRR-SKDRFNHKSA-N 1 1 238.400 3.523 20 0 BHADMO CC[C@@H]1CC[C@@H](C)[N@H+]1Cc1cccc(F)c1 ZINC000357526526 171037365 /nfs/dbraw/zinc/03/73/65/171037365.db2.gz GJQVUOJCUBYUAG-BXUZGUMPSA-N 1 1 221.319 3.589 20 0 BHADMO CC[C@H]1CC[C@H](C)[N@H+]1Cc1cccc(F)c1 ZINC000357526527 397937658 /nfs/dbraw/zinc/93/76/58/397937658.db2.gz GJQVUOJCUBYUAG-FZMZJTMJSA-N 1 1 221.319 3.589 20 0 BHADMO CC[C@H]1CC[C@@H](C)[N@H+]1Cc1cccc(F)c1 ZINC000357526528 397937253 /nfs/dbraw/zinc/93/72/53/397937253.db2.gz GJQVUOJCUBYUAG-RISCZKNCSA-N 1 1 221.319 3.589 20 0 BHADMO 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CC[C@H]1CC[C@@H](C)[N@H+]1Cc1sc(C)nc1C ZINC000357548838 386803278 /nfs/dbraw/zinc/80/32/78/386803278.db2.gz BQJAXCMQBMEJEW-SKDRFNHKSA-N 1 1 238.400 3.523 20 0 BHADMO CC[C@H]1CC[C@@H](C)[N@H+]1Cc1nc2ccccc2o1 ZINC000357550601 386805347 /nfs/dbraw/zinc/80/53/47/386805347.db2.gz GPGMZTALMWJNRH-NEPJUHHUSA-N 1 1 244.338 3.591 20 0 BHADMO CC[C@@H]1CC[C@H](C)[N@H+]1Cc1nc2ccccc2o1 ZINC000357550603 171054708 /nfs/dbraw/zinc/05/47/08/171054708.db2.gz GPGMZTALMWJNRH-NWDGAFQWSA-N 1 1 244.338 3.591 20 0 BHADMO CC[C@H]1CC[C@H](C)[N@H+]1Cc1nc2ccccc2o1 ZINC000357550604 386805272 /nfs/dbraw/zinc/80/52/72/386805272.db2.gz GPGMZTALMWJNRH-RYUDHWBXSA-N 1 1 244.338 3.591 20 0 BHADMO CC[C@@H]1CC[C@@H](C)[N@H+]1Cc1nc2ccccc2o1 ZINC000357550605 171039306 /nfs/dbraw/zinc/03/93/06/171039306.db2.gz GPGMZTALMWJNRH-VXGBXAGGSA-N 1 1 244.338 3.591 20 0 BHADMO CC[C@H]1CC[C@H](C)[N@H+]1Cc1cccc(COC)c1 ZINC000357553979 386805515 /nfs/dbraw/zinc/80/55/15/386805515.db2.gz QTAJALUNVANPPM-BBRMVZONSA-N 1 1 247.382 3.596 20 0 BHADMO CC[C@H]1CC[C@@H](C)[N@H+]1Cc1cccc(COC)c1 ZINC000357553981 386805033 /nfs/dbraw/zinc/80/50/33/386805033.db2.gz QTAJALUNVANPPM-CJNGLKHVSA-N 1 1 247.382 3.596 20 0 BHADMO CC[C@@H]1CC[C@@H](C)[N@H+]1Cc1cccc(COC)c1 ZINC000357553983 171037860 /nfs/dbraw/zinc/03/78/60/171037860.db2.gz QTAJALUNVANPPM-CZUORRHYSA-N 1 1 247.382 3.596 20 0 BHADMO CC[C@@H]1CC[C@H](C)[N@H+]1Cc1cccc(COC)c1 ZINC000357553984 171055219 /nfs/dbraw/zinc/05/52/19/171055219.db2.gz QTAJALUNVANPPM-XJKSGUPXSA-N 1 1 247.382 3.596 20 0 BHADMO CC[C@@H]1CC[C@@H](C)[N@H+]1Cc1nc(C)sc1C ZINC000357557230 171039194 /nfs/dbraw/zinc/03/91/94/171039194.db2.gz WVMKLZBJOLZXSQ-BXKDBHETSA-N 1 1 238.400 3.523 20 0 BHADMO CC[C@H]1CC[C@H](C)[N@H+]1Cc1nc(C)sc1C ZINC000357557231 386806518 /nfs/dbraw/zinc/80/65/18/386806518.db2.gz WVMKLZBJOLZXSQ-CABZTGNLSA-N 1 1 238.400 3.523 20 0 BHADMO CC[C@@H]1CC[C@H](C)[N@H+]1Cc1nc(C)sc1C ZINC000357557232 171053744 /nfs/dbraw/zinc/05/37/44/171053744.db2.gz WVMKLZBJOLZXSQ-JOYOIKCWSA-N 1 1 238.400 3.523 20 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Cc1cc([C@@H]2CCC[N@H+]2CCC2CCCC2)on1 ZINC000357612061 178240390 /nfs/dbraw/zinc/24/03/90/178240390.db2.gz VFGKOKIKGWZNKF-AWEZNQCLSA-N 1 1 248.370 3.700 20 0 BHADMO Cc1cc([C@H]2CCC[N@H+]2CCC2CCCC2)on1 ZINC000357612070 178267042 /nfs/dbraw/zinc/26/70/42/178267042.db2.gz VFGKOKIKGWZNKF-CQSZACIVSA-N 1 1 248.370 3.700 20 0 BHADMO CCC(C)(C)CC[N@@H+](Cc1ccccn1)C1CC1 ZINC000357613712 168277162 /nfs/dbraw/zinc/27/71/62/168277162.db2.gz OSUKYWNFWFEQHT-UHFFFAOYSA-N 1 1 246.398 3.872 20 0 BHADMO Cc1cccc(NCC(F)(F)c2ccccc2)[nH+]1 ZINC000357620508 179144205 /nfs/dbraw/zinc/14/42/05/179144205.db2.gz HTDXBKOAEXUTSZ-UHFFFAOYSA-N 1 1 248.276 3.594 20 0 BHADMO CCOCCC[N@H+](Cc1ccccc1)CC(C)C ZINC000357626131 170372096 /nfs/dbraw/zinc/37/20/96/170372096.db2.gz XOLQYPIGYPOKGQ-UHFFFAOYSA-N 1 1 249.398 3.571 20 0 BHADMO CC[N@@H+](CCCSC)Cc1ccccc1C ZINC000357635535 487771363 /nfs/dbraw/zinc/77/13/63/487771363.db2.gz FHFVHVGSWBYNMY-UHFFFAOYSA-N 1 1 237.412 3.570 20 0 BHADMO Cc1cc(C[N@@H+]2CCC[C@H]2C(C)C)c(C)s1 ZINC000357652677 386821119 /nfs/dbraw/zinc/82/11/19/386821119.db2.gz GAJVSLRGRKCMKP-AWEZNQCLSA-N 1 1 237.412 3.985 20 0 BHADMO Cc1cc(C[N@@H+]2CCC[C@@H]2C(C)C)c(C)s1 ZINC000357652680 386822510 /nfs/dbraw/zinc/82/25/10/386822510.db2.gz GAJVSLRGRKCMKP-CQSZACIVSA-N 1 1 237.412 3.985 20 0 BHADMO CCC[N@@H+](CCCSC)Cc1ccccc1 ZINC000357658192 169155338 /nfs/dbraw/zinc/15/53/38/169155338.db2.gz CBTWZZZJWIYLNE-UHFFFAOYSA-N 1 1 237.412 3.652 20 0 BHADMO CSCCC[N@@H+](Cc1ccccc1)C(C)C ZINC000357661450 386821937 /nfs/dbraw/zinc/82/19/37/386821937.db2.gz HNLAACKSJSAADG-UHFFFAOYSA-N 1 1 237.412 3.650 20 0 BHADMO Cc1ccc(C[N@@H+](C)CCC2CCCC2)o1 ZINC000357675602 386824171 /nfs/dbraw/zinc/82/41/71/386824171.db2.gz OWYZQAZYQKAAOB-UHFFFAOYSA-N 1 1 221.344 3.600 20 0 BHADMO CC(C)OCCC[N@@H+](C)CC1CCC(C)CC1 ZINC000357723626 168151884 /nfs/dbraw/zinc/15/18/84/168151884.db2.gz AIDFMZYSSLXCKP-UHFFFAOYSA-N 1 1 241.419 3.560 20 0 BHADMO Cc1cc(C[N@@H+]2CCC[C@H](C)[C@H]2C)c(C)s1 ZINC000357727398 386835021 /nfs/dbraw/zinc/83/50/21/386835021.db2.gz HBGQIVQVIXJGAW-CMPLNLGQSA-N 1 1 237.412 3.985 20 0 BHADMO Cc1cc(C[N@@H+]2CCC[C@H](C)[C@@H]2C)c(C)s1 ZINC000357727400 386834006 /nfs/dbraw/zinc/83/40/06/386834006.db2.gz HBGQIVQVIXJGAW-JQWIXIFHSA-N 1 1 237.412 3.985 20 0 BHADMO Cc1cc(C[N@@H+]2CCC[C@@H](C)[C@@H]2C)c(C)s1 ZINC000357727402 177989821 /nfs/dbraw/zinc/98/98/21/177989821.db2.gz HBGQIVQVIXJGAW-PWSUYJOCSA-N 1 1 237.412 3.985 20 0 BHADMO Cc1cc(C[N@@H+]2CCC[C@@H](C)[C@H]2C)c(C)s1 ZINC000357727404 386833261 /nfs/dbraw/zinc/83/32/61/386833261.db2.gz HBGQIVQVIXJGAW-ZYHUDNBSSA-N 1 1 237.412 3.985 20 0 BHADMO Cc1ccc(NCc2ccc(C3CC3)cc2)[nH+]c1 ZINC000357758372 386841206 /nfs/dbraw/zinc/84/12/06/386841206.db2.gz QOBNTVNZALGBSE-UHFFFAOYSA-N 1 1 238.334 3.880 20 0 BHADMO Cc1cccc(C[N@H+]2CCC3(C2)CCCCC3)n1 ZINC000357765910 179074466 /nfs/dbraw/zinc/07/44/66/179074466.db2.gz SYAGJESREDQQPO-UHFFFAOYSA-N 1 1 244.382 3.546 20 0 BHADMO C[C@H](c1cccnc1)[N@H+]1CCCC(C)(C)CC1 ZINC000357778083 177045238 /nfs/dbraw/zinc/04/52/38/177045238.db2.gz GYXREDPOFVSVPJ-CYBMUJFWSA-N 1 1 232.371 3.655 20 0 BHADMO C[C@@H](c1cccnc1)[N@H+]1CCCC(C)(C)CC1 ZINC000357778084 176029166 /nfs/dbraw/zinc/02/91/66/176029166.db2.gz GYXREDPOFVSVPJ-ZDUSSCGKSA-N 1 1 232.371 3.655 20 0 BHADMO CC[N@@H+](C1CC1)C1CC(c2ccccc2C)C1 ZINC000357814496 386847583 /nfs/dbraw/zinc/84/75/83/386847583.db2.gz XLGXHJCKXPPQGS-UHFFFAOYSA-N 1 1 229.367 3.725 20 0 BHADMO CCOCCC[N@H+]1CCCC[C@H]1c1ccccc1 ZINC000358014356 711952170 /nfs/dbraw/zinc/95/21/70/711952170.db2.gz GCMQOBPZHYGGAP-INIZCTEOSA-N 1 1 247.382 3.640 20 0 BHADMO CCOCCC[N@H+]1CCCC[C@@H]1c1ccccc1 ZINC000358014357 711952242 /nfs/dbraw/zinc/95/22/42/711952242.db2.gz GCMQOBPZHYGGAP-MRXNPFEDSA-N 1 1 247.382 3.640 20 0 BHADMO CSc1ccccc1C[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000358027804 384531880 /nfs/dbraw/zinc/53/18/80/384531880.db2.gz CUZZQZZJCPLLOB-TXEJJXNPSA-N 1 1 235.396 3.781 20 0 BHADMO CSc1ccccc1C[N@H+]1CCC2(CCC2)C1 ZINC000358027952 386881736 /nfs/dbraw/zinc/88/17/36/386881736.db2.gz DLLYTZGRCKRMTK-UHFFFAOYSA-N 1 1 247.407 3.785 20 0 BHADMO CSc1ccccc1C[N@@H+]1CC=C(C)CC1 ZINC000358030250 386881504 /nfs/dbraw/zinc/88/15/04/386881504.db2.gz GKSZGGCAGZETQM-UHFFFAOYSA-N 1 1 233.380 3.561 20 0 BHADMO CSc1ccccc1C[N@@H+](C)CCC1CC1 ZINC000358035997 386883903 /nfs/dbraw/zinc/88/39/03/386883903.db2.gz ONUGTXPZEKCWNJ-UHFFFAOYSA-N 1 1 235.396 3.640 20 0 BHADMO CSc1ccccc1C[N@H+]1CC[C@@H](C)[C@@H]1C ZINC000358037559 386883519 /nfs/dbraw/zinc/88/35/19/386883519.db2.gz QWFWDRDSJXUNBS-NEPJUHHUSA-N 1 1 235.396 3.639 20 0 BHADMO CSc1ccccc1C[N@H+]1CC[C@H](C)[C@H]1C ZINC000358037560 386883490 /nfs/dbraw/zinc/88/34/90/386883490.db2.gz QWFWDRDSJXUNBS-NWDGAFQWSA-N 1 1 235.396 3.639 20 0 BHADMO CSc1ccccc1C[N@H+]1CC[C@H](C)[C@@H]1C ZINC000358037561 386883653 /nfs/dbraw/zinc/88/36/53/386883653.db2.gz QWFWDRDSJXUNBS-RYUDHWBXSA-N 1 1 235.396 3.639 20 0 BHADMO CSc1ccccc1C[N@H+]1CC[C@@H](C)[C@H]1C ZINC000358037562 386883372 /nfs/dbraw/zinc/88/33/72/386883372.db2.gz QWFWDRDSJXUNBS-VXGBXAGGSA-N 1 1 235.396 3.639 20 0 BHADMO CSCC[N@H+]1CCCC[C@H]1c1ccccc1 ZINC000358037729 386884187 /nfs/dbraw/zinc/88/41/87/386884187.db2.gz MRZZVDNIRCNZSE-AWEZNQCLSA-N 1 1 235.396 3.577 20 0 BHADMO CSCC[N@H+]1CCCC[C@@H]1c1ccccc1 ZINC000358037732 386883566 /nfs/dbraw/zinc/88/35/66/386883566.db2.gz MRZZVDNIRCNZSE-CQSZACIVSA-N 1 1 235.396 3.577 20 0 BHADMO CCC[N@@H+](CC)Cc1ccccc1SC ZINC000358042202 169129528 /nfs/dbraw/zinc/12/95/28/169129528.db2.gz YQFCFXAXJALHIJ-UHFFFAOYSA-N 1 1 223.385 3.640 20 0 BHADMO Cc1[nH+]ccn1Cc1ccc(SC(C)C)cc1 ZINC000358042764 180269857 /nfs/dbraw/zinc/26/98/57/180269857.db2.gz ZQVKYEQKODPYGV-UHFFFAOYSA-N 1 1 246.379 3.740 20 0 BHADMO CSc1ccccc1C[N@@H+](C(C)C)C1CC1 ZINC000358044333 386882749 /nfs/dbraw/zinc/88/27/49/386882749.db2.gz GBKHSDIMZKRUNY-UHFFFAOYSA-N 1 1 235.396 3.781 20 0 BHADMO CSc1ccccc1C[N@H+]1CCCC[C@H]1C ZINC000358047561 386883622 /nfs/dbraw/zinc/88/36/22/386883622.db2.gz KOIBLGYTRZDURN-GFCCVEGCSA-N 1 1 235.396 3.783 20 0 BHADMO CSc1ccccc1C[N@H+]1CCCC[C@@H]1C ZINC000358047562 386883858 /nfs/dbraw/zinc/88/38/58/386883858.db2.gz KOIBLGYTRZDURN-LBPRGKRZSA-N 1 1 235.396 3.783 20 0 BHADMO CSc1ccccc1C[N@@H+](C)Cc1ccoc1 ZINC000358049746 386885089 /nfs/dbraw/zinc/88/50/89/386885089.db2.gz VIHOGNTXOZDNAX-UHFFFAOYSA-N 1 1 247.363 3.634 20 0 BHADMO CSc1ccccc1C[N@H+](C)Cc1ccoc1 ZINC000358049746 386885085 /nfs/dbraw/zinc/88/50/85/386885085.db2.gz VIHOGNTXOZDNAX-UHFFFAOYSA-N 1 1 247.363 3.634 20 0 BHADMO CC[N@@H+](Cc1ccccc1SC)C(C)C ZINC000358053615 356859193 /nfs/dbraw/zinc/85/91/93/356859193.db2.gz VUSMNMGXIDYRNO-UHFFFAOYSA-N 1 1 223.385 3.639 20 0 BHADMO CC[C@@H]1CCC[N@H+]1Cc1ccccc1SC ZINC000358055989 356859159 /nfs/dbraw/zinc/85/91/59/356859159.db2.gz BAGHDWZWMJVUBU-CYBMUJFWSA-N 1 1 235.396 3.783 20 0 BHADMO CC[C@H]1CCC[N@H+]1Cc1ccccc1SC ZINC000358055990 386886676 /nfs/dbraw/zinc/88/66/76/386886676.db2.gz BAGHDWZWMJVUBU-ZDUSSCGKSA-N 1 1 235.396 3.783 20 0 BHADMO CCC[N@@H+](Cc1ccccc1SC)C1CC1 ZINC000358059364 169179902 /nfs/dbraw/zinc/17/99/02/169179902.db2.gz DZMADAKRWMAEPM-UHFFFAOYSA-N 1 1 235.396 3.783 20 0 BHADMO CSc1ccccc1C[N@H+]1CCCC1(C)C ZINC000358061343 386886225 /nfs/dbraw/zinc/88/62/25/386886225.db2.gz HZDUJGRKVAPQTL-UHFFFAOYSA-N 1 1 235.396 3.783 20 0 BHADMO CSc1ccccc1C[N@H+]1CCC[C@@H](C)C1 ZINC000358063154 386885225 /nfs/dbraw/zinc/88/52/25/386885225.db2.gz JIRGFUDREPZQFK-GFCCVEGCSA-N 1 1 235.396 3.640 20 0 BHADMO CSc1ccccc1C[N@H+]1CCC[C@H](C)C1 ZINC000358063157 386885257 /nfs/dbraw/zinc/88/52/57/386885257.db2.gz JIRGFUDREPZQFK-LBPRGKRZSA-N 1 1 235.396 3.640 20 0 BHADMO CSc1ccccc1C[N@@H+](C)CC1CCC1 ZINC000358064170 386886166 /nfs/dbraw/zinc/88/61/66/386886166.db2.gz KZUWZBSKOHNCFC-UHFFFAOYSA-N 1 1 235.396 3.640 20 0 BHADMO CSc1ccccc1C[N@H+]1CC[C@@H](C2CC2)C1 ZINC000358066302 386887856 /nfs/dbraw/zinc/88/78/56/386887856.db2.gz UGLFKDIRQMEPDG-CYBMUJFWSA-N 1 1 247.407 3.640 20 0 BHADMO CSc1ccccc1C[N@H+]1CC[C@H](C2CC2)C1 ZINC000358066303 386888094 /nfs/dbraw/zinc/88/80/94/386888094.db2.gz UGLFKDIRQMEPDG-ZDUSSCGKSA-N 1 1 247.407 3.640 20 0 BHADMO CC[N@H+](Cc1ccccc1SC)CC1CC1 ZINC000358066907 356859498 /nfs/dbraw/zinc/85/94/98/356859498.db2.gz OLPKQGLJWGZMBX-UHFFFAOYSA-N 1 1 235.396 3.640 20 0 BHADMO CSc1ccccc1C[N@H+]1CCC(C)(C)C1 ZINC000358069045 386888826 /nfs/dbraw/zinc/88/88/26/386888826.db2.gz RMQDEJNHWKHREA-UHFFFAOYSA-N 1 1 235.396 3.640 20 0 BHADMO CC(C)Sc1ccc(C[N@@H+](C)C2CC2)cc1 ZINC000358071253 167337606 /nfs/dbraw/zinc/33/76/06/167337606.db2.gz WWBPKVMMPKYRMW-UHFFFAOYSA-N 1 1 235.396 3.781 20 0 BHADMO CC[N@@H+](Cc1ccccc1SC)C1CCC1 ZINC000358072682 356860732 /nfs/dbraw/zinc/86/07/32/356860732.db2.gz YVAJXXCHYNUMGA-UHFFFAOYSA-N 1 1 235.396 3.783 20 0 BHADMO CSc1ccccc1Cn1cc[nH+]c1C(C)C ZINC000358257279 386921146 /nfs/dbraw/zinc/92/11/46/386921146.db2.gz BVGIVDHTQABYCO-UHFFFAOYSA-N 1 1 246.379 3.777 20 0 BHADMO CCCc1[nH+]ccn1Cc1ccccc1SC ZINC000358262408 386923786 /nfs/dbraw/zinc/92/37/86/386923786.db2.gz 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20 0 BHADMO CCC1CCC([N@@H+](C)CCc2cccnc2)CC1 ZINC000358969464 387040283 /nfs/dbraw/zinc/04/02/83/387040283.db2.gz AZWRJXGWDOSPOT-UHFFFAOYSA-N 1 1 246.398 3.525 20 0 BHADMO CC(C)(C)C[C@@H]1CCC[N@H+]1CCc1cccnc1 ZINC000358981583 166600595 /nfs/dbraw/zinc/60/05/95/166600595.db2.gz OBTILFDGRKOCKS-HNNXBMFYSA-N 1 1 246.398 3.525 20 0 BHADMO CC(C)(C)C[C@H]1CCC[N@H+]1CCc1cccnc1 ZINC000358981586 387040654 /nfs/dbraw/zinc/04/06/54/387040654.db2.gz OBTILFDGRKOCKS-OAHLLOKOSA-N 1 1 246.398 3.525 20 0 BHADMO CCC[N@H+]1CCC[C@@H]1c1ccc(C)s1 ZINC000359100748 169198376 /nfs/dbraw/zinc/19/83/76/169198376.db2.gz PPLLAQBUCYLPRF-LLVKDONJSA-N 1 1 209.358 3.603 20 0 BHADMO CCC[N@H+]1CCC[C@H]1c1ccc(C)s1 ZINC000359100751 169200123 /nfs/dbraw/zinc/20/01/23/169200123.db2.gz PPLLAQBUCYLPRF-NSHDSACASA-N 1 1 209.358 3.603 20 0 BHADMO CC(C)c1[nH+]ccn1C[C@H]1C[C@H]1c1ccccc1 ZINC000359165102 387062470 /nfs/dbraw/zinc/06/24/70/387062470.db2.gz PNWPWIYUVGPXRO-CABCVRRESA-N 1 1 240.350 3.810 20 0 BHADMO CC(C)c1[nH+]ccn1C[C@@H]1C[C@H]1c1ccccc1 ZINC000359165103 387062841 /nfs/dbraw/zinc/06/28/41/387062841.db2.gz PNWPWIYUVGPXRO-GJZGRUSLSA-N 1 1 240.350 3.810 20 0 BHADMO CC(C)c1[nH+]ccn1C[C@H]1C[C@@H]1c1ccccc1 ZINC000359165104 387063234 /nfs/dbraw/zinc/06/32/34/387063234.db2.gz PNWPWIYUVGPXRO-HUUCEWRRSA-N 1 1 240.350 3.810 20 0 BHADMO CC(C)c1[nH+]ccn1C[C@@H]1C[C@@H]1c1ccccc1 ZINC000359165105 387062419 /nfs/dbraw/zinc/06/24/19/387062419.db2.gz PNWPWIYUVGPXRO-LSDHHAIUSA-N 1 1 240.350 3.810 20 0 BHADMO CCCc1[nH+]ccn1C[C@H]1C[C@H]1c1ccccc1 ZINC000359180965 387064738 /nfs/dbraw/zinc/06/47/38/387064738.db2.gz WSFGZVJIUGUPLB-CABCVRRESA-N 1 1 240.350 3.639 20 0 BHADMO CCCc1[nH+]ccn1C[C@@H]1C[C@H]1c1ccccc1 ZINC000359180966 387064746 /nfs/dbraw/zinc/06/47/46/387064746.db2.gz WSFGZVJIUGUPLB-GJZGRUSLSA-N 1 1 240.350 3.639 20 0 BHADMO CCCc1[nH+]ccn1C[C@H]1C[C@@H]1c1ccccc1 ZINC000359180967 387064695 /nfs/dbraw/zinc/06/46/95/387064695.db2.gz WSFGZVJIUGUPLB-HUUCEWRRSA-N 1 1 240.350 3.639 20 0 BHADMO CCCc1[nH+]ccn1C[C@@H]1C[C@@H]1c1ccccc1 ZINC000359180968 387064609 /nfs/dbraw/zinc/06/46/09/387064609.db2.gz WSFGZVJIUGUPLB-LSDHHAIUSA-N 1 1 240.350 3.639 20 0 BHADMO c1coc(CCNc2cc[nH+]c3ccsc32)c1 ZINC000359237029 387071673 /nfs/dbraw/zinc/07/16/73/387071673.db2.gz XFZZZEIWPLDAMR-UHFFFAOYSA-N 1 1 244.319 3.544 20 0 BHADMO Cc1ccoc1C[N@@H+]1CC[C@]2(CC[C@@H](C)C2)C1 ZINC000359289850 387078886 /nfs/dbraw/zinc/07/88/86/387078886.db2.gz BECFGGMCLOIIDD-DOMZBBRYSA-N 1 1 233.355 3.600 20 0 BHADMO Cc1ccoc1C[N@@H+]1CC[C@@]2(CC[C@@H](C)C2)C1 ZINC000359289871 387079298 /nfs/dbraw/zinc/07/92/98/387079298.db2.gz BECFGGMCLOIIDD-IUODEOHRSA-N 1 1 233.355 3.600 20 0 BHADMO Cc1ccoc1C[N@@H+]1CC[C@@]2(CC[C@H](C)C2)C1 ZINC000359289875 387078914 /nfs/dbraw/zinc/07/89/14/387078914.db2.gz BECFGGMCLOIIDD-SWLSCSKDSA-N 1 1 233.355 3.600 20 0 BHADMO Cc1ccoc1C[N@@H+]1CC[C@]2(CC[C@H](C)C2)C1 ZINC000359289878 387078720 /nfs/dbraw/zinc/07/87/20/387078720.db2.gz BECFGGMCLOIIDD-WFASDCNBSA-N 1 1 233.355 3.600 20 0 BHADMO Cc1ccc(C[N@@H+]2CC[C@]3(CC[C@@H](C)C3)C2)o1 ZINC000359301467 387081319 /nfs/dbraw/zinc/08/13/19/387081319.db2.gz NIVXSOKAEGHJAL-DOMZBBRYSA-N 1 1 233.355 3.600 20 0 BHADMO Cc1ccc(C[N@@H+]2CC[C@@]3(CC[C@@H](C)C3)C2)o1 ZINC000359301469 387081481 /nfs/dbraw/zinc/08/14/81/387081481.db2.gz NIVXSOKAEGHJAL-IUODEOHRSA-N 1 1 233.355 3.600 20 0 BHADMO Cc1ccc(C[N@@H+]2CC[C@@]3(CC[C@H](C)C3)C2)o1 ZINC000359301470 387081794 /nfs/dbraw/zinc/08/17/94/387081794.db2.gz NIVXSOKAEGHJAL-SWLSCSKDSA-N 1 1 233.355 3.600 20 0 BHADMO Cc1ccc(C[N@@H+]2CC[C@]3(CC[C@H](C)C3)C2)o1 ZINC000359301472 387080443 /nfs/dbraw/zinc/08/04/43/387080443.db2.gz NIVXSOKAEGHJAL-WFASDCNBSA-N 1 1 233.355 3.600 20 0 BHADMO C[C@H]1CC[C@@]2(CC[N@@H+](Cc3cccs3)C2)C1 ZINC000359309434 177196771 /nfs/dbraw/zinc/19/67/71/177196771.db2.gz RDCJCAPXWLAFPA-GXTWGEPZSA-N 1 1 235.396 3.760 20 0 BHADMO C[C@H]1CC[C@]2(CC[N@@H+](Cc3cccs3)C2)C1 ZINC000359309438 177208454 /nfs/dbraw/zinc/20/84/54/177208454.db2.gz RDCJCAPXWLAFPA-JSGCOSHPSA-N 1 1 235.396 3.760 20 0 BHADMO C[C@@H]1CC[C@]2(CC[N@@H+](Cc3cccs3)C2)C1 ZINC000359309441 176238071 /nfs/dbraw/zinc/23/80/71/176238071.db2.gz RDCJCAPXWLAFPA-OCCSQVGLSA-N 1 1 235.396 3.760 20 0 BHADMO C[C@@H]1CC[C@@]2(CC[N@@H+](Cc3cccs3)C2)C1 ZINC000359309446 176218897 /nfs/dbraw/zinc/21/88/97/176218897.db2.gz RDCJCAPXWLAFPA-TZMCWYRMSA-N 1 1 235.396 3.760 20 0 BHADMO C[C@H]1CC[C@@]2(CC[N@@H+](Cc3ccsc3)C2)C1 ZINC000359316243 177196475 /nfs/dbraw/zinc/19/64/75/177196475.db2.gz YRUZCHCCYWQRET-GXTWGEPZSA-N 1 1 235.396 3.760 20 0 BHADMO C[C@H]1CC[C@]2(CC[N@@H+](Cc3ccsc3)C2)C1 ZINC000359316246 177208590 /nfs/dbraw/zinc/20/85/90/177208590.db2.gz YRUZCHCCYWQRET-JSGCOSHPSA-N 1 1 235.396 3.760 20 0 BHADMO C[C@@H]1CC[C@]2(CC[N@@H+](Cc3ccsc3)C2)C1 ZINC000359316248 176238813 /nfs/dbraw/zinc/23/88/13/176238813.db2.gz YRUZCHCCYWQRET-OCCSQVGLSA-N 1 1 235.396 3.760 20 0 BHADMO C[C@@H]1CC[C@@]2(CC[N@@H+](Cc3ccsc3)C2)C1 ZINC000359316254 176218890 /nfs/dbraw/zinc/21/88/90/176218890.db2.gz YRUZCHCCYWQRET-TZMCWYRMSA-N 1 1 235.396 3.760 20 0 BHADMO Cc1cccc([C@@H](C)[N@H+]2CCC=C(F)C2)c1 ZINC000359513451 179179355 /nfs/dbraw/zinc/17/93/55/179179355.db2.gz GSSRLNKNJGMWGD-GFCCVEGCSA-N 1 1 219.303 3.615 20 0 BHADMO Cc1cccc([C@@H](C)[N@@H+]2CCC=C(F)C2)c1 ZINC000359513451 179179350 /nfs/dbraw/zinc/17/93/50/179179350.db2.gz GSSRLNKNJGMWGD-GFCCVEGCSA-N 1 1 219.303 3.615 20 0 BHADMO Cc1cccc([C@H](C)[N@H+]2CCC=C(F)C2)c1 ZINC000359513454 179193167 /nfs/dbraw/zinc/19/31/67/179193167.db2.gz GSSRLNKNJGMWGD-LBPRGKRZSA-N 1 1 219.303 3.615 20 0 BHADMO Cc1cccc([C@H](C)[N@@H+]2CCC=C(F)C2)c1 ZINC000359513454 179193164 /nfs/dbraw/zinc/19/31/64/179193164.db2.gz GSSRLNKNJGMWGD-LBPRGKRZSA-N 1 1 219.303 3.615 20 0 BHADMO CC[C@@H](c1ccccc1)[N@H+]1CCC=C(F)C1 ZINC000359517572 356890249 /nfs/dbraw/zinc/89/02/49/356890249.db2.gz XEMHCFHVBHNLGT-AWEZNQCLSA-N 1 1 219.303 3.697 20 0 BHADMO CC[C@H](c1ccccc1)[N@H+]1CCC=C(F)C1 ZINC000359517574 387115512 /nfs/dbraw/zinc/11/55/12/387115512.db2.gz XEMHCFHVBHNLGT-CQSZACIVSA-N 1 1 219.303 3.697 20 0 BHADMO C[C@H](c1ccccn1)[N@H+]1CC[C@]2(CC[C@@H](C)C2)C1 ZINC000359538409 176238204 /nfs/dbraw/zinc/23/82/04/176238204.db2.gz AYJKVZBUPZRADD-FMKPAKJESA-N 1 1 244.382 3.655 20 0 BHADMO C[C@H](c1ccccn1)[N@H+]1CC[C@@]2(CC[C@@H](C)C2)C1 ZINC000359538411 176219080 /nfs/dbraw/zinc/21/90/80/176219080.db2.gz AYJKVZBUPZRADD-IIAWOOMASA-N 1 1 244.382 3.655 20 0 BHADMO Cc1cnc([C@H](C)[N@H+]2CC[C@@]3(CC[C@H](C)C3)C2)o1 ZINC000359552690 387121296 /nfs/dbraw/zinc/12/12/96/387121296.db2.gz GNEHWECCFWQEOX-CORIIIEPSA-N 1 1 248.370 3.556 20 0 BHADMO Cc1cnc([C@H](C)[N@H+]2CC[C@@]3(CC[C@@H](C)C3)C2)o1 ZINC000359552691 387121651 /nfs/dbraw/zinc/12/16/51/387121651.db2.gz GNEHWECCFWQEOX-OSAQELSMSA-N 1 1 248.370 3.556 20 0 BHADMO Cc1cnc([C@H](C)[N@H+]2CC[C@]3(CC[C@H](C)C3)C2)o1 ZINC000359552692 387121725 /nfs/dbraw/zinc/12/17/25/387121725.db2.gz GNEHWECCFWQEOX-WHOFXGATSA-N 1 1 248.370 3.556 20 0 BHADMO Cc1cnc([C@H](C)[N@H+]2CC[C@]3(CC[C@@H](C)C3)C2)o1 ZINC000359552693 387122119 /nfs/dbraw/zinc/12/21/19/387122119.db2.gz GNEHWECCFWQEOX-ZLDLUXBVSA-N 1 1 248.370 3.556 20 0 BHADMO C[C@H](c1cccnc1)[N@H+]1CC[C@]2(CC[C@@H](C)C2)C1 ZINC000359554735 176238211 /nfs/dbraw/zinc/23/82/11/176238211.db2.gz JNDSOACGIJKEFI-FMKPAKJESA-N 1 1 244.382 3.655 20 0 BHADMO C[C@H](c1cccnc1)[N@H+]1CC[C@@]2(CC[C@@H](C)C2)C1 ZINC000359554736 176218357 /nfs/dbraw/zinc/21/83/57/176218357.db2.gz JNDSOACGIJKEFI-IIAWOOMASA-N 1 1 244.382 3.655 20 0 BHADMO C[C@@H](c1cccnc1)[N@H+]1CC[C@@]2(CC[C@@H](C)C2)C1 ZINC000359554738 176029956 /nfs/dbraw/zinc/02/99/56/176029956.db2.gz JNDSOACGIJKEFI-IJEWVQPXSA-N 1 1 244.382 3.655 20 0 BHADMO C[C@@H](c1cccnc1)[N@H+]1CC[C@]2(CC[C@@H](C)C2)C1 ZINC000359554739 176030598 /nfs/dbraw/zinc/03/05/98/176030598.db2.gz JNDSOACGIJKEFI-YCPHGPKFSA-N 1 1 244.382 3.655 20 0 BHADMO CC1=CC[N@@H+](Cc2ccc(C(F)F)cc2)CC1 ZINC000359575210 168116272 /nfs/dbraw/zinc/11/62/72/168116272.db2.gz COKVRYSSLSTDHX-UHFFFAOYSA-N 1 1 237.293 3.776 20 0 BHADMO C[C@@]1(F)CC[N@@H+](Cc2ccc(C(F)F)cc2)C1 ZINC000359583359 490127762 /nfs/dbraw/zinc/12/77/62/490127762.db2.gz PHWROKSWQFEDNS-CYBMUJFWSA-N 1 1 243.272 3.558 20 0 BHADMO C[C@]1(F)CC[N@@H+](Cc2ccc(C(F)F)cc2)C1 ZINC000359583360 387128348 /nfs/dbraw/zinc/12/83/48/387128348.db2.gz PHWROKSWQFEDNS-ZDUSSCGKSA-N 1 1 243.272 3.558 20 0 BHADMO CC(C)C[N@@H+](C)Cc1ccc(C(F)F)cc1 ZINC000359592919 166939120 /nfs/dbraw/zinc/93/91/20/166939120.db2.gz AIESROZQIUYHEC-UHFFFAOYSA-N 1 1 227.298 3.712 20 0 BHADMO CC[N@@H+](Cc1ccc(C(F)F)cc1)C1CCC1 ZINC000359594233 356891512 /nfs/dbraw/zinc/89/15/12/356891512.db2.gz CJAVGJJUMIVXRD-UHFFFAOYSA-N 1 1 239.309 3.999 20 0 BHADMO FC(F)c1ccc(C[N@H+]2CCC23CCC3)cc1 ZINC000359600094 384290143 /nfs/dbraw/zinc/29/01/43/384290143.db2.gz MLOPVCVGIIQIIP-UHFFFAOYSA-N 1 1 237.293 3.753 20 0 BHADMO Cc1cccc(N[C@@H](C)CCCC(F)(F)F)[nH+]1 ZINC000359635421 179153094 /nfs/dbraw/zinc/15/30/94/179153094.db2.gz FHQVFIDIOUPBHU-JTQLQIEISA-N 1 1 246.276 3.923 20 0 BHADMO Cc1cccc(N[C@H](C)CCCC(F)(F)F)[nH+]1 ZINC000359635431 179156085 /nfs/dbraw/zinc/15/60/85/179156085.db2.gz FHQVFIDIOUPBHU-SNVBAGLBSA-N 1 1 246.276 3.923 20 0 BHADMO Fc1ccc(C[N@@H+](CCC2CC2)C2CC2)cc1 ZINC000359843540 387175176 /nfs/dbraw/zinc/17/51/76/387175176.db2.gz MLGVBULELDDXKL-UHFFFAOYSA-N 1 1 233.330 3.590 20 0 BHADMO Cc1ccc(C[N@@H+](C)CC2CCCCC2)c(C)n1 ZINC000359849014 387175931 /nfs/dbraw/zinc/17/59/31/387175931.db2.gz RSHDOZUMJPIFFU-UHFFFAOYSA-N 1 1 246.398 3.711 20 0 BHADMO Cc1ccc(C[N@H+](C)C2CCCCCC2)c(C)n1 ZINC000359849292 387176533 /nfs/dbraw/zinc/17/65/33/387176533.db2.gz UHCNFSJGBXWFBE-UHFFFAOYSA-N 1 1 246.398 3.853 20 0 BHADMO Fc1cccc(C[N@@H+](CCC2CC2)C2CC2)c1 ZINC000359850081 387176785 /nfs/dbraw/zinc/17/67/85/387176785.db2.gz JBMBYSHUHKUNEQ-UHFFFAOYSA-N 1 1 233.330 3.590 20 0 BHADMO CCC(CC)C[N@@H+](CC)Cc1ccc(C)nc1C ZINC000359852865 168349928 /nfs/dbraw/zinc/34/99/28/168349928.db2.gz YZJUDYLNSBQEAK-UHFFFAOYSA-N 1 1 248.414 3.957 20 0 BHADMO C1=CC[C@]2(CC1)CCC[N@H+](CCC1CC1)C2 ZINC000359854226 487790455 /nfs/dbraw/zinc/79/04/55/487790455.db2.gz HIVYWSKHOVAXRR-HNNXBMFYSA-N 1 1 219.372 3.609 20 0 BHADMO C1=CC[C@@]2(CC1)CCC[N@H+](CCC1CC1)C2 ZINC000359854301 487790739 /nfs/dbraw/zinc/79/07/39/487790739.db2.gz HIVYWSKHOVAXRR-OAHLLOKOSA-N 1 1 219.372 3.609 20 0 BHADMO Fc1ccccc1C[N@@H+](CCC1CC1)C1CC1 ZINC000359854751 181012199 /nfs/dbraw/zinc/01/21/99/181012199.db2.gz QMVJTBDJPAKISV-UHFFFAOYSA-N 1 1 233.330 3.590 20 0 BHADMO Cc1ccc(C[N@H+]2CCCC(C)(C)CC2)c(C)n1 ZINC000359855779 487790326 /nfs/dbraw/zinc/79/03/26/487790326.db2.gz KOWNSAVLZUBDMO-UHFFFAOYSA-N 1 1 246.398 3.711 20 0 BHADMO CC[C@H]1CCC[N@@H+](Cc2ccc(C)nc2C)CC1 ZINC000359857075 397959436 /nfs/dbraw/zinc/95/94/36/397959436.db2.gz NAHPGCGXFRFUFW-HNNXBMFYSA-N 1 1 246.398 3.711 20 0 BHADMO CC[C@@H]1CCC[N@@H+](Cc2ccc(C)nc2C)CC1 ZINC000359857077 356895784 /nfs/dbraw/zinc/89/57/84/356895784.db2.gz NAHPGCGXFRFUFW-OAHLLOKOSA-N 1 1 246.398 3.711 20 0 BHADMO 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Cc1ccc(C[N@@H+]2CCCC[C@H]2C(C)C)c(C)n1 ZINC000359861768 387179680 /nfs/dbraw/zinc/17/96/80/387179680.db2.gz ZVKBFHQYSRTAGR-INIZCTEOSA-N 1 1 246.398 3.709 20 0 BHADMO Cc1ccc(C[N@@H+]2CCCC[C@@H]2C(C)C)c(C)n1 ZINC000359861769 387179033 /nfs/dbraw/zinc/17/90/33/387179033.db2.gz ZVKBFHQYSRTAGR-MRXNPFEDSA-N 1 1 246.398 3.709 20 0 BHADMO Cc1ccc(C[N@H+]2C[C@@H](C)CCC[C@H]2C)c(C)n1 ZINC000359887800 387184919 /nfs/dbraw/zinc/18/49/19/387184919.db2.gz QLMRDUJQJJDWRH-GXTWGEPZSA-N 1 1 246.398 3.709 20 0 BHADMO Cc1ccc(C[N@H+]2C[C@@H](C)CCC[C@@H]2C)c(C)n1 ZINC000359887802 387183883 /nfs/dbraw/zinc/18/38/83/387183883.db2.gz QLMRDUJQJJDWRH-JSGCOSHPSA-N 1 1 246.398 3.709 20 0 BHADMO Cc1ccc(C[N@H+]2C[C@H](C)CCC[C@@H]2C)c(C)n1 ZINC000359887804 387184815 /nfs/dbraw/zinc/18/48/15/387184815.db2.gz QLMRDUJQJJDWRH-OCCSQVGLSA-N 1 1 246.398 3.709 20 0 BHADMO Cc1ccc(C[N@H+]2C[C@H](C)CCC[C@H]2C)c(C)n1 ZINC000359887805 387184717 /nfs/dbraw/zinc/18/47/17/387184717.db2.gz QLMRDUJQJJDWRH-TZMCWYRMSA-N 1 1 246.398 3.709 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387440254 /nfs/dbraw/zinc/44/02/54/387440254.db2.gz RXZSVOISVJKHLG-OAHLLOKOSA-N 1 1 245.297 3.538 20 0 BHADMO C[C@@H]1CCC[N@H+]([C@H]2CCc3ccc(F)cc32)C1 ZINC000361324672 176103702 /nfs/dbraw/zinc/10/37/02/176103702.db2.gz IYNFTGUIMWVSNV-ABAIWWIYSA-N 1 1 233.330 3.545 20 0 BHADMO C[C@@H]1CCC[N@H+]([C@@H]2CCc3ccc(F)cc32)C1 ZINC000361324673 176103110 /nfs/dbraw/zinc/10/31/10/176103110.db2.gz IYNFTGUIMWVSNV-IAQYHMDHSA-N 1 1 233.330 3.545 20 0 BHADMO C[C@H]1CCC[N@H+]([C@H]2CCc3ccc(F)cc32)C1 ZINC000361324674 177105113 /nfs/dbraw/zinc/10/51/13/177105113.db2.gz IYNFTGUIMWVSNV-NHYWBVRUSA-N 1 1 233.330 3.545 20 0 BHADMO C[C@H]1CCC[N@H+]([C@@H]2CCc3ccc(F)cc32)C1 ZINC000361324675 177103381 /nfs/dbraw/zinc/10/33/81/177103381.db2.gz IYNFTGUIMWVSNV-XHDPSFHLSA-N 1 1 233.330 3.545 20 0 BHADMO C[N@@H+](C[C@@H]1C[C@H]1c1ccccc1)[C@H]1CC1(C)C ZINC000361388227 387452167 /nfs/dbraw/zinc/45/21/67/387452167.db2.gz DIUQFTKYGYENRD-KKUMJFAQSA-N 1 1 229.367 3.520 20 0 BHADMO C[N@@H+](C[C@@H]1C[C@@H]1c1ccccc1)[C@@H]1CC1(C)C ZINC000361388228 387453179 /nfs/dbraw/zinc/45/31/79/387453179.db2.gz DIUQFTKYGYENRD-RRFJBIMHSA-N 1 1 229.367 3.520 20 0 BHADMO C[N@@H+](C[C@@H]1C[C@H]1c1ccccc1)[C@@H]1CC1(C)C ZINC000361388229 387452867 /nfs/dbraw/zinc/45/28/67/387452867.db2.gz DIUQFTKYGYENRD-SOUVJXGZSA-N 1 1 229.367 3.520 20 0 BHADMO C[N@@H+](C[C@@H]1C[C@@H]1c1ccccc1)[C@H]1CC1(C)C ZINC000361388230 387451876 /nfs/dbraw/zinc/45/18/76/387451876.db2.gz DIUQFTKYGYENRD-ZNMIVQPWSA-N 1 1 229.367 3.520 20 0 BHADMO c1ccc([C@H]2C[C@@H]2[N@H+]2CCCC3(CCC3)C2)cc1 ZINC000361392215 387454386 /nfs/dbraw/zinc/45/43/86/387454386.db2.gz SEUGKFANIVVSOW-CVEARBPZSA-N 1 1 241.378 3.809 20 0 BHADMO c1ccc([C@@H]2C[C@@H]2[N@H+]2CCCC3(CCC3)C2)cc1 ZINC000361392216 387455541 /nfs/dbraw/zinc/45/55/41/387455541.db2.gz SEUGKFANIVVSOW-HOTGVXAUSA-N 1 1 241.378 3.809 20 0 BHADMO c1ccc([C@H]2C[C@H]2[N@H+]2CCCC3(CCC3)C2)cc1 ZINC000361392218 387455313 /nfs/dbraw/zinc/45/53/13/387455313.db2.gz SEUGKFANIVVSOW-HZPDHXFCSA-N 1 1 241.378 3.809 20 0 BHADMO c1ccc([C@@H]2C[C@H]2[N@H+]2CCCC3(CCC3)C2)cc1 ZINC000361392220 387455487 /nfs/dbraw/zinc/45/54/87/387455487.db2.gz SEUGKFANIVVSOW-JKSUJKDBSA-N 1 1 241.378 3.809 20 0 BHADMO Cc1ccc2c(c1)C[N@@H+]([C@H]1C[C@@H]1c1ccccc1)C2 ZINC000361396415 387455151 /nfs/dbraw/zinc/45/51/51/387455151.db2.gz UAOYYPPFEJKKGE-MSOLQXFVSA-N 1 1 249.357 3.867 20 0 BHADMO Cc1ccc2c(c1)C[N@@H+]([C@@H]1C[C@@H]1c1ccccc1)C2 ZINC000361396420 387454402 /nfs/dbraw/zinc/45/44/02/387454402.db2.gz UAOYYPPFEJKKGE-QZTJIDSGSA-N 1 1 249.357 3.867 20 0 BHADMO Cc1ccc2c(c1)C[N@@H+]([C@H]1C[C@H]1c1ccccc1)C2 ZINC000361396423 387454458 /nfs/dbraw/zinc/45/44/58/387454458.db2.gz UAOYYPPFEJKKGE-ROUUACIJSA-N 1 1 249.357 3.867 20 0 BHADMO Cc1ccc2c(c1)C[N@@H+]([C@@H]1C[C@H]1c1ccccc1)C2 ZINC000361396425 387453760 /nfs/dbraw/zinc/45/37/60/387453760.db2.gz UAOYYPPFEJKKGE-ZWKOTPCHSA-N 1 1 249.357 3.867 20 0 BHADMO C[N@@H+](CC1CCC1)[C@H]1CCc2ccc(F)cc21 ZINC000361398904 387453773 /nfs/dbraw/zinc/45/37/73/387453773.db2.gz BUJAZJGVFXAOMI-HNNXBMFYSA-N 1 1 233.330 3.545 20 0 BHADMO C[N@@H+](CC1CCC1)[C@@H]1CCc2ccc(F)cc21 ZINC000361398905 387454831 /nfs/dbraw/zinc/45/48/31/387454831.db2.gz BUJAZJGVFXAOMI-OAHLLOKOSA-N 1 1 233.330 3.545 20 0 BHADMO CCC(C)(C)CC[N@@H+](C)Cc1cnccc1C ZINC000361422777 168276855 /nfs/dbraw/zinc/27/68/55/168276855.db2.gz PCACTEPKQRGTRL-UHFFFAOYSA-N 1 1 234.387 3.648 20 0 BHADMO Cc1ccncc1C[N@@H+](C)CCCC1CCCC1 ZINC000361425547 187382134 /nfs/dbraw/zinc/38/21/34/187382134.db2.gz NVGVSCRYBUJHSN-UHFFFAOYSA-N 1 1 246.398 3.792 20 0 BHADMO C[N@@H+](CCCc1ccncc1)[C@H]1CCC(C)(C)C1 ZINC000361467099 387466164 /nfs/dbraw/zinc/46/61/64/387466164.db2.gz BBBSVFLHUJMCAT-HNNXBMFYSA-N 1 1 246.398 3.525 20 0 BHADMO C[N@@H+](CCCc1ccncc1)[C@@H]1CCC(C)(C)C1 ZINC000361467103 387467011 /nfs/dbraw/zinc/46/70/11/387467011.db2.gz BBBSVFLHUJMCAT-OAHLLOKOSA-N 1 1 246.398 3.525 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@H]2CCC(C)(C)C2)c(C)n1 ZINC000361469397 387465715 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NGADEMIVKHFVEK-UHFFFAOYSA-N 1 1 240.778 3.603 20 0 BHADMO CC[N@@H+](Cc1ccc(C)nc1C)CC(C)(C)C ZINC000361519930 169905683 /nfs/dbraw/zinc/90/56/83/169905683.db2.gz RHWSROMVKILZBJ-UHFFFAOYSA-N 1 1 234.387 3.566 20 0 BHADMO C[N@@H+](CCCC1CCCC1)Cc1nccs1 ZINC000361541789 387482796 /nfs/dbraw/zinc/48/27/96/387482796.db2.gz SVEOBIKRIXNYCZ-UHFFFAOYSA-N 1 1 238.400 3.545 20 0 BHADMO C[N@H+](CCCC1CCCC1)Cc1nccs1 ZINC000361541789 387482791 /nfs/dbraw/zinc/48/27/91/387482791.db2.gz SVEOBIKRIXNYCZ-UHFFFAOYSA-N 1 1 238.400 3.545 20 0 BHADMO CC(C)[C@@H]1CC[N@H+]1Cc1ccsc1Cl ZINC000361542741 188336888 /nfs/dbraw/zinc/33/68/88/188336888.db2.gz GMNCHLYXYMIIEU-JTQLQIEISA-N 1 1 229.776 3.632 20 0 BHADMO C[N@@H+](CCC1CC1)Cc1ccsc1Cl ZINC000361542868 387485832 /nfs/dbraw/zinc/48/58/32/387485832.db2.gz HYFYHOIHXWNSDM-UHFFFAOYSA-N 1 1 229.776 3.633 20 0 BHADMO Cc1cccc(C[N@H+]2CCC[C@H](C(C)(C)C)C2)n1 ZINC000361544654 179077862 /nfs/dbraw/zinc/07/78/62/179077862.db2.gz WLVXPNCQKLFZAC-AWEZNQCLSA-N 1 1 246.398 3.648 20 0 BHADMO Cc1cccc(C[N@H+]2CCC[C@@H](C(C)(C)C)C2)n1 ZINC000361544655 179073486 /nfs/dbraw/zinc/07/34/86/179073486.db2.gz WLVXPNCQKLFZAC-CQSZACIVSA-N 1 1 246.398 3.648 20 0 BHADMO Cc1cncc(C[N@H+]2CCC[C@H](C(C)(C)C)C2)c1 ZINC000361547460 387485325 /nfs/dbraw/zinc/48/53/25/387485325.db2.gz GCXBIKLVNOJLIS-HNNXBMFYSA-N 1 1 246.398 3.648 20 0 BHADMO Cc1cncc(C[N@H+]2CCC[C@@H](C(C)(C)C)C2)c1 ZINC000361547461 384868330 /nfs/dbraw/zinc/86/83/30/384868330.db2.gz GCXBIKLVNOJLIS-OAHLLOKOSA-N 1 1 246.398 3.648 20 0 BHADMO CC1=CC[N@@H+](Cc2ccsc2Cl)CC1 ZINC000361550040 168115223 /nfs/dbraw/zinc/11/52/23/168115223.db2.gz CPRMYOXOORQNBY-UHFFFAOYSA-N 1 1 227.760 3.554 20 0 BHADMO CC1=CC[N@H+](Cc2ccsc2Cl)CC1 ZINC000361550040 168115220 /nfs/dbraw/zinc/11/52/20/168115220.db2.gz CPRMYOXOORQNBY-UHFFFAOYSA-N 1 1 227.760 3.554 20 0 BHADMO CC[N@H+](Cc1ccsc1Cl)CC1CC1 ZINC000361550701 356932683 /nfs/dbraw/zinc/93/26/83/356932683.db2.gz GRPCOPWMTWRHHG-UHFFFAOYSA-N 1 1 229.776 3.633 20 0 BHADMO CC[N@@H+](Cc1ccsc1Cl)C1CCC1 ZINC000361551251 346579018 /nfs/dbraw/zinc/57/90/18/346579018.db2.gz VCJYAZQZGCQUHJ-UHFFFAOYSA-N 1 1 229.776 3.776 20 0 BHADMO CC[C@H]1CCC[N@H+]1Cc1ccsc1Cl ZINC000361551929 387486643 /nfs/dbraw/zinc/48/66/43/387486643.db2.gz XTUQVILHXCDITF-JTQLQIEISA-N 1 1 229.776 3.776 20 0 BHADMO CC[C@@H]1CCC[N@H+]1Cc1ccsc1Cl ZINC000361551930 356932719 /nfs/dbraw/zinc/93/27/19/356932719.db2.gz XTUQVILHXCDITF-SNVBAGLBSA-N 1 1 229.776 3.776 20 0 BHADMO CC1(C)CCC[N@H+]1Cc1ccsc1Cl ZINC000361552245 356932547 /nfs/dbraw/zinc/93/25/47/356932547.db2.gz KBXMNAWUIAFCRN-UHFFFAOYSA-N 1 1 229.776 3.776 20 0 BHADMO C[C@@H]1CC[C@H](C)[N@@H+]1Cc1ccsc1Cl ZINC000361556549 177187238 /nfs/dbraw/zinc/18/72/38/177187238.db2.gz IGRGRBPGJTUKLB-DTORHVGOSA-N 1 1 229.776 3.774 20 0 BHADMO Clc1sccc1C[N@H+]1CCC2(CCC2)C1 ZINC000361556873 387487919 /nfs/dbraw/zinc/48/79/19/387487919.db2.gz MDNXDHVPQJKLGV-UHFFFAOYSA-N 1 1 241.787 3.778 20 0 BHADMO CC1(C)CC[N@@H+](Cc2ccsc2Cl)C1 ZINC000361558861 346584029 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20 0 BHADMO CCC[N@H+]1CC[C@H](C)C[C@@H]1c1ccc(C)o1 ZINC000362431250 169207521 /nfs/dbraw/zinc/20/75/21/169207521.db2.gz RXHAEASJNIIXLD-WCQYABFASA-N 1 1 221.344 3.771 20 0 BHADMO CCC[N@H+]1CC[C@@H](C)C[C@H]1c1ccc(C)o1 ZINC000362431253 169205340 /nfs/dbraw/zinc/20/53/40/169205340.db2.gz RXHAEASJNIIXLD-YPMHNXCESA-N 1 1 221.344 3.771 20 0 BHADMO Cc1cc(C[N@H+]2C[C@H](C)CC[C@H]2C)c(C)s1 ZINC000362443180 178007878 /nfs/dbraw/zinc/00/78/78/178007878.db2.gz YFMKADATXHSCGM-GHMZBOCLSA-N 1 1 237.412 3.985 20 0 BHADMO Cc1cc(C[N@H+]2C[C@H](C)CC[C@@H]2C)c(C)s1 ZINC000362443181 178007883 /nfs/dbraw/zinc/00/78/83/178007883.db2.gz YFMKADATXHSCGM-MNOVXSKESA-N 1 1 237.412 3.985 20 0 BHADMO Cc1cc(C[N@H+]2C[C@@H](C)CC[C@@H]2C)c(C)s1 ZINC000362443182 178005079 /nfs/dbraw/zinc/00/50/79/178005079.db2.gz YFMKADATXHSCGM-QWRGUYRKSA-N 1 1 237.412 3.985 20 0 BHADMO Cc1cc(C[N@H+]2C[C@@H](C)CC[C@H]2C)c(C)s1 ZINC000362443183 178005613 /nfs/dbraw/zinc/00/56/13/178005613.db2.gz YFMKADATXHSCGM-WDEREUQCSA-N 1 1 237.412 3.985 20 0 BHADMO CCC[C@@]1(C)CCC[N@@H+](Cc2cccc(C)n2)C1 ZINC000362446964 387614226 /nfs/dbraw/zinc/61/42/26/387614226.db2.gz JGPMHUNWXLORIP-INIZCTEOSA-N 1 1 246.398 3.792 20 0 BHADMO CCC[C@]1(C)CCC[N@@H+](Cc2cccc(C)n2)C1 ZINC000362446965 387614328 /nfs/dbraw/zinc/61/43/28/387614328.db2.gz JGPMHUNWXLORIP-MRXNPFEDSA-N 1 1 246.398 3.792 20 0 BHADMO C[C@H]1CC[N@@H+](CCC2CC2)[C@@H](c2ccco2)C1 ZINC000362447905 177158215 /nfs/dbraw/zinc/15/82/15/177158215.db2.gz LYQWAAWSZDQMRX-GXTWGEPZSA-N 1 1 233.355 3.853 20 0 BHADMO C[C@H]1CC[N@@H+](CCC2CC2)[C@H](c2ccco2)C1 ZINC000362447921 177158944 /nfs/dbraw/zinc/15/89/44/177158944.db2.gz LYQWAAWSZDQMRX-JSGCOSHPSA-N 1 1 233.355 3.853 20 0 BHADMO C[C@@H]1CC[N@@H+](CCC2CC2)[C@H](c2ccco2)C1 ZINC000362447924 176168688 /nfs/dbraw/zinc/16/86/88/176168688.db2.gz LYQWAAWSZDQMRX-OCCSQVGLSA-N 1 1 233.355 3.853 20 0 BHADMO C[C@@H]1CC[N@@H+](CCC2CC2)[C@@H](c2ccco2)C1 ZINC000362447926 176169101 /nfs/dbraw/zinc/16/91/01/176169101.db2.gz LYQWAAWSZDQMRX-TZMCWYRMSA-N 1 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233.355 3.853 20 0 BHADMO C[C@@H]1CC[N@@H+](CC2CCC2)[C@H](c2ccco2)C1 ZINC000362453738 176169073 /nfs/dbraw/zinc/16/90/73/176169073.db2.gz PCYKWKJYYODXAI-OCCSQVGLSA-N 1 1 233.355 3.853 20 0 BHADMO C[C@@H]1CC[N@@H+](CC2CCC2)[C@@H](c2ccco2)C1 ZINC000362453739 176168382 /nfs/dbraw/zinc/16/83/82/176168382.db2.gz PCYKWKJYYODXAI-TZMCWYRMSA-N 1 1 233.355 3.853 20 0 BHADMO CSCCC[N@@H+](C)[C@H](C)c1ccccc1C ZINC000362462856 387615523 /nfs/dbraw/zinc/61/55/23/387615523.db2.gz CBHYDUABUAHFQE-CYBMUJFWSA-N 1 1 237.412 3.741 20 0 BHADMO CSCCC[N@@H+](C)[C@@H](C)c1ccccc1C ZINC000362462857 175479614 /nfs/dbraw/zinc/47/96/14/175479614.db2.gz CBHYDUABUAHFQE-ZDUSSCGKSA-N 1 1 237.412 3.741 20 0 BHADMO CSCCC[N@@H+](Cc1ccccc1C)C1CC1 ZINC000362464360 387616889 /nfs/dbraw/zinc/61/68/89/387616889.db2.gz NILOYQWYRPLQRN-UHFFFAOYSA-N 1 1 249.423 3.713 20 0 BHADMO CSCCC[N@@H+](C)[C@H](C)c1cccc(F)c1 ZINC000362465960 387616125 /nfs/dbraw/zinc/61/61/25/387616125.db2.gz WTXNHTMCWFRLQG-LLVKDONJSA-N 1 1 241.375 3.572 20 0 BHADMO CSCCC[N@@H+](C)[C@@H](C)c1cccc(F)c1 ZINC000362465962 387615728 /nfs/dbraw/zinc/61/57/28/387615728.db2.gz WTXNHTMCWFRLQG-NSHDSACASA-N 1 1 241.375 3.572 20 0 BHADMO CSCCC[N@@H+](C1CC1)C1CCC(C)CC1 ZINC000362466783 387615482 /nfs/dbraw/zinc/61/54/82/387615482.db2.gz ZUBCIIJNDAAMNL-UHFFFAOYSA-N 1 1 241.444 3.783 20 0 BHADMO CC[C@@H](C)[C@H](C)[N@@H+](CCCSC)C1CC1 ZINC000362466785 387616266 /nfs/dbraw/zinc/61/62/66/387616266.db2.gz ZXGHONXOPAROBD-NEPJUHHUSA-N 1 1 229.433 3.639 20 0 BHADMO CC[C@H](C)[C@@H](C)[N@@H+](CCCSC)C1CC1 ZINC000362466786 171362243 /nfs/dbraw/zinc/36/22/43/171362243.db2.gz ZXGHONXOPAROBD-NWDGAFQWSA-N 1 1 229.433 3.639 20 0 BHADMO CC[C@H](C)[C@H](C)[N@@H+](CCCSC)C1CC1 ZINC000362466787 171385894 /nfs/dbraw/zinc/38/58/94/171385894.db2.gz ZXGHONXOPAROBD-RYUDHWBXSA-N 1 1 229.433 3.639 20 0 BHADMO CC[C@@H](C)[C@@H](C)[N@@H+](CCCSC)C1CC1 ZINC000362466788 387617227 /nfs/dbraw/zinc/61/72/27/387617227.db2.gz ZXGHONXOPAROBD-VXGBXAGGSA-N 1 1 229.433 3.639 20 0 BHADMO CSCCC[N@@H+](C)C1CCC(C)(C)CC1 ZINC000362481202 387617939 /nfs/dbraw/zinc/61/79/39/387617939.db2.gz DDEREGXLBIJIFV-UHFFFAOYSA-N 1 1 229.433 3.640 20 0 BHADMO CSCCC[N@H+]1CCC[C@@]2(CC=CCC2)C1 ZINC000362482365 387619114 /nfs/dbraw/zinc/61/91/14/387619114.db2.gz CYEYMJYYSMJPNP-AWEZNQCLSA-N 1 1 239.428 3.562 20 0 BHADMO CSCCC[N@H+]1CCC[C@]2(CC=CCC2)C1 ZINC000362482370 387618456 /nfs/dbraw/zinc/61/84/56/387618456.db2.gz CYEYMJYYSMJPNP-CQSZACIVSA-N 1 1 239.428 3.562 20 0 BHADMO Fc1cc(Cl)cc(C[N@H+]2CCC23CCC3)c1 ZINC000362511392 387623230 /nfs/dbraw/zinc/62/32/30/387623230.db2.gz NGTPGSYWKSLGJR-UHFFFAOYSA-N 1 1 239.721 3.608 20 0 BHADMO Fc1cc(Cl)cc(C[N@@H+]2CCC23CCC3)c1 ZINC000362511392 387623225 /nfs/dbraw/zinc/62/32/25/387623225.db2.gz NGTPGSYWKSLGJR-UHFFFAOYSA-N 1 1 239.721 3.608 20 0 BHADMO CCCN(c1cc[nH+]c2ccsc21)C1CC1 ZINC000362648466 169183859 /nfs/dbraw/zinc/18/38/59/169183859.db2.gz IWSKOJQTTKMAKI-UHFFFAOYSA-N 1 1 232.352 3.675 20 0 BHADMO CCC[C@H](C)[C@@H]1CCC[N@H+]1Cc1cccc(C)n1 ZINC000362950151 387676884 /nfs/dbraw/zinc/67/68/84/387676884.db2.gz YISJYVYJYLNMFE-BBRMVZONSA-N 1 1 246.398 3.791 20 0 BHADMO CCC[C@@H](C)[C@@H]1CCC[N@H+]1Cc1cccc(C)n1 ZINC000362950152 169373167 /nfs/dbraw/zinc/37/31/67/169373167.db2.gz YISJYVYJYLNMFE-CJNGLKHVSA-N 1 1 246.398 3.791 20 0 BHADMO CCC[C@@H](C)[C@H]1CCC[N@H+]1Cc1cccc(C)n1 ZINC000362950153 169374564 /nfs/dbraw/zinc/37/45/64/169374564.db2.gz YISJYVYJYLNMFE-CZUORRHYSA-N 1 1 246.398 3.791 20 0 BHADMO CCC[C@H](C)[C@H]1CCC[N@H+]1Cc1cccc(C)n1 ZINC000362950154 387677886 /nfs/dbraw/zinc/67/78/86/387677886.db2.gz YISJYVYJYLNMFE-XJKSGUPXSA-N 1 1 246.398 3.791 20 0 BHADMO Cc1cccc(C[N@@H+]2CCC[C@H]2CCC(C)C)n1 ZINC000362950364 179077312 /nfs/dbraw/zinc/07/73/12/179077312.db2.gz BIGPVBACGZJYGS-INIZCTEOSA-N 1 1 246.398 3.791 20 0 BHADMO Cc1cccc(C[N@@H+]2CCC[C@@H]2CCC(C)C)n1 ZINC000362950365 179077562 /nfs/dbraw/zinc/07/75/62/179077562.db2.gz BIGPVBACGZJYGS-MRXNPFEDSA-N 1 1 246.398 3.791 20 0 BHADMO CSCCC[N@H+]1CCC[C@@H]1CCC(C)C ZINC000362953909 387677686 /nfs/dbraw/zinc/67/76/86/387677686.db2.gz DMATXLQIPJCOEF-CYBMUJFWSA-N 1 1 229.433 3.640 20 0 BHADMO CSCCC[N@H+]1CCC[C@H]1CCC(C)C ZINC000362953910 387676341 /nfs/dbraw/zinc/67/63/41/387676341.db2.gz DMATXLQIPJCOEF-ZDUSSCGKSA-N 1 1 229.433 3.640 20 0 BHADMO CCCCC[C@@H]1CCC[N@H+]1Cc1ncc(C)o1 ZINC000362955458 387680587 /nfs/dbraw/zinc/68/05/87/387680587.db2.gz QUZVMGKQQPZUDK-CYBMUJFWSA-N 1 1 236.359 3.528 20 0 BHADMO CCCCC[C@H]1CCC[N@H+]1Cc1ncc(C)o1 ZINC000362955459 387679394 /nfs/dbraw/zinc/67/93/94/387679394.db2.gz QUZVMGKQQPZUDK-ZDUSSCGKSA-N 1 1 236.359 3.528 20 0 BHADMO CCCCC[C@H]1CCC[N@H+]1Cc1cccc(C)n1 ZINC000362962733 387680682 /nfs/dbraw/zinc/68/06/82/387680682.db2.gz GJBXVAADBJSHFK-INIZCTEOSA-N 1 1 246.398 3.935 20 0 BHADMO CCCCC[C@@H]1CCC[N@H+]1Cc1cccc(C)n1 ZINC000362962734 387679169 /nfs/dbraw/zinc/67/91/69/387679169.db2.gz GJBXVAADBJSHFK-MRXNPFEDSA-N 1 1 246.398 3.935 20 0 BHADMO Cc1cc([C@H]2CCC[N@H+]2CCC(C)(C)C)no1 ZINC000362987765 178266729 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385508184 /nfs/dbraw/zinc/50/81/84/385508184.db2.gz PWCMGTXHXGCFFH-INIZCTEOSA-N 1 1 247.382 3.506 20 0 BHADMO CCCCCC[N@H+]1CC[C@@H](O)c2ccccc2C1 ZINC000364741388 385509487 /nfs/dbraw/zinc/50/94/87/385509487.db2.gz PWCMGTXHXGCFFH-MRXNPFEDSA-N 1 1 247.382 3.506 20 0 BHADMO CC1(C)CC[C@@H]([N@H+]2CCCC[C@@H]2c2ncc[nH]2)C1 ZINC000364853023 347570403 /nfs/dbraw/zinc/57/04/03/347570403.db2.gz FBLCPRVCLFHNCA-CHWSQXEVSA-N 1 1 247.386 3.515 20 0 BHADMO CC1(C)CC[C@@H]([N@H+]2CCCC[C@H]2c2ncc[nH]2)C1 ZINC000364853024 347570350 /nfs/dbraw/zinc/57/03/50/347570350.db2.gz FBLCPRVCLFHNCA-OLZOCXBDSA-N 1 1 247.386 3.515 20 0 BHADMO CC1(C)CC[C@H]([N@H+]2CCCC[C@@H]2c2ncc[nH]2)C1 ZINC000364853025 385528673 /nfs/dbraw/zinc/52/86/73/385528673.db2.gz FBLCPRVCLFHNCA-QWHCGFSZSA-N 1 1 247.386 3.515 20 0 BHADMO CC1(C)CC[C@H]([N@H+]2CCCC[C@H]2c2ncc[nH]2)C1 ZINC000364853026 188354578 /nfs/dbraw/zinc/35/45/78/188354578.db2.gz FBLCPRVCLFHNCA-STQMWFEESA-N 1 1 247.386 3.515 20 0 BHADMO Fc1ccc(C[N@H+]2CCCC23CCCCC3)nc1 ZINC000364958227 385547869 /nfs/dbraw/zinc/54/78/69/385547869.db2.gz XCPULHAPKMNFOR-UHFFFAOYSA-N 1 1 248.345 3.519 20 0 BHADMO CC[N@@H+](C1CCCC1)[C@H]1CCCc2cccnc21 ZINC000364997405 592730427 /nfs/dbraw/zinc/73/04/27/592730427.db2.gz CJTYHPKFZRAZEK-HNNXBMFYSA-N 1 1 244.382 3.724 20 0 BHADMO CC[N@@H+](C1CCCC1)[C@@H]1CCCc2cccnc21 ZINC000364997406 592730443 /nfs/dbraw/zinc/73/04/43/592730443.db2.gz CJTYHPKFZRAZEK-OAHLLOKOSA-N 1 1 244.382 3.724 20 0 BHADMO Cc1cc([C@H]2CCC[N@H+]2[C@H]2CCC(C)(C)C2)no1 ZINC000365043859 178266278 /nfs/dbraw/zinc/26/62/78/178266278.db2.gz MEKSJVWZNBGOEF-GXTWGEPZSA-N 1 1 248.370 3.699 20 0 BHADMO Cc1cc([C@@H]2CCC[N@H+]2[C@H]2CCC(C)(C)C2)no1 ZINC000365043864 178240326 /nfs/dbraw/zinc/24/03/26/178240326.db2.gz MEKSJVWZNBGOEF-JSGCOSHPSA-N 1 1 248.370 3.699 20 0 BHADMO Cc1cc([C@@H]2CCC[N@H+]2[C@@H]2CCC(C)(C)C2)no1 ZINC000365043865 178241439 /nfs/dbraw/zinc/24/14/39/178241439.db2.gz MEKSJVWZNBGOEF-OCCSQVGLSA-N 1 1 248.370 3.699 20 0 BHADMO Cc1cc([C@H]2CCC[N@H+]2[C@@H]2CCC(C)(C)C2)no1 ZINC000365043867 178265409 /nfs/dbraw/zinc/26/54/09/178265409.db2.gz MEKSJVWZNBGOEF-TZMCWYRMSA-N 1 1 248.370 3.699 20 0 BHADMO CCC(=O)CC[N@H+]1CCC[C@H]1c1ccc(C)cc1 ZINC000365207194 168203181 /nfs/dbraw/zinc/20/31/81/168203181.db2.gz RVCSRXPHUGPXRQ-INIZCTEOSA-N 1 1 245.366 3.501 20 0 BHADMO CCC(=O)CC[N@H+]1CCC[C@@H]1c1ccc(C)cc1 ZINC000365207195 168201944 /nfs/dbraw/zinc/20/19/44/168201944.db2.gz RVCSRXPHUGPXRQ-MRXNPFEDSA-N 1 1 245.366 3.501 20 0 BHADMO CCCCCC[N@H+]1CCC[C@@H]1c1nccs1 ZINC000365475868 386117490 /nfs/dbraw/zinc/11/74/90/386117490.db2.gz DSEDNHYHYIDHMO-GFCCVEGCSA-N 1 1 238.400 3.860 20 0 BHADMO CCCCCC[N@H+]1CCC[C@H]1c1nccs1 ZINC000365475875 168662068 /nfs/dbraw/zinc/66/20/68/168662068.db2.gz DSEDNHYHYIDHMO-LBPRGKRZSA-N 1 1 238.400 3.860 20 0 BHADMO C([C@H]1CCSC1)[N@H+]1CCCC12CCCCC2 ZINC000365502520 386133896 /nfs/dbraw/zinc/13/38/96/386133896.db2.gz CUZWMVQASKDLJC-CYBMUJFWSA-N 1 1 239.428 3.538 20 0 BHADMO 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ZINC000366695832 177988644 /nfs/dbraw/zinc/98/86/44/177988644.db2.gz NJOPQKUZSNMGDU-UHFFFAOYSA-N 1 1 248.370 3.672 20 0 BHADMO C[C@@H]1C[C@H](c2cccs2)C[N@H+]1CCCCF ZINC000367216786 387593526 /nfs/dbraw/zinc/59/35/26/387593526.db2.gz HBXKRQVLGPSPAN-NEPJUHHUSA-N 1 1 241.375 3.676 20 0 BHADMO C[C@H]1C[C@@H](c2cccs2)C[N@H+]1CCCCF ZINC000367216787 177339250 /nfs/dbraw/zinc/33/92/50/177339250.db2.gz HBXKRQVLGPSPAN-NWDGAFQWSA-N 1 1 241.375 3.676 20 0 BHADMO C[C@H]1C[C@H](c2cccs2)C[N@H+]1CCCCF ZINC000367216788 177375726 /nfs/dbraw/zinc/37/57/26/177375726.db2.gz HBXKRQVLGPSPAN-RYUDHWBXSA-N 1 1 241.375 3.676 20 0 BHADMO C[C@@H]1C[C@@H](c2cccs2)C[N@H+]1CCCCF ZINC000367216789 187212166 /nfs/dbraw/zinc/21/21/66/187212166.db2.gz HBXKRQVLGPSPAN-VXGBXAGGSA-N 1 1 241.375 3.676 20 0 BHADMO CC1=C(c2ccco2)C[N@@H+](CCCCF)CC1 ZINC000367216929 168087915 /nfs/dbraw/zinc/08/79/15/168087915.db2.gz HNDGPNUXTRAFLW-UHFFFAOYSA-N 1 1 237.318 3.509 20 0 BHADMO FCCCC[N@@H+]1CC=C(c2cccs2)CC1 ZINC000367217199 387594801 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CCC[C@H](C)C[N@H+]1CCC[C@@H]1c1c(C)n[nH]c1C ZINC000368136207 384271080 /nfs/dbraw/zinc/27/10/80/384271080.db2.gz TYOLYAGPRXVDEZ-SMDDNHRTSA-N 1 1 249.402 3.600 20 0 BHADMO c1c2ccccc2[nH]c1C[N@H+]1C[C@H]2CCCC[C@H]21 ZINC000368226309 386951860 /nfs/dbraw/zinc/95/18/60/386951860.db2.gz NKJVCIKYJJKLQR-CZUORRHYSA-N 1 1 240.350 3.542 20 0 BHADMO Cc1cc(C[N@H+]2CCC3(C2)CCCCCC3)no1 ZINC000368399282 386969131 /nfs/dbraw/zinc/96/91/31/386969131.db2.gz XDWDSZFZZSLNBE-UHFFFAOYSA-N 1 1 248.370 3.529 20 0 BHADMO CCCCC[N@H+]1CCC[C@@H]1c1csc(C)n1 ZINC000368417370 386970677 /nfs/dbraw/zinc/97/06/77/386970677.db2.gz RNIMTNKXYOGRGO-CYBMUJFWSA-N 1 1 238.400 3.779 20 0 BHADMO CSCC[N@H+]1CCC[C@@H]1c1ccc(C)s1 ZINC000369386438 387040544 /nfs/dbraw/zinc/04/05/44/387040544.db2.gz ARNBCCRTIUJBKO-LLVKDONJSA-N 1 1 241.425 3.556 20 0 BHADMO CSCC[N@H+]1CCC[C@H]1c1ccc(C)s1 ZINC000369386439 387041423 /nfs/dbraw/zinc/04/14/23/387041423.db2.gz ARNBCCRTIUJBKO-NSHDSACASA-N 1 1 241.425 3.556 20 0 BHADMO CCCCCC[N@H+]1CCC[C@H]1c1cc(C)on1 ZINC000369589790 387055774 /nfs/dbraw/zinc/05/57/74/387055774.db2.gz BXSDRUMMPKQUNA-AWEZNQCLSA-N 1 1 236.359 3.700 20 0 BHADMO CCCCCC[N@H+]1CCC[C@@H]1c1cc(C)on1 ZINC000369589791 387055425 /nfs/dbraw/zinc/05/54/25/387055425.db2.gz BXSDRUMMPKQUNA-CQSZACIVSA-N 1 1 236.359 3.700 20 0 BHADMO FC(F)(F)CCCC[N@H+]1CCCC2(CC2)C1 ZINC000369974992 387079425 /nfs/dbraw/zinc/07/94/25/387079425.db2.gz QFQKBNLTMCDPGZ-UHFFFAOYSA-N 1 1 235.293 3.595 20 0 BHADMO CO[C@H]1CCC[N@H+]([C@H](C)c2ccccc2C)CC1 ZINC000369992511 387083032 /nfs/dbraw/zinc/08/30/32/387083032.db2.gz CPUKASOANIQIHH-CABCVRRESA-N 1 1 247.382 3.557 20 0 BHADMO CO[C@H]1CCC[N@H+]([C@@H](C)c2ccccc2C)CC1 ZINC000369992512 387081403 /nfs/dbraw/zinc/08/14/03/387081403.db2.gz CPUKASOANIQIHH-GJZGRUSLSA-N 1 1 247.382 3.557 20 0 BHADMO CO[C@@H]1CCC[N@H+]([C@H](C)c2ccccc2C)CC1 ZINC000369992513 387082134 /nfs/dbraw/zinc/08/21/34/387082134.db2.gz CPUKASOANIQIHH-HUUCEWRRSA-N 1 1 247.382 3.557 20 0 BHADMO CO[C@@H]1CCC[N@H+]([C@@H](C)c2ccccc2C)CC1 ZINC000369992514 174746368 /nfs/dbraw/zinc/74/63/68/174746368.db2.gz CPUKASOANIQIHH-LSDHHAIUSA-N 1 1 247.382 3.557 20 0 BHADMO CC[N@H+]1CCC[C@H]1c1nc(C2CCCCC2)co1 ZINC000370208404 357007816 /nfs/dbraw/zinc/00/78/16/357007816.db2.gz UJNMWEABLQVYRP-AWEZNQCLSA-N 1 1 248.370 3.879 20 0 BHADMO CC[N@@H+]1CCC[C@H]1c1nc(C2CCCCC2)co1 ZINC000370208404 357007811 /nfs/dbraw/zinc/00/78/11/357007811.db2.gz UJNMWEABLQVYRP-AWEZNQCLSA-N 1 1 248.370 3.879 20 0 BHADMO CC[N@H+]1CCC[C@@H]1c1nc(C2CCCCC2)co1 ZINC000370208405 357007753 /nfs/dbraw/zinc/00/77/53/357007753.db2.gz UJNMWEABLQVYRP-CQSZACIVSA-N 1 1 248.370 3.879 20 0 BHADMO CC[N@@H+]1CCC[C@@H]1c1nc(C2CCCCC2)co1 ZINC000370208405 357007747 /nfs/dbraw/zinc/00/77/47/357007747.db2.gz UJNMWEABLQVYRP-CQSZACIVSA-N 1 1 248.370 3.879 20 0 BHADMO CCC[N@H+]1CCCC[C@@H]1c1nc2ccccc2o1 ZINC000370511871 169191888 /nfs/dbraw/zinc/19/18/88/169191888.db2.gz BNSNJJFEHHYQAE-CYBMUJFWSA-N 1 1 244.338 3.765 20 0 BHADMO CCC[N@H+]1CCCC[C@H]1c1nc2ccccc2o1 ZINC000370511872 169191742 /nfs/dbraw/zinc/19/17/42/169191742.db2.gz BNSNJJFEHHYQAE-ZDUSSCGKSA-N 1 1 244.338 3.765 20 0 BHADMO C[C@H](c1cccnc1)[N@H+]1C[C@H]2CCCCCC[C@@H]21 ZINC000370549272 177046357 /nfs/dbraw/zinc/04/63/57/177046357.db2.gz YMCPXOAINRKJNL-BMFZPTHFSA-N 1 1 244.382 3.797 20 0 BHADMO C[C@H](c1cccnc1)[N@H+]1C[C@H]2CCCCCC[C@H]21 ZINC000370549273 177046182 /nfs/dbraw/zinc/04/61/82/177046182.db2.gz YMCPXOAINRKJNL-FVQBIDKESA-N 1 1 244.382 3.797 20 0 BHADMO C[C@H](c1cccnc1)[N@H+]1C[C@@H]2CCCCCC[C@@H]21 ZINC000370549274 177046738 /nfs/dbraw/zinc/04/67/38/177046738.db2.gz YMCPXOAINRKJNL-KBMXLJTQSA-N 1 1 244.382 3.797 20 0 BHADMO C[C@H](c1cccnc1)[N@H+]1C[C@@H]2CCCCCC[C@H]21 ZINC000370549275 177046277 /nfs/dbraw/zinc/04/62/77/177046277.db2.gz YMCPXOAINRKJNL-VNQPRFMTSA-N 1 1 244.382 3.797 20 0 BHADMO Cc1noc(C)c1C[N@H+]1CCCC12CCCCC2 ZINC000371168016 387159618 /nfs/dbraw/zinc/15/96/18/387159618.db2.gz ZMCRUECINRBGDQ-UHFFFAOYSA-N 1 1 248.370 3.590 20 0 BHADMO Cc1ccc(C[N@H+]2CC[C@@H](c3ccco3)C2)s1 ZINC000371331910 387194464 /nfs/dbraw/zinc/19/44/64/387194464.db2.gz LQLDQGXLWBOZAV-GFCCVEGCSA-N 1 1 247.363 3.639 20 0 BHADMO Cc1ccc(C[N@H+]2CC[C@H](c3ccco3)C2)s1 ZINC000371331911 387193454 /nfs/dbraw/zinc/19/34/54/387193454.db2.gz LQLDQGXLWBOZAV-LBPRGKRZSA-N 1 1 247.363 3.639 20 0 BHADMO Cc1ccc([C@@H]2CCC[N@H+]2Cc2cc[nH]c2)cc1 ZINC000371394849 387204700 /nfs/dbraw/zinc/20/47/00/387204700.db2.gz AYNGRMMUQDSFRW-INIZCTEOSA-N 1 1 240.350 3.660 20 0 BHADMO Cc1ccc([C@H]2CCC[N@H+]2Cc2cc[nH]c2)cc1 ZINC000371394850 387204596 /nfs/dbraw/zinc/20/45/96/387204596.db2.gz AYNGRMMUQDSFRW-MRXNPFEDSA-N 1 1 240.350 3.660 20 0 BHADMO CC1(C)CC[C@H]([N@H+]2CCCC[C@H]2c2cn[nH]c2)C1 ZINC000371803059 188247683 /nfs/dbraw/zinc/24/76/83/188247683.db2.gz NZCAVVAQKJGPJB-KBPBESRZSA-N 1 1 247.386 3.515 20 0 BHADMO CC1(C)CC[C@@H]([N@H+]2CCCC[C@H]2c2cn[nH]c2)C1 ZINC000371803060 357051512 /nfs/dbraw/zinc/05/15/12/357051512.db2.gz NZCAVVAQKJGPJB-KGLIPLIRSA-N 1 1 247.386 3.515 20 0 BHADMO CC1(C)CC[C@H]([N@H+]2CCCC[C@@H]2c2cn[nH]c2)C1 ZINC000371803061 387251766 /nfs/dbraw/zinc/25/17/66/387251766.db2.gz NZCAVVAQKJGPJB-UONOGXRCSA-N 1 1 247.386 3.515 20 0 BHADMO CC1(C)CC[C@@H]([N@H+]2CCCC[C@@H]2c2cn[nH]c2)C1 ZINC000371803062 357051708 /nfs/dbraw/zinc/05/17/08/357051708.db2.gz NZCAVVAQKJGPJB-ZIAGYGMSSA-N 1 1 247.386 3.515 20 0 BHADMO FCCC[N@H+]1CCC[C@@H]1/C=C/c1cccs1 ZINC000372028740 387265199 /nfs/dbraw/zinc/26/51/99/387265199.db2.gz YSZDOVZIFAPGOQ-NNNHXZLVSA-N 1 1 239.359 3.585 20 0 BHADMO FCCC[N@H+]1CCC[C@H]1/C=C/c1cccs1 ZINC000372028741 387264821 /nfs/dbraw/zinc/26/48/21/387264821.db2.gz YSZDOVZIFAPGOQ-SYTKJHMZSA-N 1 1 239.359 3.585 20 0 BHADMO CC/C=C/CC[N@H+]1CCC[C@@H]1c1nccs1 ZINC000372044877 387267175 /nfs/dbraw/zinc/26/71/75/387267175.db2.gz YFQYGPPMHUGYEP-AAOUONPWSA-N 1 1 236.384 3.636 20 0 BHADMO CC/C=C/CC[N@H+]1CCC[C@H]1c1nccs1 ZINC000372044878 387267121 /nfs/dbraw/zinc/26/71/21/387267121.db2.gz YFQYGPPMHUGYEP-PCAWENJQSA-N 1 1 236.384 3.636 20 0 BHADMO CCCCC[N@H+]1CCC[C@H]1c1csc(C)n1 ZINC000372124675 387273133 /nfs/dbraw/zinc/27/31/33/387273133.db2.gz RNIMTNKXYOGRGO-ZDUSSCGKSA-N 1 1 238.400 3.779 20 0 BHADMO FC(F)(F)CCCC[N@H+]1CCC[C@@H]1C1CC1 ZINC000372131956 387276432 /nfs/dbraw/zinc/27/64/32/387276432.db2.gz MEKWFKVVXCXKBL-LLVKDONJSA-N 1 1 235.293 3.593 20 0 BHADMO FC(F)(F)CCCC[N@H+]1CCC[C@H]1C1CC1 ZINC000372131957 387273487 /nfs/dbraw/zinc/27/34/87/387273487.db2.gz MEKWFKVVXCXKBL-NSHDSACASA-N 1 1 235.293 3.593 20 0 BHADMO CCC(CC)C[N@H+]1CCC[C@H]1c1ccncc1 ZINC000372451320 168352744 /nfs/dbraw/zinc/35/27/44/168352744.db2.gz KFBYCNYOLHLTQI-HNNXBMFYSA-N 1 1 232.371 3.655 20 0 BHADMO CCC(CC)C[N@H+]1CCC[C@@H]1c1ccncc1 ZINC000372451321 168350805 /nfs/dbraw/zinc/35/08/05/168350805.db2.gz KFBYCNYOLHLTQI-OAHLLOKOSA-N 1 1 232.371 3.655 20 0 BHADMO CCC(CC)C[N@H+]1CCC[C@H]1c1cc(C)on1 ZINC000372452152 168352048 /nfs/dbraw/zinc/35/20/48/168352048.db2.gz WGJNXFMPXVYPGB-AWEZNQCLSA-N 1 1 236.359 3.556 20 0 BHADMO CCC(CC)C[N@H+]1CCC[C@@H]1c1cc(C)on1 ZINC000372452153 168350528 /nfs/dbraw/zinc/35/05/28/168350528.db2.gz WGJNXFMPXVYPGB-CQSZACIVSA-N 1 1 236.359 3.556 20 0 BHADMO Cc1cc([C@@H]2CCC[N@@H+]2CCCC(C)C)no1 ZINC000372461492 178241520 /nfs/dbraw/zinc/24/15/20/178241520.db2.gz CPNIYNYKRHTDAF-AWEZNQCLSA-N 1 1 236.359 3.556 20 0 BHADMO Cc1cc([C@H]2CCC[N@@H+]2CCCC(C)C)no1 ZINC000372461495 178265925 /nfs/dbraw/zinc/26/59/25/178265925.db2.gz CPNIYNYKRHTDAF-CQSZACIVSA-N 1 1 236.359 3.556 20 0 BHADMO Cc1oncc1C[N@H+]1CCCC12CCCCCC2 ZINC000372462709 387304280 /nfs/dbraw/zinc/30/42/80/387304280.db2.gz ISEGQXYLLBVZKI-UHFFFAOYSA-N 1 1 248.370 3.672 20 0 BHADMO FC(F)(F)CCCC[N@H+]1CCCC12CCC2 ZINC000373104519 398012868 /nfs/dbraw/zinc/01/28/68/398012868.db2.gz PERLVFXMDAFZFJ-UHFFFAOYSA-N 1 1 235.293 3.738 20 0 BHADMO CC/C=C/CC[N@@H+]1CC=C(c2cccnc2)CC1 ZINC000373352979 387360238 /nfs/dbraw/zinc/36/02/38/387360238.db2.gz HQMDPFIYXKVOSG-ONEGZZNKSA-N 1 1 242.366 3.527 20 0 BHADMO Cc1cc([C@@H]2CC[N@@H+](Cc3ccco3)C2)cs1 ZINC000373570306 178241888 /nfs/dbraw/zinc/24/18/88/178241888.db2.gz YYWSXMUPPZQKOS-GFCCVEGCSA-N 1 1 247.363 3.639 20 0 BHADMO Cc1cc([C@H]2CC[N@@H+](Cc3ccco3)C2)cs1 ZINC000373570307 178268359 /nfs/dbraw/zinc/26/83/59/178268359.db2.gz YYWSXMUPPZQKOS-LBPRGKRZSA-N 1 1 247.363 3.639 20 0 BHADMO CC(C)CCC[N@H+]1CCC[C@@H]1c1nccs1 ZINC000373688586 387388570 /nfs/dbraw/zinc/38/85/70/387388570.db2.gz TYZUOLPMBFSPAK-GFCCVEGCSA-N 1 1 238.400 3.716 20 0 BHADMO CC(C)CCC[N@H+]1CCC[C@H]1c1nccs1 ZINC000373688587 387387753 /nfs/dbraw/zinc/38/77/53/387387753.db2.gz TYZUOLPMBFSPAK-LBPRGKRZSA-N 1 1 238.400 3.716 20 0 BHADMO CC(C)SCC[N@H+]1CCC[C@@H]1c1ccco1 ZINC000374342263 167323059 /nfs/dbraw/zinc/32/30/59/167323059.db2.gz PYQUMJWEBKDSFC-GFCCVEGCSA-N 1 1 239.384 3.558 20 0 BHADMO CC(C)SCC[N@H+]1CCC[C@H]1c1ccco1 ZINC000374342264 167326913 /nfs/dbraw/zinc/32/69/13/167326913.db2.gz PYQUMJWEBKDSFC-LBPRGKRZSA-N 1 1 239.384 3.558 20 0 BHADMO CC[C@@H](c1ccccc1)[N@H+]1CCC[C@@H](OC)CC1 ZINC000374691643 357165980 /nfs/dbraw/zinc/16/59/80/357165980.db2.gz DUXJOCRELJMYOH-CVEARBPZSA-N 1 1 247.382 3.639 20 0 BHADMO CC[C@@H](c1ccccc1)[N@H+]1CCC[C@H](OC)CC1 ZINC000374691649 357166126 /nfs/dbraw/zinc/16/61/26/357166126.db2.gz DUXJOCRELJMYOH-HOTGVXAUSA-N 1 1 247.382 3.639 20 0 BHADMO CC[C@H](c1ccccc1)[N@H+]1CCC[C@@H](OC)CC1 ZINC000374691651 171597863 /nfs/dbraw/zinc/59/78/63/171597863.db2.gz DUXJOCRELJMYOH-HZPDHXFCSA-N 1 1 247.382 3.639 20 0 BHADMO CC[C@H](c1ccccc1)[N@H+]1CCC[C@H](OC)CC1 ZINC000374691654 387481614 /nfs/dbraw/zinc/48/16/14/387481614.db2.gz DUXJOCRELJMYOH-JKSUJKDBSA-N 1 1 247.382 3.639 20 0 BHADMO CC1=C(c2ccco2)C[N@@H+](Cc2ccco2)CC1 ZINC000374994518 168090285 /nfs/dbraw/zinc/09/02/85/168090285.db2.gz LOOOAPPKKWSKQF-UHFFFAOYSA-N 1 1 243.306 3.552 20 0 BHADMO CCC[C@@H](C)C[N@H+]1CCC[C@@H]1c1cc(C)on1 ZINC000375015120 169357966 /nfs/dbraw/zinc/35/79/66/169357966.db2.gz CDKTVFLNEBIDIG-BXUZGUMPSA-N 1 1 236.359 3.556 20 0 BHADMO CCC[C@H](C)C[N@H+]1CCC[C@H]1c1cc(C)on1 ZINC000375015122 387506127 /nfs/dbraw/zinc/50/61/27/387506127.db2.gz CDKTVFLNEBIDIG-FZMZJTMJSA-N 1 1 236.359 3.556 20 0 BHADMO CCC[C@@H](C)C[N@H+]1CCC[C@H]1c1cc(C)on1 ZINC000375015125 169357416 /nfs/dbraw/zinc/35/74/16/169357416.db2.gz CDKTVFLNEBIDIG-RISCZKNCSA-N 1 1 236.359 3.556 20 0 BHADMO CCC[C@H](C)C[N@H+]1CCC[C@@H]1c1cc(C)on1 ZINC000375015126 387506152 /nfs/dbraw/zinc/50/61/52/387506152.db2.gz CDKTVFLNEBIDIG-SMDDNHRTSA-N 1 1 236.359 3.556 20 0 BHADMO CCC[C@@H](C)C[N@H+]1CCC[C@H]1c1nccs1 ZINC000375020676 169358334 /nfs/dbraw/zinc/35/83/34/169358334.db2.gz NICVFZKBHFNTOX-NEPJUHHUSA-N 1 1 238.400 3.716 20 0 BHADMO CCC[C@H](C)C[N@H+]1CCC[C@@H]1c1nccs1 ZINC000375020677 387505980 /nfs/dbraw/zinc/50/59/80/387505980.db2.gz NICVFZKBHFNTOX-NWDGAFQWSA-N 1 1 238.400 3.716 20 0 BHADMO CCC[C@H](C)C[N@H+]1CCC[C@H]1c1nccs1 ZINC000375020679 387505801 /nfs/dbraw/zinc/50/58/01/387505801.db2.gz NICVFZKBHFNTOX-RYUDHWBXSA-N 1 1 238.400 3.716 20 0 BHADMO CCC[C@@H](C)C[N@H+]1CCC[C@@H]1c1nccs1 ZINC000375020681 169357684 /nfs/dbraw/zinc/35/76/84/169357684.db2.gz NICVFZKBHFNTOX-VXGBXAGGSA-N 1 1 238.400 3.716 20 0 BHADMO Fc1ccc(C[N@H+]2CCCC23CCCCC3)cn1 ZINC000375286783 387521161 /nfs/dbraw/zinc/52/11/61/387521161.db2.gz LRRKMZSYHRYJFV-UHFFFAOYSA-N 1 1 248.345 3.519 20 0 BHADMO Cc1oncc1C[N@H+]1CCC2(C1)CCCCCC2 ZINC000375344390 180554596 /nfs/dbraw/zinc/55/45/96/180554596.db2.gz DWMWXZCUCWTFCK-UHFFFAOYSA-N 1 1 248.370 3.529 20 0 BHADMO C1=C(C[N@H+]2CCCC23CCCCCC3)COCC1 ZINC000375357047 387531963 /nfs/dbraw/zinc/53/19/63/387531963.db2.gz PVBLCSNLEPJCNR-UHFFFAOYSA-N 1 1 249.398 3.522 20 0 BHADMO c1coc([C@H]2CCCC[N@@H+]2C2CCCC2)c1 ZINC000375833795 387585806 /nfs/dbraw/zinc/58/58/06/387585806.db2.gz VGIMKUMILCXQQI-CYBMUJFWSA-N 1 1 219.328 3.749 20 0 BHADMO c1coc([C@@H]2CCCC[N@@H+]2C2CCCC2)c1 ZINC000375833796 183511655 /nfs/dbraw/zinc/51/16/55/183511655.db2.gz VGIMKUMILCXQQI-ZDUSSCGKSA-N 1 1 219.328 3.749 20 0 BHADMO FCCCC[N@H+]1CCC[C@H]1c1cccc(F)c1 ZINC000377125857 387691422 /nfs/dbraw/zinc/69/14/22/387691422.db2.gz JCRFGECAWWFLBQ-AWEZNQCLSA-N 1 1 239.309 3.712 20 0 BHADMO FCCCC[N@H+]1CCC[C@@H]1c1cccc(F)c1 ZINC000377125858 387693626 /nfs/dbraw/zinc/69/36/26/387693626.db2.gz JCRFGECAWWFLBQ-CQSZACIVSA-N 1 1 239.309 3.712 20 0 BHADMO c1cc2c(cccc2C[N@H+]2CCCC23CCC3)[nH]1 ZINC000377200869 183339182 /nfs/dbraw/zinc/33/91/82/183339182.db2.gz BIHKYSUPZLCONG-UHFFFAOYSA-N 1 1 240.350 3.686 20 0 BHADMO CC1(C)CC[C@@H]([N@H+]2CCC[C@H]2c2ccncc2)C1 ZINC000377694061 357237581 /nfs/dbraw/zinc/23/75/81/357237581.db2.gz KVGGORDCHHBCHZ-CABCVRRESA-N 1 1 244.382 3.797 20 0 BHADMO CC1(C)CC[C@H]([N@H+]2CCC[C@H]2c2ccncc2)C1 ZINC000377694063 387739439 /nfs/dbraw/zinc/73/94/39/387739439.db2.gz KVGGORDCHHBCHZ-GJZGRUSLSA-N 1 1 244.382 3.797 20 0 BHADMO CC1(C)CC[C@@H]([N@H+]2CCC[C@@H]2c2ccncc2)C1 ZINC000377694065 357237471 /nfs/dbraw/zinc/23/74/71/357237471.db2.gz KVGGORDCHHBCHZ-HUUCEWRRSA-N 1 1 244.382 3.797 20 0 BHADMO CC1(C)CC[C@H]([N@H+]2CCC[C@@H]2c2ccncc2)C1 ZINC000377694068 188079045 /nfs/dbraw/zinc/07/90/45/188079045.db2.gz KVGGORDCHHBCHZ-LSDHHAIUSA-N 1 1 244.382 3.797 20 0 BHADMO FC(F)(F)CCCC[N@H+]1C[C@H]2CCCC[C@H]21 ZINC000377714663 387744494 /nfs/dbraw/zinc/74/44/94/387744494.db2.gz BTCKJZSWHOSKPI-GHMZBOCLSA-N 1 1 235.293 3.593 20 0 BHADMO Cc1n[nH]c(C)c1[C@@H]1CCCCC[N@@H+]1CC(C)C ZINC000377851300 387751630 /nfs/dbraw/zinc/75/16/30/387751630.db2.gz JIECYSAKTGKRIF-AWEZNQCLSA-N 1 1 249.402 3.600 20 0 BHADMO Cc1n[nH]c(C)c1[C@H]1CCCCC[N@@H+]1CC(C)C ZINC000377851301 387752766 /nfs/dbraw/zinc/75/27/66/387752766.db2.gz JIECYSAKTGKRIF-CQSZACIVSA-N 1 1 249.402 3.600 20 0 BHADMO CCC(CC)C[N@H+]1CCC[C@@H]1c1nccs1 ZINC000378338130 168350835 /nfs/dbraw/zinc/35/08/35/168350835.db2.gz RYLCWOCOQUJFPW-GFCCVEGCSA-N 1 1 238.400 3.716 20 0 BHADMO CCC(CC)C[N@H+]1CCC[C@H]1c1nccs1 ZINC000378338135 168352359 /nfs/dbraw/zinc/35/23/59/168352359.db2.gz RYLCWOCOQUJFPW-LBPRGKRZSA-N 1 1 238.400 3.716 20 0 BHADMO c1csc([C@H]2CCC[N@@H+]2C[C@@H]2CC=CCC2)n1 ZINC000378339688 187227641 /nfs/dbraw/zinc/22/76/41/187227641.db2.gz XZVFPOMPEZZKCR-CHWSQXEVSA-N 1 1 248.395 3.636 20 0 BHADMO c1csc([C@@H]2CCC[N@@H+]2C[C@@H]2CC=CCC2)n1 ZINC000378339690 387776960 /nfs/dbraw/zinc/77/69/60/387776960.db2.gz XZVFPOMPEZZKCR-OLZOCXBDSA-N 1 1 248.395 3.636 20 0 BHADMO c1csc([C@H]2CCC[N@@H+]2C[C@H]2CC=CCC2)n1 ZINC000378339693 188079313 /nfs/dbraw/zinc/07/93/13/188079313.db2.gz XZVFPOMPEZZKCR-QWHCGFSZSA-N 1 1 248.395 3.636 20 0 BHADMO c1csc([C@@H]2CCC[N@@H+]2C[C@H]2CC=CCC2)n1 ZINC000378339696 387776495 /nfs/dbraw/zinc/77/64/95/387776495.db2.gz XZVFPOMPEZZKCR-STQMWFEESA-N 1 1 248.395 3.636 20 0 BHADMO c1c[nH]c([C@@H]2CCC[N@@H+]2CCCC2CCCC2)n1 ZINC000378434717 183327575 /nfs/dbraw/zinc/32/75/75/183327575.db2.gz LMNKROAGCIBXDB-AWEZNQCLSA-N 1 1 247.386 3.517 20 0 BHADMO c1c[nH]c([C@H]2CCC[N@@H+]2CCCC2CCCC2)n1 ZINC000378434718 183327195 /nfs/dbraw/zinc/32/71/95/183327195.db2.gz LMNKROAGCIBXDB-CQSZACIVSA-N 1 1 247.386 3.517 20 0 BHADMO C[C@H](C[NH2+]CC(C)(F)F)c1cccc(Cl)c1 ZINC000378733493 346820545 /nfs/dbraw/zinc/82/05/45/346820545.db2.gz BMNOKJPTXOEVLD-SECBINFHSA-N 1 1 247.716 3.688 20 0 BHADMO C[C@@H](C[NH2+]CC(C)(F)F)c1cccc(Cl)c1 ZINC000378733502 356694542 /nfs/dbraw/zinc/69/45/42/356694542.db2.gz BMNOKJPTXOEVLD-VIFPVBQESA-N 1 1 247.716 3.688 20 0 BHADMO CC(C)C[C@@H](C)Nc1cccc(C2CC2)[nH+]1 ZINC000378770556 712360597 /nfs/dbraw/zinc/36/05/97/712360597.db2.gz BYYLYRZAZYMKJK-LLVKDONJSA-N 1 1 218.344 3.806 20 0 BHADMO CC(C)C[C@H](C)Nc1cccc(C2CC2)[nH+]1 ZINC000378770557 712360345 /nfs/dbraw/zinc/36/03/45/712360345.db2.gz BYYLYRZAZYMKJK-NSHDSACASA-N 1 1 218.344 3.806 20 0 BHADMO CC1(CNc2ccc(C3CCC3)c[nH+]2)CC1 ZINC000378846851 346845490 /nfs/dbraw/zinc/84/54/90/346845490.db2.gz AJSKAHTZMAJCED-UHFFFAOYSA-N 1 1 216.328 3.561 20 0 BHADMO C[C@@H](Nc1cccc2cc[nH+]cc21)C1CCC1 ZINC000379103719 353352566 /nfs/dbraw/zinc/35/25/66/353352566.db2.gz PQBVWYGEUVPLQC-LLVKDONJSA-N 1 1 226.323 3.835 20 0 BHADMO C[C@H](Nc1cccc2cc[nH+]cc21)C1CCC1 ZINC000379103721 353352594 /nfs/dbraw/zinc/35/25/94/353352594.db2.gz PQBVWYGEUVPLQC-NSHDSACASA-N 1 1 226.323 3.835 20 0 BHADMO CC(F)(F)CCNc1[nH+]ccc2ccccc21 ZINC000379262257 388602769 /nfs/dbraw/zinc/60/27/69/388602769.db2.gz NTBIGUQTWQDBOZ-UHFFFAOYSA-N 1 1 236.265 3.692 20 0 BHADMO CCCC[N@@H+](C)Cc1cscc1Cl ZINC000379372587 584129308 /nfs/dbraw/zinc/12/93/08/584129308.db2.gz JRFVZSUWINBFHI-UHFFFAOYSA-N 1 1 217.765 3.633 20 0 BHADMO CC[N@@H+](Cc1cscc1Cl)C(C)C ZINC000379382538 712379782 /nfs/dbraw/zinc/37/97/82/712379782.db2.gz JBUHDQJPHCUUBA-UHFFFAOYSA-N 1 1 217.765 3.632 20 0 BHADMO C[C@H]([N@@H+](C)C/C(Cl)=C\Cl)C(C)(C)C ZINC000379387070 711800982 /nfs/dbraw/zinc/80/09/82/711800982.db2.gz ZWYSJXNGENTDLL-CYXIBPNKSA-N 1 1 224.175 3.672 20 0 BHADMO C[C@H]([N@H+](C)C/C(Cl)=C\Cl)C(C)(C)C ZINC000379387070 711800980 /nfs/dbraw/zinc/80/09/80/711800980.db2.gz ZWYSJXNGENTDLL-CYXIBPNKSA-N 1 1 224.175 3.672 20 0 BHADMO C[C@@H]([N@@H+](C)C/C(Cl)=C\Cl)C(C)(C)C ZINC000379387071 712380844 /nfs/dbraw/zinc/38/08/44/712380844.db2.gz ZWYSJXNGENTDLL-GTUWVTDSSA-N 1 1 224.175 3.672 20 0 BHADMO C[C@@H]([N@H+](C)C/C(Cl)=C\Cl)C(C)(C)C ZINC000379387071 712380842 /nfs/dbraw/zinc/38/08/42/712380842.db2.gz ZWYSJXNGENTDLL-GTUWVTDSSA-N 1 1 224.175 3.672 20 0 BHADMO C[C@H]([N@@H+](C)C/C(Cl)=C/Cl)C(C)(C)C ZINC000379387072 712381034 /nfs/dbraw/zinc/38/10/34/712381034.db2.gz ZWYSJXNGENTDLL-HWPCKVLBSA-N 1 1 224.175 3.672 20 0 BHADMO C[C@H]([N@H+](C)C/C(Cl)=C/Cl)C(C)(C)C ZINC000379387072 712381033 /nfs/dbraw/zinc/38/10/33/712381033.db2.gz ZWYSJXNGENTDLL-HWPCKVLBSA-N 1 1 224.175 3.672 20 0 BHADMO C[C@@H]([N@@H+](C)C/C(Cl)=C/Cl)C(C)(C)C ZINC000379387073 712380718 /nfs/dbraw/zinc/38/07/18/712380718.db2.gz ZWYSJXNGENTDLL-WSQKDGNHSA-N 1 1 224.175 3.672 20 0 BHADMO C[C@@H]([N@H+](C)C/C(Cl)=C/Cl)C(C)(C)C ZINC000379387073 712380717 /nfs/dbraw/zinc/38/07/17/712380717.db2.gz ZWYSJXNGENTDLL-WSQKDGNHSA-N 1 1 224.175 3.672 20 0 BHADMO CC[N@@H+](C/C(Cl)=C\Cl)[C@@H](C)C(C)C ZINC000379387191 712380712 /nfs/dbraw/zinc/38/07/12/712380712.db2.gz GVVZYZXEWBPUAH-CMWXKVOJSA-N 1 1 224.175 3.672 20 0 BHADMO CC[N@@H+](C/C(Cl)=C/Cl)[C@@H](C)C(C)C ZINC000379387192 712380688 /nfs/dbraw/zinc/38/06/88/712380688.db2.gz GVVZYZXEWBPUAH-LKJZUNMESA-N 1 1 224.175 3.672 20 0 BHADMO CC[N@@H+](C/C(Cl)=C/Cl)[C@H](C)C(C)C ZINC000379387193 711800993 /nfs/dbraw/zinc/80/09/93/711800993.db2.gz GVVZYZXEWBPUAH-WPVMNKCKSA-N 1 1 224.175 3.672 20 0 BHADMO CC[N@@H+](C/C(Cl)=C\Cl)[C@H](C)C(C)C ZINC000379387194 712381090 /nfs/dbraw/zinc/38/10/90/712381090.db2.gz GVVZYZXEWBPUAH-ZFZMKPAXSA-N 1 1 224.175 3.672 20 0 BHADMO CC[N@@H+](C/C(Cl)=C\Cl)CC(C)(C)C ZINC000379392480 712381652 /nfs/dbraw/zinc/38/16/52/712381652.db2.gz RZGGPYNBFSSBQN-RMKNXTFCSA-N 1 1 224.175 3.673 20 0 BHADMO CC[N@H+](C/C(Cl)=C\Cl)CC(C)(C)C ZINC000379392480 712381651 /nfs/dbraw/zinc/38/16/51/712381651.db2.gz RZGGPYNBFSSBQN-RMKNXTFCSA-N 1 1 224.175 3.673 20 0 BHADMO CC[N@@H+](C/C(Cl)=C/Cl)CC(C)(C)C ZINC000379392481 712381367 /nfs/dbraw/zinc/38/13/67/712381367.db2.gz RZGGPYNBFSSBQN-TWGQIWQCSA-N 1 1 224.175 3.673 20 0 BHADMO CC[N@H+](C/C(Cl)=C/Cl)CC(C)(C)C ZINC000379392481 712381365 /nfs/dbraw/zinc/38/13/65/712381365.db2.gz RZGGPYNBFSSBQN-TWGQIWQCSA-N 1 1 224.175 3.673 20 0 BHADMO C[C@@H]([NH2+]CCF)c1cc(Cl)ccc1Cl ZINC000379515076 358532312 /nfs/dbraw/zinc/53/23/12/358532312.db2.gz WZAGWPZGXJUSDJ-SSDOTTSWSA-N 1 1 236.117 3.614 20 0 BHADMO C[C@H]([NH2+]CCF)c1cc(Cl)ccc1Cl ZINC000379515088 358533550 /nfs/dbraw/zinc/53/35/50/358533550.db2.gz WZAGWPZGXJUSDJ-ZETCQYMHSA-N 1 1 236.117 3.614 20 0 BHADMO CC(C)C[C@@H](C)Cn1cc[nH+]c1C(C)C ZINC000379742976 361394744 /nfs/dbraw/zinc/39/47/44/361394744.db2.gz KTBPKTXLLPYSER-GFCCVEGCSA-N 1 1 208.349 3.689 20 0 BHADMO CC(C)C[C@H](C)Cn1cc[nH+]c1C(C)C ZINC000379742977 361394971 /nfs/dbraw/zinc/39/49/71/361394971.db2.gz KTBPKTXLLPYSER-LBPRGKRZSA-N 1 1 208.349 3.689 20 0 BHADMO CC1(C)CC[C@H]1[NH2+]CC(F)(F)c1ccccc1 ZINC000379749501 361481653 /nfs/dbraw/zinc/48/16/53/361481653.db2.gz IMQAPSDCQFSRIY-GFCCVEGCSA-N 1 1 239.309 3.557 20 0 BHADMO CC1(C)CC[C@@H]1[NH2+]CC(F)(F)c1ccccc1 ZINC000379749502 361482232 /nfs/dbraw/zinc/48/22/32/361482232.db2.gz IMQAPSDCQFSRIY-LBPRGKRZSA-N 1 1 239.309 3.557 20 0 BHADMO CC(C)=CC[NH2+]C1(C(F)F)CCCCC1 ZINC000379876047 365333678 /nfs/dbraw/zinc/33/36/78/365333678.db2.gz AGRDKYVQXIMLOV-UHFFFAOYSA-N 1 1 217.303 3.510 20 0 BHADMO C[C@@H]1SCC[C@@H]1Nc1[nH+]ccc2ccccc21 ZINC000380033836 351329636 /nfs/dbraw/zinc/32/96/36/351329636.db2.gz PVOSRYURGSNXIA-GWCFXTLKSA-N 1 1 244.363 3.541 20 0 BHADMO C[C@@H]1SCC[C@H]1Nc1[nH+]ccc2ccccc21 ZINC000380033837 351329488 /nfs/dbraw/zinc/32/94/88/351329488.db2.gz PVOSRYURGSNXIA-GXFFZTMASA-N 1 1 244.363 3.541 20 0 BHADMO C[C@H]1SCC[C@@H]1Nc1[nH+]ccc2ccccc21 ZINC000380033838 351329290 /nfs/dbraw/zinc/32/92/90/351329290.db2.gz PVOSRYURGSNXIA-MFKMUULPSA-N 1 1 244.363 3.541 20 0 BHADMO C[C@H]1SCC[C@H]1Nc1[nH+]ccc2ccccc21 ZINC000380033840 351329744 /nfs/dbraw/zinc/32/97/44/351329744.db2.gz PVOSRYURGSNXIA-ZWNOBZJWSA-N 1 1 244.363 3.541 20 0 BHADMO CC(C)c1nc([C@H](C)[NH2+]C/C=C\Cl)cs1 ZINC000380067785 712684777 /nfs/dbraw/zinc/68/47/77/712684777.db2.gz CIUMJJSJFJIWTB-WBSSQXGSSA-N 1 1 244.791 3.670 20 0 BHADMO CC(C)c1nc([C@@H](C)[NH2+]C/C=C\Cl)cs1 ZINC000380067786 712684941 /nfs/dbraw/zinc/68/49/41/712684941.db2.gz CIUMJJSJFJIWTB-XRVBUDJMSA-N 1 1 244.791 3.670 20 0 BHADMO CC(C)=CCC[C@H](C)[NH2+]C1(C(F)F)CC1 ZINC000380093012 365875562 /nfs/dbraw/zinc/87/55/62/365875562.db2.gz JJYFOIHXPAOOJQ-JTQLQIEISA-N 1 1 217.303 3.509 20 0 BHADMO CC(C)=CCC[C@@H](C)[NH2+]C1(C(F)F)CC1 ZINC000380093018 365875572 /nfs/dbraw/zinc/87/55/72/365875572.db2.gz JJYFOIHXPAOOJQ-SNVBAGLBSA-N 1 1 217.303 3.509 20 0 BHADMO Cc1ccc(NCc2cscc2Cl)[nH+]c1 ZINC000380173256 712705866 /nfs/dbraw/zinc/70/58/66/712705866.db2.gz IPMHRYDQZRUARW-UHFFFAOYSA-N 1 1 238.743 3.717 20 0 BHADMO CCCCCNc1cc[nH+]c2ccsc21 ZINC000380317907 346375155 /nfs/dbraw/zinc/37/51/55/346375155.db2.gz JKOJGNKTCVRBMD-UHFFFAOYSA-N 1 1 220.341 3.898 20 0 BHADMO Cc1cc(C[N@@H+]2C[C@H](C)CC2(C)C)cc(C)c1O ZINC000380590227 359407479 /nfs/dbraw/zinc/40/74/79/359407479.db2.gz DAHUBYZVNUQRHP-LLVKDONJSA-N 1 1 247.382 3.629 20 0 BHADMO Cc1cc(C[N@@H+]2C[C@@H](C)CC2(C)C)cc(C)c1O ZINC000380590232 367248482 /nfs/dbraw/zinc/24/84/82/367248482.db2.gz DAHUBYZVNUQRHP-NSHDSACASA-N 1 1 247.382 3.629 20 0 BHADMO CC[N@@H+](Cc1cccc(Cl)n1)CC(C)(C)C ZINC000380668106 712902317 /nfs/dbraw/zinc/90/23/17/712902317.db2.gz AEICNTQNBPSOGY-UHFFFAOYSA-N 1 1 240.778 3.603 20 0 BHADMO CC[N@@H+](Cc1ccc(Cl)nc1)CC(C)(C)C ZINC000380701340 712902609 /nfs/dbraw/zinc/90/26/09/712902609.db2.gz KXWLUTWSQGKRFS-UHFFFAOYSA-N 1 1 240.778 3.603 20 0 BHADMO CC(C)[C@@H]1CCC[C@@H]([NH2+]C2(C(F)F)CC2)C1 ZINC000380980501 367329468 /nfs/dbraw/zinc/32/94/68/367329468.db2.gz AXHWSQLAXBPBJV-GHMZBOCLSA-N 1 1 231.330 3.589 20 0 BHADMO CC(C)[C@@H]1CCC[C@H]([NH2+]C2(C(F)F)CC2)C1 ZINC000380980507 350086322 /nfs/dbraw/zinc/08/63/22/350086322.db2.gz AXHWSQLAXBPBJV-MNOVXSKESA-N 1 1 231.330 3.589 20 0 BHADMO CC(C)[C@H]1CCC[C@H]([NH2+]C2(C(F)F)CC2)C1 ZINC000380980508 350086596 /nfs/dbraw/zinc/08/65/96/350086596.db2.gz AXHWSQLAXBPBJV-QWRGUYRKSA-N 1 1 231.330 3.589 20 0 BHADMO CC(C)[C@H]1CCC[C@@H]([NH2+]C2(C(F)F)CC2)C1 ZINC000380980512 367329713 /nfs/dbraw/zinc/32/97/13/367329713.db2.gz AXHWSQLAXBPBJV-WDEREUQCSA-N 1 1 231.330 3.589 20 0 BHADMO CCCC[C@@H](C)[N@@H+](C)Cc1cccc(Cl)n1 ZINC000380987196 710596645 /nfs/dbraw/zinc/59/66/45/710596645.db2.gz DHZSWAGUAOOLOY-LLVKDONJSA-N 1 1 240.778 3.746 20 0 BHADMO CCCC[C@H](C)[N@@H+](C)Cc1cccc(Cl)n1 ZINC000380987205 710597598 /nfs/dbraw/zinc/59/75/98/710597598.db2.gz DHZSWAGUAOOLOY-NSHDSACASA-N 1 1 240.778 3.746 20 0 BHADMO CCC[N@H+](Cc1ccnc(Cl)c1)CC(C)C ZINC000381101201 711512388 /nfs/dbraw/zinc/51/23/88/711512388.db2.gz XWPDPBANBUGRKV-UHFFFAOYSA-N 1 1 240.778 3.603 20 0 BHADMO CC[N@@H+](CCC(=O)c1ccccc1)CC(C)(C)C ZINC000381180065 344122738 /nfs/dbraw/zinc/12/27/38/344122738.db2.gz QLUTYRWTIWJJLB-UHFFFAOYSA-N 1 1 247.382 3.627 20 0 BHADMO CCCC[C@@H](C)[N@@H+](C)Cc1cccnc1Cl ZINC000381275801 710616139 /nfs/dbraw/zinc/61/61/39/710616139.db2.gz WXANODWADZSYFO-LLVKDONJSA-N 1 1 240.778 3.746 20 0 BHADMO CCCC[C@H](C)[N@@H+](C)Cc1cccnc1Cl ZINC000381275805 710616312 /nfs/dbraw/zinc/61/63/12/710616312.db2.gz WXANODWADZSYFO-NSHDSACASA-N 1 1 240.778 3.746 20 0 BHADMO Cc1cc(C[NH2+]Cc2ccc(Cl)o2)cs1 ZINC000381290332 398249744 /nfs/dbraw/zinc/24/97/44/398249744.db2.gz NIXCSQVDABDQFA-UHFFFAOYSA-N 1 1 241.743 3.593 20 0 BHADMO CCC1(C)CCC([NH2+]C2(C(F)F)CC2)CC1 ZINC000381321180 367381553 /nfs/dbraw/zinc/38/15/53/367381553.db2.gz OUMCXOHNJXLMEE-UHFFFAOYSA-N 1 1 231.330 3.733 20 0 BHADMO C[C@@H](CCC1CCCC1)[NH2+]C1(C(F)F)CC1 ZINC000381350244 345439202 /nfs/dbraw/zinc/43/92/02/345439202.db2.gz BKNOZNPHKQWRDM-JTQLQIEISA-N 1 1 231.330 3.733 20 0 BHADMO C[C@H](CCC1CCCC1)[NH2+]C1(C(F)F)CC1 ZINC000381350261 367385894 /nfs/dbraw/zinc/38/58/94/367385894.db2.gz BKNOZNPHKQWRDM-SNVBAGLBSA-N 1 1 231.330 3.733 20 0 BHADMO CC1(C)CCC(C[NH2+]C2(C(F)F)CC2)CC1 ZINC000381351201 345440650 /nfs/dbraw/zinc/44/06/50/345440650.db2.gz AWMIWYSAWPFVJA-UHFFFAOYSA-N 1 1 231.330 3.590 20 0 BHADMO FC(F)C1([NH2+][C@@H]2C=CCCC2)CCCCC1 ZINC000381483816 367416984 /nfs/dbraw/zinc/41/69/84/367416984.db2.gz GPLRTUAGTXXANP-LLVKDONJSA-N 1 1 229.314 3.653 20 0 BHADMO FC(F)C1([NH2+][C@H]2C=CCCC2)CCCCC1 ZINC000381483817 367416943 /nfs/dbraw/zinc/41/69/43/367416943.db2.gz GPLRTUAGTXXANP-NSHDSACASA-N 1 1 229.314 3.653 20 0 BHADMO CC(C)C[C@@H](C)C[C@@H](C)[NH2+]C1(C(F)F)CC1 ZINC000381521188 367424425 /nfs/dbraw/zinc/42/44/25/367424425.db2.gz UUONIMWHKXDHHS-GHMZBOCLSA-N 1 1 233.346 3.835 20 0 BHADMO CC(C)C[C@@H](C)C[C@H](C)[NH2+]C1(C(F)F)CC1 ZINC000381521190 346241230 /nfs/dbraw/zinc/24/12/30/346241230.db2.gz UUONIMWHKXDHHS-MNOVXSKESA-N 1 1 233.346 3.835 20 0 BHADMO CC(C)C[C@H](C)C[C@H](C)[NH2+]C1(C(F)F)CC1 ZINC000381521191 346241065 /nfs/dbraw/zinc/24/10/65/346241065.db2.gz UUONIMWHKXDHHS-QWRGUYRKSA-N 1 1 233.346 3.835 20 0 BHADMO CC(C)C[C@H](C)C[C@@H](C)[NH2+]C1(C(F)F)CC1 ZINC000381521192 346241043 /nfs/dbraw/zinc/24/10/43/346241043.db2.gz UUONIMWHKXDHHS-WDEREUQCSA-N 1 1 233.346 3.835 20 0 BHADMO CC[C@H](F)C[NH2+][C@H](C)c1ccc(F)cc1Cl ZINC000381561007 346352837 /nfs/dbraw/zinc/35/28/37/346352837.db2.gz RFSWRGCUNSVGPO-BDAKNGLRSA-N 1 1 247.716 3.878 20 0 BHADMO CC[C@@H](F)C[NH2+][C@@H](C)c1ccc(F)cc1Cl ZINC000381561008 346352703 /nfs/dbraw/zinc/35/27/03/346352703.db2.gz RFSWRGCUNSVGPO-DTWKUNHWSA-N 1 1 247.716 3.878 20 0 BHADMO CC[C@H](F)C[NH2+][C@@H](C)c1ccc(F)cc1Cl ZINC000381561009 346352821 /nfs/dbraw/zinc/35/28/21/346352821.db2.gz RFSWRGCUNSVGPO-IUCAKERBSA-N 1 1 247.716 3.878 20 0 BHADMO CC[C@@H](F)C[NH2+][C@H](C)c1ccc(F)cc1Cl ZINC000381561010 346352827 /nfs/dbraw/zinc/35/28/27/346352827.db2.gz RFSWRGCUNSVGPO-RKDXNWHRSA-N 1 1 247.716 3.878 20 0 BHADMO CC[C@@H](C)[NH2+]CC(F)(F)c1ccc(Cl)cc1 ZINC000381561856 367431408 /nfs/dbraw/zinc/43/14/08/367431408.db2.gz RNWRKWLQIDUXAU-SECBINFHSA-N 1 1 247.716 3.820 20 0 BHADMO CC[C@H](C)[NH2+]CC(F)(F)c1ccc(Cl)cc1 ZINC000381561857 367431262 /nfs/dbraw/zinc/43/12/62/367431262.db2.gz RNWRKWLQIDUXAU-VIFPVBQESA-N 1 1 247.716 3.820 20 0 BHADMO CCCc1[nH+]ccn1C[C@H]1CCCCC1(F)F ZINC000381605460 367437229 /nfs/dbraw/zinc/43/72/29/367437229.db2.gz NZUJEPJDHRKWQM-LLVKDONJSA-N 1 1 242.313 3.661 20 0 BHADMO CCCc1[nH+]ccn1C[C@@H]1CCCCC1(F)F ZINC000381605464 367437617 /nfs/dbraw/zinc/43/76/17/367437617.db2.gz NZUJEPJDHRKWQM-NSHDSACASA-N 1 1 242.313 3.661 20 0 BHADMO CC[C@H]([NH2+][C@@H]1CCCC1(F)F)c1cccs1 ZINC000381642483 539005887 /nfs/dbraw/zinc/00/58/87/539005887.db2.gz AWHJGJLEMLLQQT-GXSJLCMTSA-N 1 1 245.338 3.977 20 0 BHADMO CC[C@@H]([NH2+][C@H]1CCCC1(F)F)c1cccs1 ZINC000381642484 539006073 /nfs/dbraw/zinc/00/60/73/539006073.db2.gz AWHJGJLEMLLQQT-KOLCDFICSA-N 1 1 245.338 3.977 20 0 BHADMO CC[C@@H]([NH2+][C@@H]1CCCC1(F)F)c1cccs1 ZINC000381642485 539005936 /nfs/dbraw/zinc/00/59/36/539005936.db2.gz AWHJGJLEMLLQQT-MWLCHTKSSA-N 1 1 245.338 3.977 20 0 BHADMO CC[C@H]([NH2+][C@H]1CCCC1(F)F)c1cccs1 ZINC000381642486 539005951 /nfs/dbraw/zinc/00/59/51/539005951.db2.gz AWHJGJLEMLLQQT-ONGXEEELSA-N 1 1 245.338 3.977 20 0 BHADMO FC(F)C1([NH2+]CCCC2CCCCC2)CC1 ZINC000381801480 367459372 /nfs/dbraw/zinc/45/93/72/367459372.db2.gz DJGNNNDCHSGAIK-UHFFFAOYSA-N 1 1 231.330 3.734 20 0 BHADMO CC[C@@H](C)C[N@@H+](C)Cc1cccc(O)c1Cl ZINC000381977647 347006668 /nfs/dbraw/zinc/00/66/68/347006668.db2.gz APDWYEMBZQDYAZ-SNVBAGLBSA-N 1 1 241.762 3.524 20 0 BHADMO CC(C)[C@@H]([NH2+]CC(C)(F)F)c1ccccc1 ZINC000382175717 367493135 /nfs/dbraw/zinc/49/31/35/367493135.db2.gz XUWPOZXRSQJENB-GFCCVEGCSA-N 1 1 227.298 3.629 20 0 BHADMO CC(C)[C@H]([NH2+]CC(C)(F)F)c1ccccc1 ZINC000382175720 367493235 /nfs/dbraw/zinc/49/32/35/367493235.db2.gz XUWPOZXRSQJENB-LBPRGKRZSA-N 1 1 227.298 3.629 20 0 BHADMO CCC[N@@H+](Cc1cccc(O)c1Cl)C(C)C ZINC000382187922 487532733 /nfs/dbraw/zinc/53/27/33/487532733.db2.gz HGLMCOCGFMOHGV-UHFFFAOYSA-N 1 1 241.762 3.666 20 0 BHADMO C[C@H](Cc1ccc(Cl)cc1)[NH2+]CC(C)(F)F ZINC000382199991 367497444 /nfs/dbraw/zinc/49/74/44/367497444.db2.gz DULSCSHWKLGAAC-SECBINFHSA-N 1 1 247.716 3.516 20 0 BHADMO C[C@@H](Cc1ccc(Cl)cc1)[NH2+]CC(C)(F)F ZINC000382199993 367498447 /nfs/dbraw/zinc/49/84/47/367498447.db2.gz DULSCSHWKLGAAC-VIFPVBQESA-N 1 1 247.716 3.516 20 0 BHADMO CC(C)[C@H](C)[N@@H+](C)Cc1cccc(O)c1Cl ZINC000382311160 397881354 /nfs/dbraw/zinc/88/13/54/397881354.db2.gz QDDAMTSOOOWFBU-JTQLQIEISA-N 1 1 241.762 3.522 20 0 BHADMO CC(C)[C@@H](C)[N@@H+](C)Cc1cccc(O)c1Cl ZINC000382311161 397881407 /nfs/dbraw/zinc/88/14/07/397881407.db2.gz QDDAMTSOOOWFBU-SNVBAGLBSA-N 1 1 241.762 3.522 20 0 BHADMO F[C@@H]1CCCC[C@H]1[NH2+]Cc1cscc1Cl ZINC000382398138 487541445 /nfs/dbraw/zinc/54/14/45/487541445.db2.gz OVBCCBZFSRQEMU-GHMZBOCLSA-N 1 1 247.766 3.772 20 0 BHADMO F[C@@H]1CCCC[C@H]1[NH2+]Cc1ccsc1Cl ZINC000382413149 367517473 /nfs/dbraw/zinc/51/74/73/367517473.db2.gz VEAQOHIRRXQVGE-NXEZZACHSA-N 1 1 247.766 3.772 20 0 BHADMO CC(C)c1cccc(N[C@H]2CC[N@@H+](C)C[C@@H]2C)c1 ZINC000382831834 367562349 /nfs/dbraw/zinc/56/23/49/367562349.db2.gz JOILYFWUZCTCCW-BBRMVZONSA-N 1 1 246.398 3.562 20 0 BHADMO CC(C)c1cccc(N[C@H]2CC[N@@H+](C)C[C@H]2C)c1 ZINC000382831836 367561636 /nfs/dbraw/zinc/56/16/36/367561636.db2.gz JOILYFWUZCTCCW-CJNGLKHVSA-N 1 1 246.398 3.562 20 0 BHADMO CC(C)c1cccc(N[C@@H]2CC[N@@H+](C)C[C@H]2C)c1 ZINC000382831838 367562310 /nfs/dbraw/zinc/56/23/10/367562310.db2.gz JOILYFWUZCTCCW-CZUORRHYSA-N 1 1 246.398 3.562 20 0 BHADMO CC(C)c1cccc(N[C@@H]2CC[N@@H+](C)C[C@@H]2C)c1 ZINC000382831840 367562536 /nfs/dbraw/zinc/56/25/36/367562536.db2.gz JOILYFWUZCTCCW-XJKSGUPXSA-N 1 1 246.398 3.562 20 0 BHADMO CC(C)c1ccc(N[C@H]2CC[N@@H+](C)C[C@@H]2C)cc1 ZINC000382837295 367561828 /nfs/dbraw/zinc/56/18/28/367561828.db2.gz PYFCULFEIGFUGI-BBRMVZONSA-N 1 1 246.398 3.562 20 0 BHADMO CC(C)c1ccc(N[C@H]2CC[N@@H+](C)C[C@H]2C)cc1 ZINC000382837296 367561976 /nfs/dbraw/zinc/56/19/76/367561976.db2.gz PYFCULFEIGFUGI-CJNGLKHVSA-N 1 1 246.398 3.562 20 0 BHADMO CC(C)c1ccc(N[C@@H]2CC[N@@H+](C)C[C@H]2C)cc1 ZINC000382837297 367562505 /nfs/dbraw/zinc/56/25/05/367562505.db2.gz PYFCULFEIGFUGI-CZUORRHYSA-N 1 1 246.398 3.562 20 0 BHADMO CC(C)c1ccc(N[C@@H]2CC[N@@H+](C)C[C@@H]2C)cc1 ZINC000382837298 367562195 /nfs/dbraw/zinc/56/21/95/367562195.db2.gz PYFCULFEIGFUGI-XJKSGUPXSA-N 1 1 246.398 3.562 20 0 BHADMO FC1(F)CC(CNc2[nH+]ccc3ccccc32)C1 ZINC000383144417 367600475 /nfs/dbraw/zinc/60/04/75/367600475.db2.gz GFFRPQNQOHLNHR-UHFFFAOYSA-N 1 1 248.276 3.692 20 0 BHADMO C[C@H](c1ccccc1)[N@@H+](C)CCC(=O)C(C)(C)C ZINC000383851379 710965400 /nfs/dbraw/zinc/96/54/00/710965400.db2.gz QGMGVBPHZOJVPI-CYBMUJFWSA-N 1 1 247.382 3.685 20 0 BHADMO C[C@@H](c1ccccc1)[N@@H+](C)CCC(=O)C(C)(C)C ZINC000383851380 710965516 /nfs/dbraw/zinc/96/55/16/710965516.db2.gz QGMGVBPHZOJVPI-ZDUSSCGKSA-N 1 1 247.382 3.685 20 0 BHADMO CC[C@H]1[C@H](C)CC[N@H+]1Cc1cc(C)c(O)c(C)c1 ZINC000384313683 367684636 /nfs/dbraw/zinc/68/46/36/367684636.db2.gz MZDWWJWQNHEXLP-ABAIWWIYSA-N 1 1 247.382 3.629 20 0 BHADMO CC[C@@H]1[C@H](C)CC[N@H+]1Cc1cc(C)c(O)c(C)c1 ZINC000384313686 367684387 /nfs/dbraw/zinc/68/43/87/367684387.db2.gz MZDWWJWQNHEXLP-IAQYHMDHSA-N 1 1 247.382 3.629 20 0 BHADMO CC[C@H]1[C@@H](C)CC[N@H+]1Cc1cc(C)c(O)c(C)c1 ZINC000384313688 367684247 /nfs/dbraw/zinc/68/42/47/367684247.db2.gz MZDWWJWQNHEXLP-NHYWBVRUSA-N 1 1 247.382 3.629 20 0 BHADMO CC[C@@H]1[C@@H](C)CC[N@H+]1Cc1cc(C)c(O)c(C)c1 ZINC000384313690 367683982 /nfs/dbraw/zinc/68/39/82/367683982.db2.gz MZDWWJWQNHEXLP-XHDPSFHLSA-N 1 1 247.382 3.629 20 0 BHADMO C[C@H](CC(C)(C)C)[NH2+][C@@H]1C[C@H](N)c2ccccc21 ZINC000384474560 367693063 /nfs/dbraw/zinc/69/30/63/367693063.db2.gz UQOJCSXRHCCJCA-BYCMXARLSA-N 1 1 246.398 3.546 20 0 BHADMO C[C@H](CC(C)(C)C)[NH2+][C@H]1C[C@@H](N)c2ccccc21 ZINC000384474561 367692297 /nfs/dbraw/zinc/69/22/97/367692297.db2.gz UQOJCSXRHCCJCA-DFBGVHRSSA-N 1 1 246.398 3.546 20 0 BHADMO C[C@H](CC(C)(C)C)[NH2+][C@@H]1C[C@@H](N)c2ccccc21 ZINC000384474562 367692949 /nfs/dbraw/zinc/69/29/49/367692949.db2.gz UQOJCSXRHCCJCA-KCPJHIHWSA-N 1 1 246.398 3.546 20 0 BHADMO C[C@H](CC(C)(C)C)[NH2+][C@H]1C[C@H](N)c2ccccc21 ZINC000384474563 367692721 /nfs/dbraw/zinc/69/27/21/367692721.db2.gz UQOJCSXRHCCJCA-UGFHNGPFSA-N 1 1 246.398 3.546 20 0 BHADMO C[C@H](Cn1c[nH+]c2c1CCCC2)c1ccccc1 ZINC000384593473 367706666 /nfs/dbraw/zinc/70/66/66/367706666.db2.gz MTSFJIDEMDXXBC-CYBMUJFWSA-N 1 1 240.350 3.566 20 0 BHADMO C[C@@H](Cn1c[nH+]c2c1CCCC2)c1ccccc1 ZINC000384593492 367705825 /nfs/dbraw/zinc/70/58/25/367705825.db2.gz MTSFJIDEMDXXBC-ZDUSSCGKSA-N 1 1 240.350 3.566 20 0 BHADMO c1[nH+]c2c(n1CCC1=CCCCC1)CCCC2 ZINC000384986942 367769959 /nfs/dbraw/zinc/76/99/59/367769959.db2.gz SDBHDYYUPLWYIW-UHFFFAOYSA-N 1 1 230.355 3.652 20 0 BHADMO CCCC[C@H](C)[N@@H+](C)CCC(=O)c1ccccc1 ZINC000385900709 367879568 /nfs/dbraw/zinc/87/95/68/367879568.db2.gz GBXIJOHQOSBUHV-AWEZNQCLSA-N 1 1 247.382 3.770 20 0 BHADMO CCCC[C@@H](C)[N@@H+](C)CCC(=O)c1ccccc1 ZINC000385900711 367879756 /nfs/dbraw/zinc/87/97/56/367879756.db2.gz GBXIJOHQOSBUHV-CQSZACIVSA-N 1 1 247.382 3.770 20 0 BHADMO CCCC[C@H](C)[N@@H+](C)Cc1ccc(C#N)cc1C ZINC000386446609 362990602 /nfs/dbraw/zinc/99/06/02/362990602.db2.gz QSFYAECYWWUKSK-AWEZNQCLSA-N 1 1 244.382 3.877 20 0 BHADMO CCCC[C@@H](C)[N@@H+](C)Cc1ccc(C#N)cc1C ZINC000386446610 362989969 /nfs/dbraw/zinc/98/99/69/362989969.db2.gz QSFYAECYWWUKSK-CQSZACIVSA-N 1 1 244.382 3.877 20 0 BHADMO CCCCC[N@@H+](C/C=C\Cl)C(C)C ZINC000388332073 711058714 /nfs/dbraw/zinc/05/87/14/711058714.db2.gz FSNMEEUWIAQGKF-FPLPWBNLSA-N 1 1 203.757 3.640 20 0 BHADMO CCC[N@@H+](CC)Cc1cc(Cl)cs1 ZINC000388345817 347341511 /nfs/dbraw/zinc/34/15/11/347341511.db2.gz MCHZZZIUQOHCRX-UHFFFAOYSA-N 1 1 217.765 3.633 20 0 BHADMO CC[C@H](C)C[N@@H+](CC)C/C(Cl)=C\Cl ZINC000388616499 711063793 /nfs/dbraw/zinc/06/37/93/711063793.db2.gz CYQVDPAKTGFAMC-CMWXKVOJSA-N 1 1 224.175 3.673 20 0 BHADMO CC[C@H](C)C[N@@H+](CC)C/C(Cl)=C/Cl ZINC000388616501 711063918 /nfs/dbraw/zinc/06/39/18/711063918.db2.gz CYQVDPAKTGFAMC-LKJZUNMESA-N 1 1 224.175 3.673 20 0 BHADMO CC[C@@H](C)C[N@@H+](CC)C/C(Cl)=C/Cl ZINC000388616502 711064017 /nfs/dbraw/zinc/06/40/17/711064017.db2.gz CYQVDPAKTGFAMC-WPVMNKCKSA-N 1 1 224.175 3.673 20 0 BHADMO CC[C@@H](C)C[N@@H+](CC)C/C(Cl)=C\Cl ZINC000388616504 711063630 /nfs/dbraw/zinc/06/36/30/711063630.db2.gz CYQVDPAKTGFAMC-ZFZMKPAXSA-N 1 1 224.175 3.673 20 0 BHADMO CC[C@H]1CCCC[N@H+]1C/C(Cl)=C\Cl ZINC000388617586 711064270 /nfs/dbraw/zinc/06/42/70/711064270.db2.gz BEAKUXVAEZDDBR-PCYYEKQGSA-N 1 1 222.159 3.570 20 0 BHADMO CC[C@H]1CCCC[N@@H+]1C/C(Cl)=C\Cl ZINC000388617586 711064268 /nfs/dbraw/zinc/06/42/68/711064268.db2.gz BEAKUXVAEZDDBR-PCYYEKQGSA-N 1 1 222.159 3.570 20 0 BHADMO CC[C@@H]1CCCC[N@H+]1C/C(Cl)=C\Cl ZINC000388617588 711064259 /nfs/dbraw/zinc/06/42/59/711064259.db2.gz BEAKUXVAEZDDBR-TTZKWOQHSA-N 1 1 222.159 3.570 20 0 BHADMO CC[C@@H]1CCCC[N@@H+]1C/C(Cl)=C\Cl ZINC000388617588 711064257 /nfs/dbraw/zinc/06/42/57/711064257.db2.gz BEAKUXVAEZDDBR-TTZKWOQHSA-N 1 1 222.159 3.570 20 0 BHADMO C[C@H]1CCCCC[N@H+]1C/C(Cl)=C\Cl ZINC000388822305 711069582 /nfs/dbraw/zinc/06/95/82/711069582.db2.gz UJNNOIOBPHOZKP-HZAKCSEPSA-N 1 1 222.159 3.570 20 0 BHADMO C[C@@H]1CCCCC[N@H+]1C/C(Cl)=C\Cl ZINC000388822306 711068929 /nfs/dbraw/zinc/06/89/29/711068929.db2.gz UJNNOIOBPHOZKP-YIXGCBLDSA-N 1 1 222.159 3.570 20 0 BHADMO CCC[N@H+](C/C(Cl)=C/Cl)CC(C)C ZINC000388844040 711068844 /nfs/dbraw/zinc/06/88/44/711068844.db2.gz ZBJUOPJMBFXQAN-POHAHGRESA-N 1 1 224.175 3.673 20 0 BHADMO CCC[N@H+](C/C(Cl)=C\Cl)CC(C)C ZINC000388844043 711069282 /nfs/dbraw/zinc/06/92/82/711069282.db2.gz ZBJUOPJMBFXQAN-UXBLZVDNSA-N 1 1 224.175 3.673 20 0 BHADMO CC[C@@H](C)C[N@@H+](CC)Cc1csc(Cl)n1 ZINC000389328161 712689006 /nfs/dbraw/zinc/68/90/06/712689006.db2.gz HHBRHQLRBCRWNX-SECBINFHSA-N 1 1 246.807 3.665 20 0 BHADMO CC[C@H](C)C[N@@H+](CC)Cc1csc(Cl)n1 ZINC000389328167 712689002 /nfs/dbraw/zinc/68/90/02/712689002.db2.gz HHBRHQLRBCRWNX-VIFPVBQESA-N 1 1 246.807 3.665 20 0 BHADMO C[C@H]([NH2+]C1CC(c2ccccc2)C1)C(C)(F)F ZINC000389458758 356678339 /nfs/dbraw/zinc/67/83/39/356678339.db2.gz APWQHIAJYBDSII-PKSQDBQZSA-N 1 1 239.309 3.566 20 0 BHADMO C[C@@H]([NH2+]C1CC(c2ccccc2)C1)C(C)(F)F ZINC000389458934 356678449 /nfs/dbraw/zinc/67/84/49/356678449.db2.gz APWQHIAJYBDSII-QFWMXSHPSA-N 1 1 239.309 3.566 20 0 BHADMO C[C@H]([NH2+][C@H]1CCCc2ccccc21)C(C)(F)F ZINC000389464737 356679398 /nfs/dbraw/zinc/67/93/98/356679398.db2.gz HSHSCGVCAVKVGU-GWCFXTLKSA-N 1 1 239.309 3.697 20 0 BHADMO C[C@H]([NH2+][C@@H]1CCCc2ccccc21)C(C)(F)F ZINC000389464738 356679435 /nfs/dbraw/zinc/67/94/35/356679435.db2.gz HSHSCGVCAVKVGU-GXFFZTMASA-N 1 1 239.309 3.697 20 0 BHADMO C[C@@H]([NH2+][C@H]1CCCc2ccccc21)C(C)(F)F ZINC000389464739 356679500 /nfs/dbraw/zinc/67/95/00/356679500.db2.gz HSHSCGVCAVKVGU-MFKMUULPSA-N 1 1 239.309 3.697 20 0 BHADMO C[C@@H]([NH2+][C@@H]1CCCc2ccccc21)C(C)(F)F ZINC000389464740 356679773 /nfs/dbraw/zinc/67/97/73/356679773.db2.gz HSHSCGVCAVKVGU-ZWNOBZJWSA-N 1 1 239.309 3.697 20 0 BHADMO C[C@H](CC[NH2+][C@@H](C)C(C)(F)F)c1ccccc1 ZINC000389467523 356682102 /nfs/dbraw/zinc/68/21/02/356682102.db2.gz MKTLLRJUCSVSGG-NEPJUHHUSA-N 1 1 241.325 3.814 20 0 BHADMO C[C@@H]([NH2+]CC[C@H](C)c1ccccc1)C(C)(F)F ZINC000389467524 356682489 /nfs/dbraw/zinc/68/24/89/356682489.db2.gz MKTLLRJUCSVSGG-NWDGAFQWSA-N 1 1 241.325 3.814 20 0 BHADMO C[C@@H](CC[NH2+][C@@H](C)C(C)(F)F)c1ccccc1 ZINC000389467525 356681899 /nfs/dbraw/zinc/68/18/99/356681899.db2.gz MKTLLRJUCSVSGG-RYUDHWBXSA-N 1 1 241.325 3.814 20 0 BHADMO C[C@H](CC[NH2+][C@H](C)C(C)(F)F)c1ccccc1 ZINC000389467526 356682503 /nfs/dbraw/zinc/68/25/03/356682503.db2.gz MKTLLRJUCSVSGG-VXGBXAGGSA-N 1 1 241.325 3.814 20 0 BHADMO C[C@@H]([NH2+]Cc1cscc1Cl)c1ccoc1 ZINC000389596492 711081257 /nfs/dbraw/zinc/08/12/57/711081257.db2.gz PWZWFHMETIBCLE-MRVPVSSYSA-N 1 1 241.743 3.845 20 0 BHADMO C[C@H]([NH2+]Cc1cscc1Cl)c1ccoc1 ZINC000389596497 711081864 /nfs/dbraw/zinc/08/18/64/711081864.db2.gz PWZWFHMETIBCLE-QMMMGPOBSA-N 1 1 241.743 3.845 20 0 BHADMO Cc1ccc[nH+]c1NCc1cscc1Cl ZINC000389886256 539018501 /nfs/dbraw/zinc/01/85/01/539018501.db2.gz RQUNWHAKDXWHDX-UHFFFAOYSA-N 1 1 238.743 3.717 20 0 BHADMO CCCCCC[C@H](C)[NH2+]C1(C(F)F)CC1 ZINC000389893908 711095768 /nfs/dbraw/zinc/09/57/68/711095768.db2.gz XNJWHTVAOMULHG-JTQLQIEISA-N 1 1 219.319 3.733 20 0 BHADMO CCCCCC[C@@H](C)[NH2+]C1(C(F)F)CC1 ZINC000389893909 711096024 /nfs/dbraw/zinc/09/60/24/711096024.db2.gz XNJWHTVAOMULHG-SNVBAGLBSA-N 1 1 219.319 3.733 20 0 BHADMO Cc1cccc(NCc2cscc2Cl)[nH+]1 ZINC000389904098 712691104 /nfs/dbraw/zinc/69/11/04/712691104.db2.gz FXRMEWDENBFNNI-UHFFFAOYSA-N 1 1 238.743 3.717 20 0 BHADMO C[C@H](Cc1ccc(Cl)cc1)[NH2+][C@@H](C)C(F)F ZINC000389905151 398148608 /nfs/dbraw/zinc/14/86/08/398148608.db2.gz GHOTZYOVRKZNPI-BDAKNGLRSA-N 1 1 247.716 3.514 20 0 BHADMO C[C@@H]([NH2+][C@@H](C)Cc1ccc(Cl)cc1)C(F)F ZINC000389905152 398183964 /nfs/dbraw/zinc/18/39/64/398183964.db2.gz GHOTZYOVRKZNPI-DTWKUNHWSA-N 1 1 247.716 3.514 20 0 BHADMO C[C@@H](Cc1ccc(Cl)cc1)[NH2+][C@@H](C)C(F)F ZINC000389905153 398148651 /nfs/dbraw/zinc/14/86/51/398148651.db2.gz GHOTZYOVRKZNPI-IUCAKERBSA-N 1 1 247.716 3.514 20 0 BHADMO C[C@H](Cc1ccc(Cl)cc1)[NH2+][C@H](C)C(F)F ZINC000389905154 398148622 /nfs/dbraw/zinc/14/86/22/398148622.db2.gz GHOTZYOVRKZNPI-RKDXNWHRSA-N 1 1 247.716 3.514 20 0 BHADMO FC1(C[NH2+]Cc2c(Cl)cccc2Cl)CC1 ZINC000389940737 357071690 /nfs/dbraw/zinc/07/16/90/357071690.db2.gz OOFMTMSGFVGYNY-UHFFFAOYSA-N 1 1 248.128 3.585 20 0 BHADMO CCCc1[nH+]ccn1CC1CCC(C)CC1 ZINC000390350864 357090426 /nfs/dbraw/zinc/09/04/26/357090426.db2.gz PHCUSYVAZWGXFW-UHFFFAOYSA-N 1 1 220.360 3.662 20 0 BHADMO CCCC1CCC([NH2+]C2(C(F)F)CC2)CC1 ZINC000390520539 259391902 /nfs/dbraw/zinc/39/19/02/259391902.db2.gz FFFJREIRFYHOID-UHFFFAOYSA-N 1 1 231.330 3.733 20 0 BHADMO FC(F)C1([NH2+]CCC2CCCCCC2)CC1 ZINC000390795722 385904873 /nfs/dbraw/zinc/90/48/73/385904873.db2.gz QVFYOPGTDQJEEQ-UHFFFAOYSA-N 1 1 231.330 3.734 20 0 BHADMO CCCC[N@@H+](CC)Cc1cccc(O)c1Cl ZINC000392962597 387305103 /nfs/dbraw/zinc/30/51/03/387305103.db2.gz PSNVRXWAVDPJQZ-UHFFFAOYSA-N 1 1 241.762 3.668 20 0 BHADMO c1cc2cc[nH+]cc2c(N[C@H]2CCC[C@H]3C[C@H]32)c1 ZINC000393378268 384198303 /nfs/dbraw/zinc/19/83/03/384198303.db2.gz NTLMPZAZZQMZJH-GUTXKFCHSA-N 1 1 238.334 3.835 20 0 BHADMO CCC[N@@H+](C)Cc1csc(Cl)c1Cl ZINC000393556143 259345096 /nfs/dbraw/zinc/34/50/96/259345096.db2.gz NZLQIHCRJBNTRE-UHFFFAOYSA-N 1 1 238.183 3.897 20 0 BHADMO CCC[N@H+](C)Cc1csc(Cl)c1Cl ZINC000393556143 259345095 /nfs/dbraw/zinc/34/50/95/259345095.db2.gz NZLQIHCRJBNTRE-UHFFFAOYSA-N 1 1 238.183 3.897 20 0 BHADMO CCCC[C@H](C)[N@@H+](C)C/C(Cl)=C/Cl ZINC000393579689 711164552 /nfs/dbraw/zinc/16/45/52/711164552.db2.gz CXNZBNKAPFLWBR-CBFJXKFUSA-N 1 1 224.175 3.816 20 0 BHADMO CCCC[C@H](C)[N@H+](C)C/C(Cl)=C/Cl ZINC000393579689 711164550 /nfs/dbraw/zinc/16/45/50/711164550.db2.gz CXNZBNKAPFLWBR-CBFJXKFUSA-N 1 1 224.175 3.816 20 0 BHADMO CCCC[C@H](C)[N@@H+](C)C/C(Cl)=C\Cl ZINC000393579692 711164617 /nfs/dbraw/zinc/16/46/17/711164617.db2.gz CXNZBNKAPFLWBR-HZAKCSEPSA-N 1 1 224.175 3.816 20 0 BHADMO CCCC[C@H](C)[N@H+](C)C/C(Cl)=C\Cl ZINC000393579692 711164615 /nfs/dbraw/zinc/16/46/15/711164615.db2.gz CXNZBNKAPFLWBR-HZAKCSEPSA-N 1 1 224.175 3.816 20 0 BHADMO CCCC[C@@H](C)[N@@H+](C)C/C(Cl)=C/Cl ZINC000393579695 711577704 /nfs/dbraw/zinc/57/77/04/711577704.db2.gz CXNZBNKAPFLWBR-SBMLRHLQSA-N 1 1 224.175 3.816 20 0 BHADMO CCCC[C@@H](C)[N@H+](C)C/C(Cl)=C/Cl ZINC000393579695 711577701 /nfs/dbraw/zinc/57/77/01/711577701.db2.gz CXNZBNKAPFLWBR-SBMLRHLQSA-N 1 1 224.175 3.816 20 0 BHADMO CCCC[C@@H](C)[N@@H+](C)C/C(Cl)=C\Cl ZINC000393579697 711627842 /nfs/dbraw/zinc/62/78/42/711627842.db2.gz CXNZBNKAPFLWBR-YIXGCBLDSA-N 1 1 224.175 3.816 20 0 BHADMO CCCC[C@@H](C)[N@H+](C)C/C(Cl)=C\Cl ZINC000393579697 711627841 /nfs/dbraw/zinc/62/78/41/711627841.db2.gz CXNZBNKAPFLWBR-YIXGCBLDSA-N 1 1 224.175 3.816 20 0 BHADMO FC1(C[NH2+]Cc2cccc(Cl)c2Cl)CC1 ZINC000393618578 357290190 /nfs/dbraw/zinc/29/01/90/357290190.db2.gz JRJLXSVACANOQZ-UHFFFAOYSA-N 1 1 248.128 3.585 20 0 BHADMO Clc1cscc1C[NH2+]Cc1ccsc1 ZINC000393658399 711168483 /nfs/dbraw/zinc/16/84/83/711168483.db2.gz ONXHYAPZLCTQOP-UHFFFAOYSA-N 1 1 243.784 3.753 20 0 BHADMO Cc1cc[nH+]c(N[C@H]2CC[C@H]2C(C)(C)C)c1 ZINC000393752816 259471232 /nfs/dbraw/zinc/47/12/32/259471232.db2.gz TYNYQXCVCVFNEZ-NEPJUHHUSA-N 1 1 218.344 3.627 20 0 BHADMO Cc1cc[nH+]c(N[C@@H]2CC[C@@H]2C(C)(C)C)c1 ZINC000393752821 387066954 /nfs/dbraw/zinc/06/69/54/387066954.db2.gz TYNYQXCVCVFNEZ-NWDGAFQWSA-N 1 1 218.344 3.627 20 0 BHADMO Cc1cc[nH+]c(N[C@H]2CC[C@@H]2C(C)(C)C)c1 ZINC000393752824 387067255 /nfs/dbraw/zinc/06/72/55/387067255.db2.gz TYNYQXCVCVFNEZ-RYUDHWBXSA-N 1 1 218.344 3.627 20 0 BHADMO Cc1cc[nH+]c(N[C@@H]2CC[C@H]2C(C)(C)C)c1 ZINC000393752829 387059812 /nfs/dbraw/zinc/05/98/12/387059812.db2.gz TYNYQXCVCVFNEZ-VXGBXAGGSA-N 1 1 218.344 3.627 20 0 BHADMO C[C@H](CCC(C)(C)C)[NH2+]C1(C(F)F)CC1 ZINC000393757820 323028893 /nfs/dbraw/zinc/02/88/93/323028893.db2.gz HTSLAIZOUQNLTG-SECBINFHSA-N 1 1 219.319 3.589 20 0 BHADMO C[C@@H](CCC(C)(C)C)[NH2+]C1(C(F)F)CC1 ZINC000393757821 259472853 /nfs/dbraw/zinc/47/28/53/259472853.db2.gz HTSLAIZOUQNLTG-VIFPVBQESA-N 1 1 219.319 3.589 20 0 BHADMO CC1(C)SC[C@H]1Nc1[nH+]ccc2ccccc21 ZINC000393783063 371526098 /nfs/dbraw/zinc/52/60/98/371526098.db2.gz REZGGMUQZCLIEJ-GFCCVEGCSA-N 1 1 244.363 3.541 20 0 BHADMO CC1(C)SC[C@@H]1Nc1[nH+]ccc2ccccc21 ZINC000393783064 371526304 /nfs/dbraw/zinc/52/63/04/371526304.db2.gz REZGGMUQZCLIEJ-LBPRGKRZSA-N 1 1 244.363 3.541 20 0 BHADMO CC1(C)CCC[C@H](C[NH2+]C2(C(F)F)CC2)C1 ZINC000393785877 371526704 /nfs/dbraw/zinc/52/67/04/371526704.db2.gz USAAICGDUWZKDP-JTQLQIEISA-N 1 1 231.330 3.590 20 0 BHADMO CC1(C)CCC[C@@H](C[NH2+]C2(C(F)F)CC2)C1 ZINC000393786198 359265431 /nfs/dbraw/zinc/26/54/31/359265431.db2.gz USAAICGDUWZKDP-SNVBAGLBSA-N 1 1 231.330 3.590 20 0 BHADMO CC[N@@H+](Cc1ccc(C#N)cc1C)CC(C)(C)C ZINC000394467163 342800330 /nfs/dbraw/zinc/80/03/30/342800330.db2.gz ZWOBGCVOWVSZDW-UHFFFAOYSA-N 1 1 244.382 3.735 20 0 BHADMO CC(C)c1[nH+]ccn1C[C@H]1CCCCC1(F)F ZINC000394510400 259361222 /nfs/dbraw/zinc/36/12/22/259361222.db2.gz YSHZXYHYDJRXMC-LLVKDONJSA-N 1 1 242.313 3.832 20 0 BHADMO CC(C)c1[nH+]ccn1C[C@@H]1CCCCC1(F)F ZINC000394510402 259361185 /nfs/dbraw/zinc/36/11/85/259361185.db2.gz YSHZXYHYDJRXMC-NSHDSACASA-N 1 1 242.313 3.832 20 0 BHADMO CC1(C)CC([NH2+]CC(F)(F)c2ccccc2)C1 ZINC000395177174 357415574 /nfs/dbraw/zinc/41/55/74/357415574.db2.gz LAVUKSCNOVHWIF-UHFFFAOYSA-N 1 1 239.309 3.557 20 0 BHADMO CC1(C)CC(Nc2cccc3cc[nH+]cc32)C1 ZINC000395304159 357422715 /nfs/dbraw/zinc/42/27/15/357422715.db2.gz SXBHEXBWTLFMSB-UHFFFAOYSA-N 1 1 226.323 3.835 20 0 BHADMO CC(C)[C@@H]1CCCC[N@H+]1Cc1ccc(C#N)cc1 ZINC000395790399 344564066 /nfs/dbraw/zinc/56/40/66/344564066.db2.gz UEJRRSYTSUMAEW-INIZCTEOSA-N 1 1 242.366 3.569 20 0 BHADMO CC(C)[C@H]1CCCC[N@H+]1Cc1ccc(C#N)cc1 ZINC000395790400 344563681 /nfs/dbraw/zinc/56/36/81/344563681.db2.gz UEJRRSYTSUMAEW-MRXNPFEDSA-N 1 1 242.366 3.569 20 0 BHADMO CC(C)[C@H]1CCCC[N@H+]1CCC(=O)C(C)(C)C ZINC000395953267 711217770 /nfs/dbraw/zinc/21/77/70/711217770.db2.gz ZLQCYCKMFJSPME-CYBMUJFWSA-N 1 1 239.403 3.502 20 0 BHADMO CC(C)[C@@H]1CCCC[N@H+]1CCC(=O)C(C)(C)C ZINC000395953270 711217623 /nfs/dbraw/zinc/21/76/23/711217623.db2.gz ZLQCYCKMFJSPME-ZDUSSCGKSA-N 1 1 239.403 3.502 20 0 BHADMO CC(C)C[C@H]1CCC[N@H+]1CCC(=O)C(C)(C)C ZINC000396956977 711374510 /nfs/dbraw/zinc/37/45/10/711374510.db2.gz VIJCJEKOSSXRPK-CYBMUJFWSA-N 1 1 239.403 3.502 20 0 BHADMO CC(C)C[C@@H]1CCC[N@H+]1CCC(=O)C(C)(C)C ZINC000396956978 711374022 /nfs/dbraw/zinc/37/40/22/711374022.db2.gz VIJCJEKOSSXRPK-ZDUSSCGKSA-N 1 1 239.403 3.502 20 0 BHADMO C[C@H]1C[C@@H](Nc2[nH+]ccc3ccccc32)CS1 ZINC000397881655 363727706 /nfs/dbraw/zinc/72/77/06/363727706.db2.gz YXLTWXOQSIIIDS-CMPLNLGQSA-N 1 1 244.363 3.541 20 0 BHADMO C[C@H]1C[C@H](Nc2[nH+]ccc3ccccc32)CS1 ZINC000397881659 350986056 /nfs/dbraw/zinc/98/60/56/350986056.db2.gz YXLTWXOQSIIIDS-JQWIXIFHSA-N 1 1 244.363 3.541 20 0 BHADMO C[C@@H]1C[C@H](Nc2[nH+]ccc3ccccc32)CS1 ZINC000397881662 350986166 /nfs/dbraw/zinc/98/61/66/350986166.db2.gz YXLTWXOQSIIIDS-PWSUYJOCSA-N 1 1 244.363 3.541 20 0 BHADMO C[C@@H]1C[C@@H](Nc2[nH+]ccc3ccccc32)CS1 ZINC000397881666 350985699 /nfs/dbraw/zinc/98/56/99/350985699.db2.gz YXLTWXOQSIIIDS-ZYHUDNBSSA-N 1 1 244.363 3.541 20 0 BHADMO CCCC[C@H]([NH2+]Cc1cocn1)c1ccccc1 ZINC000397942084 583113058 /nfs/dbraw/zinc/11/30/58/583113058.db2.gz VFPTUTMBPALPMB-HNNXBMFYSA-N 1 1 244.338 3.696 20 0 BHADMO CCCC[C@@H]([NH2+]Cc1cocn1)c1ccccc1 ZINC000397942087 583113221 /nfs/dbraw/zinc/11/32/21/583113221.db2.gz VFPTUTMBPALPMB-OAHLLOKOSA-N 1 1 244.338 3.696 20 0 BHADMO CC[C@@H]([NH2+][C@@H]1CCCC1(F)F)c1ccccc1 ZINC000398014031 583116909 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CC[N@@H+](Cc1cnc2ccc(C)cc2c1)C(C)C ZINC000411178448 191167543 /nfs/dbraw/zinc/16/75/43/191167543.db2.gz MDXQHKBXJZJYTO-UHFFFAOYSA-N 1 1 242.366 3.774 20 0 BHADMO Cc1ccc2ncc(C[N@H+](C)CC(C)C)cc2c1 ZINC000411191239 191167740 /nfs/dbraw/zinc/16/77/40/191167740.db2.gz JHMIOIPXTYLZNM-UHFFFAOYSA-N 1 1 242.366 3.631 20 0 BHADMO CCC[N@@H+](CC)Cc1cnc2ccc(C)cc2c1 ZINC000411195332 191167650 /nfs/dbraw/zinc/16/76/50/191167650.db2.gz RYOXKPAJONZOMK-UHFFFAOYSA-N 1 1 242.366 3.775 20 0 BHADMO Cc1ccc2ncc(C[N@H+](C)C3CCC3)cc2c1 ZINC000411294553 191175328 /nfs/dbraw/zinc/17/53/28/191175328.db2.gz MZKOIRWUSJLGBM-UHFFFAOYSA-N 1 1 240.350 3.528 20 0 BHADMO Cc1ccc2ncc(C[N@@H+]3CCC[C@H]3C)cc2c1 ZINC000411298324 191176421 /nfs/dbraw/zinc/17/64/21/191176421.db2.gz NOEZGQKCAXRDNI-CYBMUJFWSA-N 1 1 240.350 3.528 20 0 BHADMO Cc1ccc2ncc(C[N@@H+]3CCC[C@@H]3C)cc2c1 ZINC000411298326 191174939 /nfs/dbraw/zinc/17/49/39/191174939.db2.gz NOEZGQKCAXRDNI-ZDUSSCGKSA-N 1 1 240.350 3.528 20 0 BHADMO Fc1cccc([C@@H]2C[C@@H]2[N@H+]2CCC3(CCC3)C2)c1 ZINC000411320991 191177020 /nfs/dbraw/zinc/17/70/20/191177020.db2.gz TVIPVXAVDDBWQP-GJZGRUSLSA-N 1 1 245.341 3.558 20 0 BHADMO Fc1cccc([C@@H]2C[C@H]2[N@H+]2CCC3(CCC3)C2)c1 ZINC000411320994 191177136 /nfs/dbraw/zinc/17/71/36/191177136.db2.gz TVIPVXAVDDBWQP-LSDHHAIUSA-N 1 1 245.341 3.558 20 0 BHADMO CC[C@@H](C)[N@@H+](C)Cc1cnc2ccc(C)cc2c1 ZINC000411368737 191180146 /nfs/dbraw/zinc/18/01/46/191180146.db2.gz WCUSEAHIGGCGKU-CYBMUJFWSA-N 1 1 242.366 3.774 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1cnc2ccc(C)cc2c1 ZINC000411368740 191180398 /nfs/dbraw/zinc/18/03/98/191180398.db2.gz WCUSEAHIGGCGKU-ZDUSSCGKSA-N 1 1 242.366 3.774 20 0 BHADMO Fc1cccc([C@@H]2C[C@@H]2[N@H+]2CCCC3(CC3)C2)c1 ZINC000411547028 191192259 /nfs/dbraw/zinc/19/22/59/191192259.db2.gz BUOWPHKGCPGOPI-GJZGRUSLSA-N 1 1 245.341 3.558 20 0 BHADMO Fc1cccc([C@@H]2C[C@H]2[N@H+]2CCCC3(CC3)C2)c1 ZINC000411547034 191192794 /nfs/dbraw/zinc/19/27/94/191192794.db2.gz BUOWPHKGCPGOPI-LSDHHAIUSA-N 1 1 245.341 3.558 20 0 BHADMO CC[N@@H+](CCc1ccccn1)[C@@H]1CCCC[C@H]1C ZINC000411614470 191196793 /nfs/dbraw/zinc/19/67/93/191196793.db2.gz PUOBLDHPAPJPTL-GDBMZVCRSA-N 1 1 246.398 3.525 20 0 BHADMO CC[N@@H+](CCc1ccccn1)[C@@H]1CCCC[C@@H]1C ZINC000411614475 191196817 /nfs/dbraw/zinc/19/68/17/191196817.db2.gz PUOBLDHPAPJPTL-GOEBONIOSA-N 1 1 246.398 3.525 20 0 BHADMO CC[N@@H+](CCc1ccccn1)[C@H]1CCCC[C@@H]1C ZINC000411614477 191197364 /nfs/dbraw/zinc/19/73/64/191197364.db2.gz PUOBLDHPAPJPTL-HOCLYGCPSA-N 1 1 246.398 3.525 20 0 BHADMO CC[N@@H+](CCc1ccccn1)[C@H]1CCCC[C@H]1C ZINC000411614479 191196672 /nfs/dbraw/zinc/19/66/72/191196672.db2.gz PUOBLDHPAPJPTL-ZBFHGGJFSA-N 1 1 246.398 3.525 20 0 BHADMO c1ccc(C[N@H+]2CCSC3(CCC3)CC2)cc1 ZINC000411864316 191222067 /nfs/dbraw/zinc/22/20/67/191222067.db2.gz DMFPZHJRFBQNLN-UHFFFAOYSA-N 1 1 247.407 3.548 20 0 BHADMO C(C1CCCC1)[N@H+]1CCSC2(CCC2)CC1 ZINC000411868940 191223896 /nfs/dbraw/zinc/22/38/96/191223896.db2.gz MATBNWJNZWGREZ-UHFFFAOYSA-N 1 1 239.428 3.538 20 0 BHADMO CC1(C[N@H+]2CCSC3(CCC3)CC2)CCC1 ZINC000411874747 191226350 /nfs/dbraw/zinc/22/63/50/191226350.db2.gz IKGJNLPYKDJJQC-UHFFFAOYSA-N 1 1 239.428 3.538 20 0 BHADMO CCC[C@@H](C)[N@H+]1CCSC2(CCC2)CC1 ZINC000411875044 191225626 /nfs/dbraw/zinc/22/56/26/191225626.db2.gz KBRMEINPPDMRMQ-GFCCVEGCSA-N 1 1 227.417 3.537 20 0 BHADMO CCC[C@H](C)[N@H+]1CCSC2(CCC2)CC1 ZINC000411875045 191225353 /nfs/dbraw/zinc/22/53/53/191225353.db2.gz KBRMEINPPDMRMQ-LBPRGKRZSA-N 1 1 227.417 3.537 20 0 BHADMO CC/C=C\CC[N@H+]1Cc2ccc(C(C)=O)cc2C1 ZINC000411929828 191229253 /nfs/dbraw/zinc/22/92/53/191229253.db2.gz AIODWIFEUCNXCH-PLNGDYQASA-N 1 1 243.350 3.561 20 0 BHADMO CC/C=C\CC[N@@H+]1Cc2ccc(C(C)=O)cc2C1 ZINC000411929828 191229252 /nfs/dbraw/zinc/22/92/52/191229252.db2.gz AIODWIFEUCNXCH-PLNGDYQASA-N 1 1 243.350 3.561 20 0 BHADMO CC/C=C/CC[N@H+]1Cc2ccc(C(C)=O)cc2C1 ZINC000411929830 191229422 /nfs/dbraw/zinc/22/94/22/191229422.db2.gz AIODWIFEUCNXCH-SNAWJCMRSA-N 1 1 243.350 3.561 20 0 BHADMO CC/C=C/CC[N@@H+]1Cc2ccc(C(C)=O)cc2C1 ZINC000411929830 191229420 /nfs/dbraw/zinc/22/94/20/191229420.db2.gz AIODWIFEUCNXCH-SNAWJCMRSA-N 1 1 243.350 3.561 20 0 BHADMO CC(=O)c1ccc2c(c1)C[N@@H+](CCCC(C)C)C2 ZINC000411946343 191230063 /nfs/dbraw/zinc/23/00/63/191230063.db2.gz KTTYREMOLLWUKN-UHFFFAOYSA-N 1 1 245.366 3.641 20 0 BHADMO CC(=O)c1ccc2c(c1)C[N@H+](CCCC(C)C)C2 ZINC000411946343 191230061 /nfs/dbraw/zinc/23/00/61/191230061.db2.gz KTTYREMOLLWUKN-UHFFFAOYSA-N 1 1 245.366 3.641 20 0 BHADMO CC(=O)c1ccc2c(c1)C[N@@H+]([C@H](C)CC(C)C)C2 ZINC000411952793 191232259 /nfs/dbraw/zinc/23/22/59/191232259.db2.gz OILKJWWTRGIESY-GFCCVEGCSA-N 1 1 245.366 3.639 20 0 BHADMO CC(=O)c1ccc2c(c1)C[N@@H+]([C@@H](C)CC(C)C)C2 ZINC000411952794 191231780 /nfs/dbraw/zinc/23/17/80/191231780.db2.gz OILKJWWTRGIESY-LBPRGKRZSA-N 1 1 245.366 3.639 20 0 BHADMO CC(=O)c1ccc2c(c1)C[N@H+](CCC(C)(C)C)C2 ZINC000411953088 191232308 /nfs/dbraw/zinc/23/23/08/191232308.db2.gz VWUNELTTWBTQQH-UHFFFAOYSA-N 1 1 245.366 3.641 20 0 BHADMO FCCC[N@H+]1C[C@@H](c2ccccc2)C2(CCC2)C1 ZINC000411974894 191233465 /nfs/dbraw/zinc/23/34/65/191233465.db2.gz AYLRFVCQZCPMPD-HNNXBMFYSA-N 1 1 247.357 3.616 20 0 BHADMO FCCC[N@H+]1C[C@H](c2ccccc2)C2(CCC2)C1 ZINC000411974906 191233318 /nfs/dbraw/zinc/23/33/18/191233318.db2.gz AYLRFVCQZCPMPD-OAHLLOKOSA-N 1 1 247.357 3.616 20 0 BHADMO CC[N@@H+](Cc1occc1C)[C@H](C)c1ccccn1 ZINC000412023187 191238840 /nfs/dbraw/zinc/23/88/40/191238840.db2.gz BTCKIUUNBWCPAT-CYBMUJFWSA-N 1 1 244.338 3.566 20 0 BHADMO CC[N@@H+](Cc1occc1C)[C@@H](C)c1ccccn1 ZINC000412023188 191238202 /nfs/dbraw/zinc/23/82/02/191238202.db2.gz BTCKIUUNBWCPAT-ZDUSSCGKSA-N 1 1 244.338 3.566 20 0 BHADMO CC[N@@H+](CCSC(C)C)Cc1occc1C ZINC000412027647 191240047 /nfs/dbraw/zinc/24/00/47/191240047.db2.gz QDRQYWHXQAVAQK-UHFFFAOYSA-N 1 1 241.400 3.552 20 0 BHADMO CC[N@@H+](CCCCCF)Cc1occc1C ZINC000412029345 191240895 /nfs/dbraw/zinc/24/08/95/191240895.db2.gz UBMPPZKRXCZKDK-UHFFFAOYSA-N 1 1 227.323 3.550 20 0 BHADMO CC[N@@H+](CCCc1ccncc1)C1CC(C)(C)C1 ZINC000412029448 191242214 /nfs/dbraw/zinc/24/22/14/191242214.db2.gz CUODQFOERAUPRJ-UHFFFAOYSA-N 1 1 246.398 3.525 20 0 BHADMO CC[N@@H+](Cc1occc1C)[C@@H]1C=CCCC1 ZINC000412030853 191241091 /nfs/dbraw/zinc/24/10/91/191241091.db2.gz WXDJLMCOCOVNME-CYBMUJFWSA-N 1 1 219.328 3.519 20 0 BHADMO CC[N@@H+](Cc1occc1C)[C@H]1C=CCCC1 ZINC000412030857 191242245 /nfs/dbraw/zinc/24/22/45/191242245.db2.gz WXDJLMCOCOVNME-ZDUSSCGKSA-N 1 1 219.328 3.519 20 0 BHADMO C[C@H]1CC(C)(C)C[N@H+]1CCCCC(F)(F)F ZINC000412030897 191241329 /nfs/dbraw/zinc/24/13/29/191241329.db2.gz AGNIVYTWZCTFFN-JTQLQIEISA-N 1 1 237.309 3.839 20 0 BHADMO C[C@@H]1CC(C)(C)C[N@H+]1CCCCC(F)(F)F ZINC000412030906 191240798 /nfs/dbraw/zinc/24/07/98/191240798.db2.gz AGNIVYTWZCTFFN-SNVBAGLBSA-N 1 1 237.309 3.839 20 0 BHADMO CC[N@@H+](C[C@@H]1CCC(F)(F)C1)C1CC(C)(C)C1 ZINC000412034233 191247326 /nfs/dbraw/zinc/24/73/26/191247326.db2.gz JFSDEQWRDQGSRZ-LLVKDONJSA-N 1 1 245.357 3.932 20 0 BHADMO CC[N@@H+](C[C@H]1CCC(F)(F)C1)C1CC(C)(C)C1 ZINC000412034234 191247307 /nfs/dbraw/zinc/24/73/07/191247307.db2.gz JFSDEQWRDQGSRZ-NSHDSACASA-N 1 1 245.357 3.932 20 0 BHADMO CC[N@@H+](CCCCCF)C1CC(C)(C)C1 ZINC000412034997 191247598 /nfs/dbraw/zinc/24/75/98/191247598.db2.gz KEROETRDDOJYHF-UHFFFAOYSA-N 1 1 215.356 3.637 20 0 BHADMO CCc1ccc(C[N@H+](CC)C2CC(C)(C)C2)nc1 ZINC000412035032 191248394 /nfs/dbraw/zinc/24/83/94/191248394.db2.gz KIVCKYFKENDCEY-UHFFFAOYSA-N 1 1 246.398 3.655 20 0 BHADMO C[C@@H]1CC(C)(C)C[N@H+]1CCCCOC(C)(C)C ZINC000412035058 191246674 /nfs/dbraw/zinc/24/66/74/191246674.db2.gz FTPAVLWHWDXQDE-CYBMUJFWSA-N 1 1 241.419 3.702 20 0 BHADMO C[C@H]1CC(C)(C)C[N@H+]1CCCCOC(C)(C)C ZINC000412035059 191247695 /nfs/dbraw/zinc/24/76/95/191247695.db2.gz FTPAVLWHWDXQDE-ZDUSSCGKSA-N 1 1 241.419 3.702 20 0 BHADMO CC[N@@H+](Cc1ncc(C2CC2)o1)C1CC(C)(C)C1 ZINC000412038477 191246701 /nfs/dbraw/zinc/24/67/01/191246701.db2.gz OXNZWAUSZPBGMH-UHFFFAOYSA-N 1 1 248.370 3.563 20 0 BHADMO CC[N@@H+](CC1CC(F)(F)C1)C1CC(C)(C)C1 ZINC000412040503 191249614 /nfs/dbraw/zinc/24/96/14/191249614.db2.gz RJCVIGJUIQMTCJ-UHFFFAOYSA-N 1 1 231.330 3.542 20 0 BHADMO CC[N@@H+](Cc1ccc(C)nc1C)C1CC(C)(C)C1 ZINC000412040592 385633978 /nfs/dbraw/zinc/63/39/78/385633978.db2.gz RUMMQTIXYIABQJ-UHFFFAOYSA-N 1 1 246.398 3.709 20 0 BHADMO CC(=O)c1cccc(C[N@@H+]2CC(C)(C)C[C@H]2C)c1 ZINC000412045198 191242942 /nfs/dbraw/zinc/24/29/42/191242942.db2.gz PLUGCZQCAYHBPT-GFCCVEGCSA-N 1 1 245.366 3.510 20 0 BHADMO CC(=O)c1cccc(C[N@@H+]2CC(C)(C)C[C@@H]2C)c1 ZINC000412045200 191244159 /nfs/dbraw/zinc/24/41/59/191244159.db2.gz PLUGCZQCAYHBPT-LBPRGKRZSA-N 1 1 245.366 3.510 20 0 BHADMO C[C@@H]1CC(C)(C)C[N@H+]1C[C@@H]1CCC(F)(F)C1 ZINC000412048588 191244524 /nfs/dbraw/zinc/24/45/24/191244524.db2.gz VECTYRCPRFNFGG-GHMZBOCLSA-N 1 1 231.330 3.542 20 0 BHADMO C[C@@H]1CC(C)(C)C[N@H+]1C[C@H]1CCC(F)(F)C1 ZINC000412048589 191242595 /nfs/dbraw/zinc/24/25/95/191242595.db2.gz VECTYRCPRFNFGG-MNOVXSKESA-N 1 1 231.330 3.542 20 0 BHADMO C[C@H]1CC(C)(C)C[N@H+]1C[C@H]1CCC(F)(F)C1 ZINC000412048590 191243817 /nfs/dbraw/zinc/24/38/17/191243817.db2.gz VECTYRCPRFNFGG-QWRGUYRKSA-N 1 1 231.330 3.542 20 0 BHADMO C[C@H]1CC(C)(C)C[N@H+]1C[C@@H]1CCC(F)(F)C1 ZINC000412048591 191243980 /nfs/dbraw/zinc/24/39/80/191243980.db2.gz VECTYRCPRFNFGG-WDEREUQCSA-N 1 1 231.330 3.542 20 0 BHADMO CC(=O)c1ccc(C[N@@H+]2CC(C)(C)C[C@H]2C)cc1 ZINC000412049762 191244706 /nfs/dbraw/zinc/24/47/06/191244706.db2.gz WXHDEUZAQIEICG-GFCCVEGCSA-N 1 1 245.366 3.510 20 0 BHADMO CC(=O)c1ccc(C[N@@H+]2CC(C)(C)C[C@@H]2C)cc1 ZINC000412049764 191244869 /nfs/dbraw/zinc/24/48/69/191244869.db2.gz WXHDEUZAQIEICG-LBPRGKRZSA-N 1 1 245.366 3.510 20 0 BHADMO CCCC(CCC)SCCc1c[nH+]cn1C ZINC000412993804 191331481 /nfs/dbraw/zinc/33/14/81/191331481.db2.gz POQPIBVTYZEQNH-UHFFFAOYSA-N 1 1 240.416 3.665 20 0 BHADMO c1ccc(C[N@H+]2CC[C@H](SC3CCC3)C2)cc1 ZINC000412997849 191333773 /nfs/dbraw/zinc/33/37/73/191333773.db2.gz BHVCEUUVSQVHMX-HNNXBMFYSA-N 1 1 247.407 3.547 20 0 BHADMO 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ZINC000413004280 191336844 /nfs/dbraw/zinc/33/68/44/191336844.db2.gz WHEYBNMPIRCUCX-UHFFFAOYSA-N 1 1 242.313 3.661 20 0 BHADMO Cc1occc1CNc1[nH+]cccc1C(C)C ZINC000414310410 386114317 /nfs/dbraw/zinc/11/43/17/386114317.db2.gz HMTYDQHWESMABB-UHFFFAOYSA-N 1 1 230.311 3.719 20 0 BHADMO CC[N@@H+](Cc1ccoc1C)Cc1ccccc1 ZINC000414362300 398220466 /nfs/dbraw/zinc/22/04/66/398220466.db2.gz DXCLRWNOLJDPES-UHFFFAOYSA-N 1 1 229.323 3.610 20 0 BHADMO Cc1occc1C[N@H+]1CC[C@H]1c1ccccc1 ZINC000414365645 386148679 /nfs/dbraw/zinc/14/86/79/386148679.db2.gz MQAUGKFQFVHUGW-HNNXBMFYSA-N 1 1 227.307 3.535 20 0 BHADMO Cc1occc1C[N@H+]1CC[C@@H]1c1ccccc1 ZINC000414365646 386149086 /nfs/dbraw/zinc/14/90/86/386149086.db2.gz MQAUGKFQFVHUGW-OAHLLOKOSA-N 1 1 227.307 3.535 20 0 BHADMO CC[N@@H+](CCc1cccs1)Cc1ccoc1C ZINC000414366910 386159638 /nfs/dbraw/zinc/15/96/38/386159638.db2.gz CNGKJPLYYWVSCP-UHFFFAOYSA-N 1 1 249.379 3.714 20 0 BHADMO Cc1occc1C[N@@H+](Cc1ccccc1)C1CC1 ZINC000414367261 386162485 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/nfs/dbraw/zinc/17/78/71/386177871.db2.gz SKTSKDFSIFOKHR-CQSZACIVSA-N 1 1 247.363 3.987 20 0 BHADMO Cc1occc1C[N@H+]1CC[C@H](c2ccccc2)C1 ZINC000414373588 386177825 /nfs/dbraw/zinc/17/78/25/386177825.db2.gz SSOVNVKPYAAZAF-INIZCTEOSA-N 1 1 241.334 3.578 20 0 BHADMO Cc1occc1C[N@H+]1CC[C@@H](c2ccccc2)C1 ZINC000414373591 386178077 /nfs/dbraw/zinc/17/80/77/386178077.db2.gz SSOVNVKPYAAZAF-MRXNPFEDSA-N 1 1 241.334 3.578 20 0 BHADMO Cc1occc1C[N@@H+](Cc1cccs1)C1CC1 ZINC000414375043 386194265 /nfs/dbraw/zinc/19/42/65/386194265.db2.gz XLNABEIPIGCVIC-UHFFFAOYSA-N 1 1 247.363 3.814 20 0 BHADMO Cc1occc1C[N@H+]1CCC[C@@H]1c1cccs1 ZINC000414375145 386188217 /nfs/dbraw/zinc/18/82/17/386188217.db2.gz XWCYNHQLLXMXCN-CYBMUJFWSA-N 1 1 247.363 3.987 20 0 BHADMO Cc1occc1C[N@H+]1CCC[C@H]1c1cccs1 ZINC000414375147 386189337 /nfs/dbraw/zinc/18/93/37/386189337.db2.gz XWCYNHQLLXMXCN-ZDUSSCGKSA-N 1 1 247.363 3.987 20 0 BHADMO Cc1occc1C[N@H+]([C@H](C)c1ccco1)C1CC1 ZINC000414385173 386238882 /nfs/dbraw/zinc/23/88/82/386238882.db2.gz VEJIMDUXJJJDCI-LLVKDONJSA-N 1 1 245.322 3.907 20 0 BHADMO Cc1occc1C[N@@H+]([C@H](C)c1ccco1)C1CC1 ZINC000414385173 386238877 /nfs/dbraw/zinc/23/88/77/386238877.db2.gz VEJIMDUXJJJDCI-LLVKDONJSA-N 1 1 245.322 3.907 20 0 BHADMO Cc1occc1C[N@H+]([C@@H](C)c1ccco1)C1CC1 ZINC000414385177 386239780 /nfs/dbraw/zinc/23/97/80/386239780.db2.gz VEJIMDUXJJJDCI-NSHDSACASA-N 1 1 245.322 3.907 20 0 BHADMO Cc1occc1C[N@@H+]([C@@H](C)c1ccco1)C1CC1 ZINC000414385177 386239778 /nfs/dbraw/zinc/23/97/78/386239778.db2.gz VEJIMDUXJJJDCI-NSHDSACASA-N 1 1 245.322 3.907 20 0 BHADMO Cc1occc1C[N@H+]1CC2C[C@@H]3CC1C[C@H](C2)C3 ZINC000414387695 411413938 /nfs/dbraw/zinc/41/39/38/411413938.db2.gz ZGZNPCVWMHUINI-KKNUOHPOSA-N 1 1 245.366 3.599 20 0 BHADMO Cc1occc1C[NH2+]C1(c2ccccc2F)CC1 ZINC000414388415 386243030 /nfs/dbraw/zinc/24/30/30/386243030.db2.gz CBVNIDRWBAINRU-UHFFFAOYSA-N 1 1 245.297 3.506 20 0 BHADMO CCSCC[C@@H](C)[N@@H+](C)Cc1ccoc1C ZINC000414392697 386271148 /nfs/dbraw/zinc/27/11/48/386271148.db2.gz CIHYQBKPUOEWKI-LLVKDONJSA-N 1 1 241.400 3.552 20 0 BHADMO CCSCC[C@H](C)[N@@H+](C)Cc1ccoc1C ZINC000414392698 386271182 /nfs/dbraw/zinc/27/11/82/386271182.db2.gz CIHYQBKPUOEWKI-NSHDSACASA-N 1 1 241.400 3.552 20 0 BHADMO Cc1occc1C[N@@H+]1C[C@H](C)[C@@H]1c1ccccc1 ZINC000414393091 386271926 /nfs/dbraw/zinc/27/19/26/386271926.db2.gz CYDAEDXSJXZEEM-BLLLJJGKSA-N 1 1 241.334 3.781 20 0 BHADMO Cc1occc1C[N@@H+]1C[C@H](C)[C@H]1c1ccccc1 ZINC000414393093 386271262 /nfs/dbraw/zinc/27/12/62/386271262.db2.gz CYDAEDXSJXZEEM-LRDDRELGSA-N 1 1 241.334 3.781 20 0 BHADMO Cc1occc1C[N@@H+]1C[C@@H](C)[C@@H]1c1ccccc1 ZINC000414393094 386270917 /nfs/dbraw/zinc/27/09/17/386270917.db2.gz CYDAEDXSJXZEEM-MLGOLLRUSA-N 1 1 241.334 3.781 20 0 BHADMO Cc1occc1C[N@@H+]1C[C@@H](C)[C@H]1c1ccccc1 ZINC000414393097 191504081 /nfs/dbraw/zinc/50/40/81/191504081.db2.gz CYDAEDXSJXZEEM-WBMJQRKESA-N 1 1 241.334 3.781 20 0 BHADMO Cc1occc1C[N@H+](C)C1CCC(F)(F)CC1 ZINC000414437280 386454855 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/nfs/dbraw/zinc/71/68/93/385716893.db2.gz CFBGAEWHPHWGBA-UHFFFAOYSA-N 1 1 233.311 3.512 20 0 BHADMO CC[NH+](Cc1occc1C)Cc1occc1C ZINC000414545690 385714982 /nfs/dbraw/zinc/71/49/82/385714982.db2.gz FPHJZDINGMUINK-UHFFFAOYSA-N 1 1 233.311 3.512 20 0 BHADMO CC[N@H+](Cc1ccsc1C)Cc1occc1C ZINC000414548795 385722160 /nfs/dbraw/zinc/72/21/60/385722160.db2.gz KNINNNGHXPSFDH-UHFFFAOYSA-N 1 1 249.379 3.980 20 0 BHADMO CC[N@@H+](Cc1occc1C)Cc1sccc1C ZINC000414548862 385725965 /nfs/dbraw/zinc/72/59/65/385725965.db2.gz KYVFRIBLRGGYTR-UHFFFAOYSA-N 1 1 249.379 3.980 20 0 BHADMO CC[N@@H+](Cc1ccc(C)o1)Cc1occc1C ZINC000414550931 385728609 /nfs/dbraw/zinc/72/86/09/385728609.db2.gz OCTOREOMGBIUSO-UHFFFAOYSA-N 1 1 233.311 3.512 20 0 BHADMO CC[N@H+](Cc1ccc(C)o1)Cc1occc1C ZINC000414550931 385728605 /nfs/dbraw/zinc/72/86/05/385728605.db2.gz OCTOREOMGBIUSO-UHFFFAOYSA-N 1 1 233.311 3.512 20 0 BHADMO CC[N@H+](Cc1ccsc1)Cc1occc1C ZINC000414553616 385749585 /nfs/dbraw/zinc/74/95/85/385749585.db2.gz TWTIFIXHRBXSFD-UHFFFAOYSA-N 1 1 235.352 3.672 20 0 BHADMO CC[C@@H](C)C[NH2+]c1ccc2c(c1)CCCN2 ZINC000414843054 386757791 /nfs/dbraw/zinc/75/77/91/386757791.db2.gz BTXXOMVQPZPDBS-LLVKDONJSA-N 1 1 218.344 3.503 20 0 BHADMO CC[C@H](C)C[NH2+]c1ccc2c(c1)CCCN2 ZINC000414843060 386758193 /nfs/dbraw/zinc/75/81/93/386758193.db2.gz BTXXOMVQPZPDBS-NSHDSACASA-N 1 1 218.344 3.503 20 0 BHADMO CC1(C[NH2+]c2ccc3c(c2)CCCN3)CCC1 ZINC000414845806 487826271 /nfs/dbraw/zinc/82/62/71/487826271.db2.gz GEUSZEBLVPXEDG-UHFFFAOYSA-N 1 1 230.355 3.647 20 0 BHADMO CC(C)(C)C[NH2+]c1ccc2c(c1)CCCN2 ZINC000414852148 385671915 /nfs/dbraw/zinc/67/19/15/385671915.db2.gz PHSDLOYPURQTSI-UHFFFAOYSA-N 1 1 218.344 3.503 20 0 BHADMO C[C@@H]([NH2+]c1ccc2c(c1)CCCN2)C1CCC1 ZINC000414853278 385685671 /nfs/dbraw/zinc/68/56/71/385685671.db2.gz RORQTMZMEMHELU-LLVKDONJSA-N 1 1 230.355 3.645 20 0 BHADMO C[C@H]([NH2+]c1ccc2c(c1)CCCN2)C1CCC1 ZINC000414853280 385685849 /nfs/dbraw/zinc/68/58/49/385685849.db2.gz RORQTMZMEMHELU-NSHDSACASA-N 1 1 230.355 3.645 20 0 BHADMO CC(C)[C@H]1CC[N@H+]1C[C@@H]1C[C@H]1c1ccccc1 ZINC000417841187 386800562 /nfs/dbraw/zinc/80/05/62/386800562.db2.gz PAXJGEVYEAYLDW-HRCADAONSA-N 1 1 229.367 3.520 20 0 BHADMO CC(C)[C@@H]1CC[N@H+]1C[C@@H]1C[C@H]1c1ccccc1 ZINC000417841198 386800500 /nfs/dbraw/zinc/80/05/00/386800500.db2.gz PAXJGEVYEAYLDW-JYJNAYRXSA-N 1 1 229.367 3.520 20 0 BHADMO Cc1ccc[nH+]c1NC[C@@H]1C[C@H]1c1ccccc1 ZINC000417865804 386808057 /nfs/dbraw/zinc/80/80/57/386808057.db2.gz DECMIBLSJDNVIZ-GJZGRUSLSA-N 1 1 238.334 3.606 20 0 BHADMO C[N@@H+](Cc1ccncc1)[C@H]1CCC[C@H]1C(C)(C)C ZINC000418115887 387715254 /nfs/dbraw/zinc/71/52/54/387715254.db2.gz QANHVIDMGOTPPX-CABCVRRESA-N 1 1 246.398 3.728 20 0 BHADMO C[N@@H+](Cc1ccncc1)[C@H]1CCC[C@@H]1C(C)(C)C ZINC000418115888 387714909 /nfs/dbraw/zinc/71/49/09/387714909.db2.gz QANHVIDMGOTPPX-GJZGRUSLSA-N 1 1 246.398 3.728 20 0 BHADMO C[N@@H+](Cc1ccncc1)[C@@H]1CCC[C@H]1C(C)(C)C ZINC000418115889 387716574 /nfs/dbraw/zinc/71/65/74/387716574.db2.gz QANHVIDMGOTPPX-HUUCEWRRSA-N 1 1 246.398 3.728 20 0 BHADMO C[N@@H+](Cc1ccncc1)[C@@H]1CCC[C@@H]1C(C)(C)C ZINC000418115890 387715405 /nfs/dbraw/zinc/71/54/05/387715405.db2.gz QANHVIDMGOTPPX-LSDHHAIUSA-N 1 1 246.398 3.728 20 0 BHADMO C[N@@H+](Cc1ccccn1)[C@H]1CCC[C@H]1C(C)(C)C ZINC000418117235 387027439 /nfs/dbraw/zinc/02/74/39/387027439.db2.gz RIDWBTYZSVIXJP-CABCVRRESA-N 1 1 246.398 3.728 20 0 BHADMO C[N@@H+](Cc1ccccn1)[C@H]1CCC[C@@H]1C(C)(C)C ZINC000418117237 387026334 /nfs/dbraw/zinc/02/63/34/387026334.db2.gz RIDWBTYZSVIXJP-GJZGRUSLSA-N 1 1 246.398 3.728 20 0 BHADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@H]1C(C)(C)C ZINC000418117241 387029400 /nfs/dbraw/zinc/02/94/00/387029400.db2.gz RIDWBTYZSVIXJP-HUUCEWRRSA-N 1 1 246.398 3.728 20 0 BHADMO C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]1C(C)(C)C ZINC000418117242 191979341 /nfs/dbraw/zinc/97/93/41/191979341.db2.gz RIDWBTYZSVIXJP-LSDHHAIUSA-N 1 1 246.398 3.728 20 0 BHADMO C[N@@H+](Cc1cccnc1)[C@H]1CCC[C@H]1C(C)(C)C ZINC000418120138 387072166 /nfs/dbraw/zinc/07/21/66/387072166.db2.gz VTJXJKOCAWGWKV-CABCVRRESA-N 1 1 246.398 3.728 20 0 BHADMO C[N@@H+](Cc1cccnc1)[C@H]1CCC[C@@H]1C(C)(C)C ZINC000418120139 387071413 /nfs/dbraw/zinc/07/14/13/387071413.db2.gz VTJXJKOCAWGWKV-GJZGRUSLSA-N 1 1 246.398 3.728 20 0 BHADMO C[N@@H+](Cc1cccnc1)[C@@H]1CCC[C@H]1C(C)(C)C ZINC000418120140 387071937 /nfs/dbraw/zinc/07/19/37/387071937.db2.gz VTJXJKOCAWGWKV-HUUCEWRRSA-N 1 1 246.398 3.728 20 0 BHADMO C[N@@H+](Cc1cccnc1)[C@@H]1CCC[C@@H]1C(C)(C)C ZINC000418120141 387072474 /nfs/dbraw/zinc/07/24/74/387072474.db2.gz VTJXJKOCAWGWKV-LSDHHAIUSA-N 1 1 246.398 3.728 20 0 BHADMO CC[C@@H](C[N@@H+](C)CCCCOC)c1ccccc1 ZINC000418133279 387160706 /nfs/dbraw/zinc/16/07/06/387160706.db2.gz KESNZFWAHDYXRD-HNNXBMFYSA-N 1 1 249.398 3.539 20 0 BHADMO CC[C@H](C[N@@H+](C)CCCCOC)c1ccccc1 ZINC000418133280 387162057 /nfs/dbraw/zinc/16/20/57/387162057.db2.gz KESNZFWAHDYXRD-OAHLLOKOSA-N 1 1 249.398 3.539 20 0 BHADMO COCCCC[N@@H+](C)CC[C@H](C)c1ccccc1 ZINC000418148485 387178583 /nfs/dbraw/zinc/17/85/83/387178583.db2.gz SYWLDLYHLCJBRO-HNNXBMFYSA-N 1 1 249.398 3.539 20 0 BHADMO COCCCC[N@@H+](C)CC[C@@H](C)c1ccccc1 ZINC000418148487 387179454 /nfs/dbraw/zinc/17/94/54/387179454.db2.gz SYWLDLYHLCJBRO-OAHLLOKOSA-N 1 1 249.398 3.539 20 0 BHADMO c1cc2[nH+]ccc(NC[C@H]3CC34CC4)c2s1 ZINC000418996118 192096544 /nfs/dbraw/zinc/09/65/44/192096544.db2.gz SCEQGVUUPRIMSD-SECBINFHSA-N 1 1 230.336 3.508 20 0 BHADMO c1cc2[nH+]ccc(NC[C@@H]3CC34CC4)c2s1 ZINC000418996128 192097124 /nfs/dbraw/zinc/09/71/24/192097124.db2.gz SCEQGVUUPRIMSD-VIFPVBQESA-N 1 1 230.336 3.508 20 0 BHADMO CC[C@H](C[N@H+]1CCC[C@H]1c1ccc(C)cc1)OC ZINC000419180175 192101279 /nfs/dbraw/zinc/10/12/79/192101279.db2.gz XHOYJRGPQVMMIA-CVEARBPZSA-N 1 1 247.382 3.557 20 0 BHADMO CC[C@@H](C[N@H+]1CCC[C@H]1c1ccc(C)cc1)OC ZINC000419180176 192101817 /nfs/dbraw/zinc/10/18/17/192101817.db2.gz XHOYJRGPQVMMIA-HOTGVXAUSA-N 1 1 247.382 3.557 20 0 BHADMO CC[C@H](C[N@H+]1CCC[C@@H]1c1ccc(C)cc1)OC ZINC000419180177 192101704 /nfs/dbraw/zinc/10/17/04/192101704.db2.gz XHOYJRGPQVMMIA-HZPDHXFCSA-N 1 1 247.382 3.557 20 0 BHADMO CC[C@@H](C[N@H+]1CCC[C@@H]1c1ccc(C)cc1)OC ZINC000419180178 192101293 /nfs/dbraw/zinc/10/12/93/192101293.db2.gz XHOYJRGPQVMMIA-JKSUJKDBSA-N 1 1 247.382 3.557 20 0 BHADMO CC[C@H](C[N@H+]1CCC[C@@H]1c1ccccc1C)OC ZINC000419206124 192103575 /nfs/dbraw/zinc/10/35/75/192103575.db2.gz KHKYOBGXQSJUCA-GDBMZVCRSA-N 1 1 247.382 3.557 20 0 BHADMO CC[C@@H](C[N@H+]1CCC[C@@H]1c1ccccc1C)OC ZINC000419206125 192104264 /nfs/dbraw/zinc/10/42/64/192104264.db2.gz KHKYOBGXQSJUCA-GOEBONIOSA-N 1 1 247.382 3.557 20 0 BHADMO CC[C@@H](C[N@H+]1CCC[C@H]1c1ccccc1C)OC ZINC000419206126 192104040 /nfs/dbraw/zinc/10/40/40/192104040.db2.gz KHKYOBGXQSJUCA-HOCLYGCPSA-N 1 1 247.382 3.557 20 0 BHADMO CC[C@H](C[N@H+]1CCC[C@H]1c1ccccc1C)OC ZINC000419206127 192103776 /nfs/dbraw/zinc/10/37/76/192103776.db2.gz KHKYOBGXQSJUCA-ZBFHGGJFSA-N 1 1 247.382 3.557 20 0 BHADMO CC[C@H](C[N@H+]1CCC[C@H]1c1cccc(C)c1)OC ZINC000419212254 192105545 /nfs/dbraw/zinc/10/55/45/192105545.db2.gz UODBYTGAYPGQJU-CVEARBPZSA-N 1 1 247.382 3.557 20 0 BHADMO CC[C@@H](C[N@H+]1CCC[C@H]1c1cccc(C)c1)OC ZINC000419212255 192104634 /nfs/dbraw/zinc/10/46/34/192104634.db2.gz UODBYTGAYPGQJU-HOTGVXAUSA-N 1 1 247.382 3.557 20 0 BHADMO CC[C@H](C[N@H+]1CCC[C@@H]1c1cccc(C)c1)OC ZINC000419212256 192104969 /nfs/dbraw/zinc/10/49/69/192104969.db2.gz UODBYTGAYPGQJU-HZPDHXFCSA-N 1 1 247.382 3.557 20 0 BHADMO CC[C@@H](C[N@H+]1CCC[C@@H]1c1cccc(C)c1)OC ZINC000419212257 192104966 /nfs/dbraw/zinc/10/49/66/192104966.db2.gz UODBYTGAYPGQJU-JKSUJKDBSA-N 1 1 247.382 3.557 20 0 BHADMO CC[C@H](C[N@H+]1CCCC[C@H]1c1ccccc1)OC ZINC000419244378 192113468 /nfs/dbraw/zinc/11/34/68/192113468.db2.gz MWOMCBXRKXGXTF-CVEARBPZSA-N 1 1 247.382 3.639 20 0 BHADMO CC[C@@H](C[N@H+]1CCCC[C@H]1c1ccccc1)OC ZINC000419244379 192113227 /nfs/dbraw/zinc/11/32/27/192113227.db2.gz MWOMCBXRKXGXTF-HOTGVXAUSA-N 1 1 247.382 3.639 20 0 BHADMO CC[C@H](C[N@H+]1CCCC[C@@H]1c1ccccc1)OC ZINC000419244380 192113048 /nfs/dbraw/zinc/11/30/48/192113048.db2.gz MWOMCBXRKXGXTF-HZPDHXFCSA-N 1 1 247.382 3.639 20 0 BHADMO CC[C@@H](C[N@H+]1CCCC[C@@H]1c1ccccc1)OC ZINC000419244381 192113943 /nfs/dbraw/zinc/11/39/43/192113943.db2.gz MWOMCBXRKXGXTF-JKSUJKDBSA-N 1 1 247.382 3.639 20 0 BHADMO CC[C@@H](C[N@@H+]([C@@H](C)c1ccccc1)C1CC1)OC ZINC000419253900 192115846 /nfs/dbraw/zinc/11/58/46/192115846.db2.gz FFDNOFPFDQJRBL-BBRMVZONSA-N 1 1 247.382 3.637 20 0 BHADMO CC[C@@H](C[N@@H+]([C@H](C)c1ccccc1)C1CC1)OC ZINC000419253901 192115812 /nfs/dbraw/zinc/11/58/12/192115812.db2.gz FFDNOFPFDQJRBL-CJNGLKHVSA-N 1 1 247.382 3.637 20 0 BHADMO CC[C@H](C[N@@H+]([C@H](C)c1ccccc1)C1CC1)OC ZINC000419253902 192116151 /nfs/dbraw/zinc/11/61/51/192116151.db2.gz FFDNOFPFDQJRBL-CZUORRHYSA-N 1 1 247.382 3.637 20 0 BHADMO CC[C@H](C[N@@H+]([C@@H](C)c1ccccc1)C1CC1)OC ZINC000419253903 192115690 /nfs/dbraw/zinc/11/56/90/192115690.db2.gz FFDNOFPFDQJRBL-XJKSGUPXSA-N 1 1 247.382 3.637 20 0 BHADMO COCCCC[N@@H+](C)[C@H]1CCC[C@@H]1C(C)(C)C ZINC000419312260 192120478 /nfs/dbraw/zinc/12/04/78/192120478.db2.gz CNPZYPYWQMRKRH-KBPBESRZSA-N 1 1 241.419 3.560 20 0 BHADMO COCCCC[N@@H+](C)[C@H]1CCC[C@H]1C(C)(C)C ZINC000419312264 192119907 /nfs/dbraw/zinc/11/99/07/192119907.db2.gz CNPZYPYWQMRKRH-KGLIPLIRSA-N 1 1 241.419 3.560 20 0 BHADMO COCCCC[N@@H+](C)[C@@H]1CCC[C@@H]1C(C)(C)C ZINC000419312266 192119670 /nfs/dbraw/zinc/11/96/70/192119670.db2.gz CNPZYPYWQMRKRH-UONOGXRCSA-N 1 1 241.419 3.560 20 0 BHADMO COCCCC[N@@H+](C)[C@@H]1CCC[C@H]1C(C)(C)C ZINC000419312267 192121460 /nfs/dbraw/zinc/12/14/60/192121460.db2.gz CNPZYPYWQMRKRH-ZIAGYGMSSA-N 1 1 241.419 3.560 20 0 BHADMO C[C@@H]1[C@@H](C)[C@H](C)C[N@H+]1CCCCOC(C)(C)C ZINC000419335070 192124783 /nfs/dbraw/zinc/12/47/83/192124783.db2.gz HKAGEEDYIJKQEK-HZSPNIEDSA-N 1 1 241.419 3.558 20 0 BHADMO C[C@@H]1[C@H](C)C[N@@H+](CCCCOC(C)(C)C)[C@H]1C ZINC000419335071 192124942 /nfs/dbraw/zinc/12/49/42/192124942.db2.gz HKAGEEDYIJKQEK-MCIONIFRSA-N 1 1 241.419 3.558 20 0 BHADMO C[C@H]1[C@@H](C)[N@H+](CCCCOC(C)(C)C)C[C@H]1C ZINC000419335072 192124559 /nfs/dbraw/zinc/12/45/59/192124559.db2.gz HKAGEEDYIJKQEK-MGPQQGTHSA-N 1 1 241.419 3.558 20 0 BHADMO C[C@@H]1C[N@@H+](CCCCOC(C)(C)C)[C@@H](C)[C@H]1C ZINC000419335073 192125365 /nfs/dbraw/zinc/12/53/65/192125365.db2.gz HKAGEEDYIJKQEK-RDBSUJKOSA-N 1 1 241.419 3.558 20 0 BHADMO C[C@H]1[C@@H](C)[N@H+](CCCCC(F)(F)F)C[C@H]1C ZINC000419378490 192132675 /nfs/dbraw/zinc/13/26/75/192132675.db2.gz VQVHNGYVLDYPHQ-GMTAPVOTSA-N 1 1 237.309 3.695 20 0 BHADMO C[C@@H]1[C@H](C)C[N@@H+](CCCCC(F)(F)F)[C@H]1C ZINC000419378491 192132331 /nfs/dbraw/zinc/13/23/31/192132331.db2.gz VQVHNGYVLDYPHQ-MXWKQRLJSA-N 1 1 237.309 3.695 20 0 BHADMO C[C@@H]1[C@@H](C)[C@H](C)C[N@H+]1CCCCC(F)(F)F ZINC000419378492 192132917 /nfs/dbraw/zinc/13/29/17/192132917.db2.gz VQVHNGYVLDYPHQ-OUAUKWLOSA-N 1 1 237.309 3.695 20 0 BHADMO C[C@@H]1C[N@@H+](CCCCC(F)(F)F)[C@@H](C)[C@H]1C ZINC000419378493 192132313 /nfs/dbraw/zinc/13/23/13/192132313.db2.gz VQVHNGYVLDYPHQ-VWYCJHECSA-N 1 1 237.309 3.695 20 0 BHADMO COCCCC[N@@H+](C)C[C@H](C)C1CCCCC1 ZINC000419382832 192133460 /nfs/dbraw/zinc/13/34/60/192133460.db2.gz INTRTFHMNAPOPC-AWEZNQCLSA-N 1 1 241.419 3.561 20 0 BHADMO COCCCC[N@@H+](C)C[C@@H](C)C1CCCCC1 ZINC000419382833 192133733 /nfs/dbraw/zinc/13/37/33/192133733.db2.gz INTRTFHMNAPOPC-CQSZACIVSA-N 1 1 241.419 3.561 20 0 BHADMO C[C@@H](C1CCCCC1)[N@@H+](C)Cc1cccc(N)c1 ZINC000420364472 192223913 /nfs/dbraw/zinc/22/39/13/192223913.db2.gz QYOCIJJEHUGXPD-ZDUSSCGKSA-N 1 1 246.398 3.669 20 0 BHADMO CCC(C)(C)[C@@H]1CCC[N@H+]1Cc1cccc(N)c1 ZINC000420380476 192233342 /nfs/dbraw/zinc/23/33/42/192233342.db2.gz WVEWHJJFJMLAPM-HNNXBMFYSA-N 1 1 246.398 3.669 20 0 BHADMO CCC(C)(C)[C@H]1CCC[N@H+]1Cc1cccc(N)c1 ZINC000420380477 192233054 /nfs/dbraw/zinc/23/30/54/192233054.db2.gz WVEWHJJFJMLAPM-OAHLLOKOSA-N 1 1 246.398 3.669 20 0 BHADMO CC(C)=CC[N@H+]1CCC[C@H](CC(F)(F)F)C1 ZINC000420940974 192289063 /nfs/dbraw/zinc/28/90/63/192289063.db2.gz FBYCTUZNKAPJDO-LLVKDONJSA-N 1 1 235.293 3.617 20 0 BHADMO CC(C)=CC[N@H+]1CCC[C@@H](CC(F)(F)F)C1 ZINC000420940975 192289339 /nfs/dbraw/zinc/28/93/39/192289339.db2.gz FBYCTUZNKAPJDO-NSHDSACASA-N 1 1 235.293 3.617 20 0 BHADMO CC(C)CC[N@H+]1CCC[C@H](CC(F)(F)F)C1 ZINC000420943261 192288488 /nfs/dbraw/zinc/28/84/88/192288488.db2.gz ICPVZCWIBJCTGR-LLVKDONJSA-N 1 1 237.309 3.697 20 0 BHADMO CC(C)CC[N@H+]1CCC[C@@H](CC(F)(F)F)C1 ZINC000420943262 192288463 /nfs/dbraw/zinc/28/84/63/192288463.db2.gz ICPVZCWIBJCTGR-NSHDSACASA-N 1 1 237.309 3.697 20 0 BHADMO CC[C@@H](C)C[N@H+]1CCC[C@H](CC(F)(F)F)C1 ZINC000420944233 192276782 /nfs/dbraw/zinc/27/67/82/192276782.db2.gz JDAJYTWNSZZSDG-GHMZBOCLSA-N 1 1 237.309 3.697 20 0 BHADMO CC[C@@H](C)C[N@H+]1CCC[C@@H](CC(F)(F)F)C1 ZINC000420944234 192275387 /nfs/dbraw/zinc/27/53/87/192275387.db2.gz JDAJYTWNSZZSDG-MNOVXSKESA-N 1 1 237.309 3.697 20 0 BHADMO CC[C@H](C)C[N@H+]1CCC[C@@H](CC(F)(F)F)C1 ZINC000420944235 192275776 /nfs/dbraw/zinc/27/57/76/192275776.db2.gz JDAJYTWNSZZSDG-QWRGUYRKSA-N 1 1 237.309 3.697 20 0 BHADMO CC[C@H](C)C[N@H+]1CCC[C@H](CC(F)(F)F)C1 ZINC000420944236 192276498 /nfs/dbraw/zinc/27/64/98/192276498.db2.gz JDAJYTWNSZZSDG-WDEREUQCSA-N 1 1 237.309 3.697 20 0 BHADMO FC(F)(F)C[C@H]1CCC[N@@H+](CC2CCCC2)C1 ZINC000420950109 192275871 /nfs/dbraw/zinc/27/58/71/192275871.db2.gz POESEFZTRBUHSI-GFCCVEGCSA-N 1 1 249.320 3.841 20 0 BHADMO FC(F)(F)C[C@@H]1CCC[N@@H+](CC2CCCC2)C1 ZINC000420950111 192275330 /nfs/dbraw/zinc/27/53/30/192275330.db2.gz POESEFZTRBUHSI-LBPRGKRZSA-N 1 1 249.320 3.841 20 0 BHADMO CC1(C[N@H+]2CCC[C@H](CC(F)(F)F)C2)CCC1 ZINC000420951378 192277629 /nfs/dbraw/zinc/27/76/29/192277629.db2.gz QTBPOKHCGWGDOX-LLVKDONJSA-N 1 1 249.320 3.841 20 0 BHADMO CC1(C[N@H+]2CCC[C@@H](CC(F)(F)F)C2)CCC1 ZINC000420951380 192278409 /nfs/dbraw/zinc/27/84/09/192278409.db2.gz QTBPOKHCGWGDOX-NSHDSACASA-N 1 1 249.320 3.841 20 0 BHADMO CCC[C@@H](C)[N@H+]1CCC[C@H](CC(F)(F)F)C1 ZINC000420953635 192277993 /nfs/dbraw/zinc/27/79/93/192277993.db2.gz TYFSBZWQJVDSKH-GHMZBOCLSA-N 1 1 237.309 3.839 20 0 BHADMO CCC[C@@H](C)[N@H+]1CCC[C@@H](CC(F)(F)F)C1 ZINC000420953636 192278401 /nfs/dbraw/zinc/27/84/01/192278401.db2.gz TYFSBZWQJVDSKH-MNOVXSKESA-N 1 1 237.309 3.839 20 0 BHADMO CCC[C@H](C)[N@H+]1CCC[C@@H](CC(F)(F)F)C1 ZINC000420953637 192277724 /nfs/dbraw/zinc/27/77/24/192277724.db2.gz TYFSBZWQJVDSKH-QWRGUYRKSA-N 1 1 237.309 3.839 20 0 BHADMO CCC[C@H](C)[N@H+]1CCC[C@H](CC(F)(F)F)C1 ZINC000420953638 192278422 /nfs/dbraw/zinc/27/84/22/192278422.db2.gz TYFSBZWQJVDSKH-WDEREUQCSA-N 1 1 237.309 3.839 20 0 BHADMO FC(F)(F)C[C@H]1CCC[N@H+]([C@H]2C=CCCC2)C1 ZINC000420956142 192279019 /nfs/dbraw/zinc/27/90/19/192279019.db2.gz XUSHQDSOACXMAN-NEPJUHHUSA-N 1 1 247.304 3.760 20 0 BHADMO FC(F)(F)C[C@@H]1CCC[N@H+]([C@@H]2C=CCCC2)C1 ZINC000420956143 192280267 /nfs/dbraw/zinc/28/02/67/192280267.db2.gz XUSHQDSOACXMAN-NWDGAFQWSA-N 1 1 247.304 3.760 20 0 BHADMO FC(F)(F)C[C@@H]1CCC[N@H+]([C@H]2C=CCCC2)C1 ZINC000420956144 192279468 /nfs/dbraw/zinc/27/94/68/192279468.db2.gz XUSHQDSOACXMAN-RYUDHWBXSA-N 1 1 247.304 3.760 20 0 BHADMO FC(F)(F)C[C@H]1CCC[N@H+]([C@@H]2C=CCCC2)C1 ZINC000420956145 192279715 /nfs/dbraw/zinc/27/97/15/192279715.db2.gz XUSHQDSOACXMAN-VXGBXAGGSA-N 1 1 247.304 3.760 20 0 BHADMO C[C@@H](c1ccccn1)[N@H+]1CC[C@@H](C2CCCC2)C1 ZINC000420959492 192280984 /nfs/dbraw/zinc/28/09/84/192280984.db2.gz FCPSDQZXLDDYRH-DZGCQCFKSA-N 1 1 244.382 3.655 20 0 BHADMO C[C@H](c1ccccn1)[N@H+]1CC[C@H](C2CCCC2)C1 ZINC000420959495 192281990 /nfs/dbraw/zinc/28/19/90/192281990.db2.gz FCPSDQZXLDDYRH-HIFRSBDPSA-N 1 1 244.382 3.655 20 0 BHADMO C[C@H](c1ccccn1)[N@H+]1CC[C@@H](C2CCCC2)C1 ZINC000420959497 192281965 /nfs/dbraw/zinc/28/19/65/192281965.db2.gz FCPSDQZXLDDYRH-UKRRQHHQSA-N 1 1 244.382 3.655 20 0 BHADMO C[C@@H](c1ccccn1)[N@H+]1CC[C@H](C2CCCC2)C1 ZINC000420959499 192281678 /nfs/dbraw/zinc/28/16/78/192281678.db2.gz FCPSDQZXLDDYRH-ZFWWWQNUSA-N 1 1 244.382 3.655 20 0 BHADMO C[C@@H](c1cccnc1)[N@H+]1CC[C@H](C2CCCC2)C1 ZINC000420966012 192284924 /nfs/dbraw/zinc/28/49/24/192284924.db2.gz UMEQBYATDCNCGR-BBRMVZONSA-N 1 1 244.382 3.655 20 0 BHADMO C[C@H](c1cccnc1)[N@H+]1CC[C@H](C2CCCC2)C1 ZINC000420966013 192284540 /nfs/dbraw/zinc/28/45/40/192284540.db2.gz UMEQBYATDCNCGR-CJNGLKHVSA-N 1 1 244.382 3.655 20 0 BHADMO C[C@H](c1cccnc1)[N@H+]1CC[C@@H](C2CCCC2)C1 ZINC000420966014 192285466 /nfs/dbraw/zinc/28/54/66/192285466.db2.gz UMEQBYATDCNCGR-CZUORRHYSA-N 1 1 244.382 3.655 20 0 BHADMO C[C@@H](c1cccnc1)[N@H+]1CC[C@@H](C2CCCC2)C1 ZINC000420966015 192285169 /nfs/dbraw/zinc/28/51/69/192285169.db2.gz UMEQBYATDCNCGR-XJKSGUPXSA-N 1 1 244.382 3.655 20 0 BHADMO FC1(F)CC(C[N@H+]2CC[C@@H](C3CCCC3)C2)C1 ZINC000420966599 192284370 /nfs/dbraw/zinc/28/43/70/192284370.db2.gz VQQYUEQAGIVVDL-CYBMUJFWSA-N 1 1 243.341 3.544 20 0 BHADMO FC1(F)CC(C[N@H+]2CC[C@H](C3CCCC3)C2)C1 ZINC000420966608 192285359 /nfs/dbraw/zinc/28/53/59/192285359.db2.gz VQQYUEQAGIVVDL-ZDUSSCGKSA-N 1 1 243.341 3.544 20 0 BHADMO CC(C)[N@@H+](CCCF)[C@H](C)c1ccsc1 ZINC000420998166 192294935 /nfs/dbraw/zinc/29/49/35/192294935.db2.gz ASZKXUUBVFFJLQ-LLVKDONJSA-N 1 1 229.364 3.879 20 0 BHADMO CC(C)[N@@H+](CCCF)[C@@H](C)c1ccsc1 ZINC000420998167 192294254 /nfs/dbraw/zinc/29/42/54/192294254.db2.gz ASZKXUUBVFFJLQ-NSHDSACASA-N 1 1 229.364 3.879 20 0 BHADMO CCC[N@@H+](C(C)C)[C@H](C)c1ccsc1 ZINC000421004912 192298687 /nfs/dbraw/zinc/29/86/87/192298687.db2.gz IUEOGBIOLAJGSO-LLVKDONJSA-N 1 1 211.374 3.930 20 0 BHADMO CCC[N@@H+](C(C)C)[C@@H](C)c1ccsc1 ZINC000421004916 192298778 /nfs/dbraw/zinc/29/87/78/192298778.db2.gz IUEOGBIOLAJGSO-NSHDSACASA-N 1 1 211.374 3.930 20 0 BHADMO CC(C)[N@@H+](CC1CC1)[C@H](C)c1ccsc1 ZINC000421005484 192297423 /nfs/dbraw/zinc/29/74/23/192297423.db2.gz JIROHDGVJXQDEK-LLVKDONJSA-N 1 1 223.385 3.930 20 0 BHADMO CC(C)[N@@H+](CC1CC1)[C@@H](C)c1ccsc1 ZINC000421005485 192297839 /nfs/dbraw/zinc/29/78/39/192297839.db2.gz JIROHDGVJXQDEK-NSHDSACASA-N 1 1 223.385 3.930 20 0 BHADMO CCOCC[N@@H+](C(C)C)[C@H](C)c1ccsc1 ZINC000421006439 192298814 /nfs/dbraw/zinc/29/88/14/192298814.db2.gz JYKVQEJLVILFHW-GFCCVEGCSA-N 1 1 241.400 3.556 20 0 BHADMO CCOCC[N@@H+](C(C)C)[C@@H](C)c1ccsc1 ZINC000421006440 192298583 /nfs/dbraw/zinc/29/85/83/192298583.db2.gz JYKVQEJLVILFHW-LBPRGKRZSA-N 1 1 241.400 3.556 20 0 BHADMO COCCC[N@@H+](C(C)C)[C@H](C)c1ccsc1 ZINC000421012057 192301278 /nfs/dbraw/zinc/30/12/78/192301278.db2.gz PVNZJJILRWTLPK-GFCCVEGCSA-N 1 1 241.400 3.556 20 0 BHADMO COCCC[N@@H+](C(C)C)[C@@H](C)c1ccsc1 ZINC000421012061 192301245 /nfs/dbraw/zinc/30/12/45/192301245.db2.gz PVNZJJILRWTLPK-LBPRGKRZSA-N 1 1 241.400 3.556 20 0 BHADMO CSCC[N@@H+](C(C)C)[C@H](C)c1ccsc1 ZINC000421016766 192304353 /nfs/dbraw/zinc/30/43/53/192304353.db2.gz UZJFENQEBGZACT-LLVKDONJSA-N 1 1 243.441 3.883 20 0 BHADMO CSCC[N@@H+](C(C)C)[C@@H](C)c1ccsc1 ZINC000421016767 192303603 /nfs/dbraw/zinc/30/36/03/192303603.db2.gz UZJFENQEBGZACT-NSHDSACASA-N 1 1 243.441 3.883 20 0 BHADMO CO[C@H](C)C[N@@H+](C(C)C)[C@@H](C)c1ccsc1 ZINC000421017975 192304851 /nfs/dbraw/zinc/30/48/51/192304851.db2.gz VXARQKVEGPGXLH-NEPJUHHUSA-N 1 1 241.400 3.554 20 0 BHADMO CO[C@@H](C)C[N@@H+](C(C)C)[C@H](C)c1ccsc1 ZINC000421017976 192304865 /nfs/dbraw/zinc/30/48/65/192304865.db2.gz VXARQKVEGPGXLH-NWDGAFQWSA-N 1 1 241.400 3.554 20 0 BHADMO CO[C@@H](C)C[N@@H+](C(C)C)[C@@H](C)c1ccsc1 ZINC000421017977 192303331 /nfs/dbraw/zinc/30/33/31/192303331.db2.gz VXARQKVEGPGXLH-RYUDHWBXSA-N 1 1 241.400 3.554 20 0 BHADMO CO[C@H](C)C[N@@H+](C(C)C)[C@H](C)c1ccsc1 ZINC000421017978 192304468 /nfs/dbraw/zinc/30/44/68/192304468.db2.gz VXARQKVEGPGXLH-VXGBXAGGSA-N 1 1 241.400 3.554 20 0 BHADMO CC1(C)[C@H](c2ccccc2)CC[N@H+]1CCCF ZINC000421030065 192309401 /nfs/dbraw/zinc/30/94/01/192309401.db2.gz XZJBEZFXSJZUGJ-AWEZNQCLSA-N 1 1 235.346 3.614 20 0 BHADMO CC1(C)[C@@H](c2ccccc2)CC[N@H+]1CCCF ZINC000421030066 192308759 /nfs/dbraw/zinc/30/87/59/192308759.db2.gz XZJBEZFXSJZUGJ-CQSZACIVSA-N 1 1 235.346 3.614 20 0 BHADMO c1cc(C[N@H+]2CCC23CCC3)cc(C2CC2)c1 ZINC000421318354 192317042 /nfs/dbraw/zinc/31/70/42/192317042.db2.gz DZBXYTZXZWHJAJ-UHFFFAOYSA-N 1 1 227.351 3.692 20 0 BHADMO C[N@@H+](Cc1cccc(C2CC2)c1)C1CCC1 ZINC000421319387 192317101 /nfs/dbraw/zinc/31/71/01/192317101.db2.gz MLVHIWMSISGWOO-UHFFFAOYSA-N 1 1 215.340 3.548 20 0 BHADMO C[N@@H+](Cc1ccc[nH]1)Cc1cccc(C2CC2)c1 ZINC000421323520 192317579 /nfs/dbraw/zinc/31/75/79/192317579.db2.gz WFQWHSQWEGYKJO-UHFFFAOYSA-N 1 1 240.350 3.524 20 0 BHADMO C[N@@H+](Cc1ccoc1)Cc1cccc(C2CC2)c1 ZINC000421323898 192317641 /nfs/dbraw/zinc/31/76/41/192317641.db2.gz WVRMBGBJQLHXAX-UHFFFAOYSA-N 1 1 241.334 3.789 20 0 BHADMO C[N@@H+](Cc1cccc(C2CC2)c1)[C@H]1CCSC1 ZINC000421325566 192317618 /nfs/dbraw/zinc/31/76/18/192317618.db2.gz CRUVEPBSBNECFE-HNNXBMFYSA-N 1 1 247.407 3.501 20 0 BHADMO C[N@@H+](Cc1cccc(C2CC2)c1)[C@@H]1CCSC1 ZINC000421325569 192318402 /nfs/dbraw/zinc/31/84/02/192318402.db2.gz CRUVEPBSBNECFE-OAHLLOKOSA-N 1 1 247.407 3.501 20 0 BHADMO C[N@@H+](Cc1ccco1)Cc1cccc(C2CC2)c1 ZINC000421334714 388027334 /nfs/dbraw/zinc/02/73/34/388027334.db2.gz ZYAVHYJQJMCJEZ-UHFFFAOYSA-N 1 1 241.334 3.789 20 0 BHADMO c1cc(C[N@H+]2CCCSCC2)cc(C2CC2)c1 ZINC000421337434 192319012 /nfs/dbraw/zinc/31/90/12/192319012.db2.gz CFUFFNDKEZOAGH-UHFFFAOYSA-N 1 1 247.407 3.503 20 0 BHADMO c1cc(C[N@H+]2CC[C@H]2C2CC2)cc(C2CC2)c1 ZINC000421375903 192322649 /nfs/dbraw/zinc/32/26/49/192322649.db2.gz DLDMLJWSIXWJLH-INIZCTEOSA-N 1 1 227.351 3.548 20 0 BHADMO c1cc(C[N@H+]2CC[C@@H]2C2CC2)cc(C2CC2)c1 ZINC000421375904 192322624 /nfs/dbraw/zinc/32/26/24/192322624.db2.gz DLDMLJWSIXWJLH-MRXNPFEDSA-N 1 1 227.351 3.548 20 0 BHADMO CS[C@H]1CC[N@@H+](Cc2cccc(C3CC3)c2)C1 ZINC000421388373 192326801 /nfs/dbraw/zinc/32/68/01/192326801.db2.gz VJROPFHBMZBSKT-HNNXBMFYSA-N 1 1 247.407 3.501 20 0 BHADMO CS[C@@H]1CC[N@@H+](Cc2cccc(C3CC3)c2)C1 ZINC000421388374 192326871 /nfs/dbraw/zinc/32/68/71/192326871.db2.gz VJROPFHBMZBSKT-OAHLLOKOSA-N 1 1 247.407 3.501 20 0 BHADMO COC1([C@@H](C)Nc2cc(C)cc[nH+]2)CCCCC1 ZINC000421836954 192391044 /nfs/dbraw/zinc/39/10/44/192391044.db2.gz PRLJPVNHIFWWBV-CYBMUJFWSA-N 1 1 248.370 3.540 20 0 BHADMO COC1([C@H](C)Nc2cc(C)cc[nH+]2)CCCCC1 ZINC000421836956 192391490 /nfs/dbraw/zinc/39/14/90/192391490.db2.gz PRLJPVNHIFWWBV-ZDUSSCGKSA-N 1 1 248.370 3.540 20 0 BHADMO CC[C@H]([NH2+][C@H]1C[C@@H](N)c2ccccc21)C(C)(C)C ZINC000422863154 387743996 /nfs/dbraw/zinc/74/39/96/387743996.db2.gz RDAGRJFROUUKHH-ILXRZTDVSA-N 1 1 246.398 3.546 20 0 BHADMO CC[C@H]([NH2+][C@@H]1C[C@@H](N)c2ccccc21)C(C)(C)C ZINC000422863167 387743156 /nfs/dbraw/zinc/74/31/56/387743156.db2.gz RDAGRJFROUUKHH-KFWWJZLASA-N 1 1 246.398 3.546 20 0 BHADMO CC[C@H]([NH2+][C@H]1C[C@H](N)c2ccccc21)C(C)(C)C ZINC000422863169 387743359 /nfs/dbraw/zinc/74/33/59/387743359.db2.gz RDAGRJFROUUKHH-KKUMJFAQSA-N 1 1 246.398 3.546 20 0 BHADMO CC[C@H]([NH2+][C@@H]1C[C@H](N)c2ccccc21)C(C)(C)C ZINC000422863171 387743056 /nfs/dbraw/zinc/74/30/56/387743056.db2.gz RDAGRJFROUUKHH-ZNMIVQPWSA-N 1 1 246.398 3.546 20 0 BHADMO C[C@]12C[C@H]1CCC[C@@H]2[NH2+]c1ccc2c(c1)CCN2 ZINC000423204316 387988981 /nfs/dbraw/zinc/98/89/81/387988981.db2.gz ACZVUUWAEGJFTG-KCXAZCMYSA-N 1 1 242.366 3.645 20 0 BHADMO C[C@]12C[C@H]1CCC[C@H]2[NH2+]c1ccc2c(c1)CCN2 ZINC000423204319 387988908 /nfs/dbraw/zinc/98/89/08/387988908.db2.gz ACZVUUWAEGJFTG-WQVCFCJDSA-N 1 1 242.366 3.645 20 0 BHADMO C[C@@H]([NH2+]c1ccc2c(c1)CCN2)C1CCCC1 ZINC000423204391 387989154 /nfs/dbraw/zinc/98/91/54/387989154.db2.gz AMVMDAFMGATELZ-LLVKDONJSA-N 1 1 230.355 3.645 20 0 BHADMO C[C@H]([NH2+]c1ccc2c(c1)CCN2)C1CCCC1 ZINC000423204392 387989015 /nfs/dbraw/zinc/98/90/15/387989015.db2.gz AMVMDAFMGATELZ-NSHDSACASA-N 1 1 230.355 3.645 20 0 BHADMO CCCC[C@@H](C)[NH2+]c1ccc2c(c1)CCN2 ZINC000423204871 387989266 /nfs/dbraw/zinc/98/92/66/387989266.db2.gz ARDYTLHBMHQCMF-LLVKDONJSA-N 1 1 218.344 3.645 20 0 BHADMO CCCC[C@H](C)[NH2+]c1ccc2c(c1)CCN2 ZINC000423204873 387990208 /nfs/dbraw/zinc/99/02/08/387990208.db2.gz ARDYTLHBMHQCMF-NSHDSACASA-N 1 1 218.344 3.645 20 0 BHADMO C[C@H]1CCC[C@H]([NH2+]c2ccc3c(c2)CCN3)C1 ZINC000423205764 387990963 /nfs/dbraw/zinc/99/09/63/387990963.db2.gz BKEILWHEJOZUPB-AAEUAGOBSA-N 1 1 230.355 3.645 20 0 BHADMO C[C@@H]1CCC[C@@H]([NH2+]c2ccc3c(c2)CCN3)C1 ZINC000423205765 387991554 /nfs/dbraw/zinc/99/15/54/387991554.db2.gz BKEILWHEJOZUPB-DGCLKSJQSA-N 1 1 230.355 3.645 20 0 BHADMO C[C@H]1CCC[C@@H]([NH2+]c2ccc3c(c2)CCN3)C1 ZINC000423205766 387991113 /nfs/dbraw/zinc/99/11/13/387991113.db2.gz BKEILWHEJOZUPB-WCQYABFASA-N 1 1 230.355 3.645 20 0 BHADMO C[C@@H]1CCC[C@H]([NH2+]c2ccc3c(c2)CCN3)C1 ZINC000423205767 387991073 /nfs/dbraw/zinc/99/10/73/387991073.db2.gz BKEILWHEJOZUPB-YPMHNXCESA-N 1 1 230.355 3.645 20 0 BHADMO c1cc([NH2+][C@H]2CCCC23CCC3)cc2c1NCC2 ZINC000423205772 387991904 /nfs/dbraw/zinc/99/19/04/387991904.db2.gz BKHMBDOETHNSTD-HNNXBMFYSA-N 1 1 242.366 3.789 20 0 BHADMO c1cc([NH2+][C@@H]2CCCC23CCC3)cc2c1NCC2 ZINC000423205773 387991825 /nfs/dbraw/zinc/99/18/25/387991825.db2.gz BKHMBDOETHNSTD-OAHLLOKOSA-N 1 1 242.366 3.789 20 0 BHADMO c1cc([NH2+][C@@H]2CCC[C@@H]2C2CC2)cc2c1NCC2 ZINC000423206312 387992126 /nfs/dbraw/zinc/99/21/26/387992126.db2.gz BSQKSQFCCCASMP-GDBMZVCRSA-N 1 1 242.366 3.645 20 0 BHADMO c1cc([NH2+][C@@H]2CCC[C@H]2C2CC2)cc2c1NCC2 ZINC000423206314 387990845 /nfs/dbraw/zinc/99/08/45/387990845.db2.gz BSQKSQFCCCASMP-GOEBONIOSA-N 1 1 242.366 3.645 20 0 BHADMO c1cc([NH2+][C@H]2CCC[C@H]2C2CC2)cc2c1NCC2 ZINC000423206316 387992196 /nfs/dbraw/zinc/99/21/96/387992196.db2.gz BSQKSQFCCCASMP-HOCLYGCPSA-N 1 1 242.366 3.645 20 0 BHADMO c1cc([NH2+][C@H]2CCC[C@@H]2C2CC2)cc2c1NCC2 ZINC000423206319 387991450 /nfs/dbraw/zinc/99/14/50/387991450.db2.gz BSQKSQFCCCASMP-ZBFHGGJFSA-N 1 1 242.366 3.645 20 0 BHADMO c1cc([NH2+][C@H](C2CC2)C2CCC2)cc2c1NCC2 ZINC000423206828 387991539 /nfs/dbraw/zinc/99/15/39/387991539.db2.gz CEBRJRHOBZLYCW-INIZCTEOSA-N 1 1 242.366 3.645 20 0 BHADMO c1cc([NH2+][C@@H](C2CC2)C2CCC2)cc2c1NCC2 ZINC000423206829 387991678 /nfs/dbraw/zinc/99/16/78/387991678.db2.gz CEBRJRHOBZLYCW-MRXNPFEDSA-N 1 1 242.366 3.645 20 0 BHADMO C[C@H](CCC1CC1)[NH2+]c1ccc2c(c1)CCN2 ZINC000423208144 387992663 /nfs/dbraw/zinc/99/26/63/387992663.db2.gz DDNKRNACUQFUKT-LLVKDONJSA-N 1 1 230.355 3.645 20 0 BHADMO C[C@@H](CCC1CC1)[NH2+]c1ccc2c(c1)CCN2 ZINC000423208145 387993910 /nfs/dbraw/zinc/99/39/10/387993910.db2.gz DDNKRNACUQFUKT-NSHDSACASA-N 1 1 230.355 3.645 20 0 BHADMO CCC[C@@H](CC)[NH2+]c1ccc2c(c1)CCN2 ZINC000423209427 387994128 /nfs/dbraw/zinc/99/41/28/387994128.db2.gz FIDDHWCKUKMUSU-GFCCVEGCSA-N 1 1 218.344 3.645 20 0 BHADMO CCC[C@H](CC)[NH2+]c1ccc2c(c1)CCN2 ZINC000423209428 387993986 /nfs/dbraw/zinc/99/39/86/387993986.db2.gz FIDDHWCKUKMUSU-LBPRGKRZSA-N 1 1 218.344 3.645 20 0 BHADMO C[C@H]([NH2+]c1ccc2c(c1)CCN2)C(C)(C)C ZINC000423211386 387995719 /nfs/dbraw/zinc/99/57/19/387995719.db2.gz HCUXOSZSKJFKBT-JTQLQIEISA-N 1 1 218.344 3.501 20 0 BHADMO C[C@@H]([NH2+]c1ccc2c(c1)CCN2)C(C)(C)C ZINC000423211387 387994948 /nfs/dbraw/zinc/99/49/48/387994948.db2.gz HCUXOSZSKJFKBT-SNVBAGLBSA-N 1 1 218.344 3.501 20 0 BHADMO CC1(C)CC[C@@H]([NH2+]c2ccc3c(c2)CCN3)C1 ZINC000423211896 387995558 /nfs/dbraw/zinc/99/55/58/387995558.db2.gz HTHNZFWWDGQWIA-CYBMUJFWSA-N 1 1 230.355 3.645 20 0 BHADMO CC1(C)CC[C@H]([NH2+]c2ccc3c(c2)CCN3)C1 ZINC000423211897 387995878 /nfs/dbraw/zinc/99/58/78/387995878.db2.gz HTHNZFWWDGQWIA-ZDUSSCGKSA-N 1 1 230.355 3.645 20 0 BHADMO CC1CCC([NH2+]c2ccc3c(c2)CCN3)CC1 ZINC000423212916 387995579 /nfs/dbraw/zinc/99/55/79/387995579.db2.gz JERUIXIZCHGROX-UHFFFAOYSA-N 1 1 230.355 3.645 20 0 BHADMO C[C@H]([NH2+]c1ccc2c(c1)CCN2)[C@@H]1CC1(C)C ZINC000423214233 387998245 /nfs/dbraw/zinc/99/82/45/387998245.db2.gz LAJGFNNHGUFFBQ-GWCFXTLKSA-N 1 1 230.355 3.501 20 0 BHADMO C[C@H]([NH2+]c1ccc2c(c1)CCN2)[C@H]1CC1(C)C ZINC000423214235 387998398 /nfs/dbraw/zinc/99/83/98/387998398.db2.gz LAJGFNNHGUFFBQ-GXFFZTMASA-N 1 1 230.355 3.501 20 0 BHADMO C[C@@H]([NH2+]c1ccc2c(c1)CCN2)[C@@H]1CC1(C)C ZINC000423214236 192630431 /nfs/dbraw/zinc/63/04/31/192630431.db2.gz LAJGFNNHGUFFBQ-MFKMUULPSA-N 1 1 230.355 3.501 20 0 BHADMO C[C@@H]([NH2+]c1ccc2c(c1)CCN2)[C@H]1CC1(C)C ZINC000423214238 387996938 /nfs/dbraw/zinc/99/69/38/387996938.db2.gz LAJGFNNHGUFFBQ-ZWNOBZJWSA-N 1 1 230.355 3.501 20 0 BHADMO CC1(C)CCC[C@@H]1[NH2+]c1ccc2c(c1)CCN2 ZINC000423215835 387997010 /nfs/dbraw/zinc/99/70/10/387997010.db2.gz NQNCREKYBUYZRP-AWEZNQCLSA-N 1 1 230.355 3.645 20 0 BHADMO CC1(C)CCC[C@H]1[NH2+]c1ccc2c(c1)CCN2 ZINC000423215837 387997152 /nfs/dbraw/zinc/99/71/52/387997152.db2.gz NQNCREKYBUYZRP-CQSZACIVSA-N 1 1 230.355 3.645 20 0 BHADMO CC[C@@H]([NH2+]c1ccc2c(c1)CCN2)C(C)C ZINC000423217526 387999518 /nfs/dbraw/zinc/99/95/18/387999518.db2.gz QBDRKMIKFGCUHM-CYBMUJFWSA-N 1 1 218.344 3.501 20 0 BHADMO CC[C@H]([NH2+]c1ccc2c(c1)CCN2)C(C)C ZINC000423217527 388000341 /nfs/dbraw/zinc/00/03/41/388000341.db2.gz QBDRKMIKFGCUHM-ZDUSSCGKSA-N 1 1 218.344 3.501 20 0 BHADMO c1cc([NH2+]C2CCC3(CC3)CC2)cc2c1NCC2 ZINC000423219561 388000697 /nfs/dbraw/zinc/00/06/97/388000697.db2.gz UGYUBUHPTGNWEA-UHFFFAOYSA-N 1 1 242.366 3.789 20 0 BHADMO C[C@H](CC(C)(C)C)[NH2+]c1ccc2c(c1)CCN2 ZINC000423220838 388001161 /nfs/dbraw/zinc/00/11/61/388001161.db2.gz VZDOAAGUUWOIAL-LLVKDONJSA-N 1 1 232.371 3.891 20 0 BHADMO C[C@@H](CC(C)(C)C)[NH2+]c1ccc2c(c1)CCN2 ZINC000423220839 388001712 /nfs/dbraw/zinc/00/17/12/388001712.db2.gz VZDOAAGUUWOIAL-NSHDSACASA-N 1 1 232.371 3.891 20 0 BHADMO C[C@@H]1CCCC[C@H]1[NH2+]c1ccc2c(c1)CCN2 ZINC000423221184 388002118 /nfs/dbraw/zinc/00/21/18/388002118.db2.gz WRUFWHJIWBZFLO-BXUZGUMPSA-N 1 1 230.355 3.645 20 0 BHADMO C[C@H]1CCCC[C@@H]1[NH2+]c1ccc2c(c1)CCN2 ZINC000423221185 388001206 /nfs/dbraw/zinc/00/12/06/388001206.db2.gz WRUFWHJIWBZFLO-FZMZJTMJSA-N 1 1 230.355 3.645 20 0 BHADMO C[C@@H]1CCCC[C@@H]1[NH2+]c1ccc2c(c1)CCN2 ZINC000423221186 388002463 /nfs/dbraw/zinc/00/24/63/388002463.db2.gz WRUFWHJIWBZFLO-RISCZKNCSA-N 1 1 230.355 3.645 20 0 BHADMO C[C@H]1CCCC[C@H]1[NH2+]c1ccc2c(c1)CCN2 ZINC000423221402 388001963 /nfs/dbraw/zinc/00/19/63/388001963.db2.gz WRUFWHJIWBZFLO-SMDDNHRTSA-N 1 1 230.355 3.645 20 0 BHADMO CC[C@H]([NH2+]c1ccc2c(c1)CCN2)[C@H]1C[C@@H]1C ZINC000423221750 388002690 /nfs/dbraw/zinc/00/26/90/388002690.db2.gz XXVMHQQTPBVKGB-BPNCWPANSA-N 1 1 230.355 3.501 20 0 BHADMO CC[C@H]([NH2+]c1ccc2c(c1)CCN2)[C@@H]1C[C@@H]1C ZINC000423221751 388001971 /nfs/dbraw/zinc/00/19/71/388001971.db2.gz XXVMHQQTPBVKGB-GDLCADMTSA-N 1 1 230.355 3.501 20 0 BHADMO CC[C@H]([NH2+]c1ccc2c(c1)CCN2)[C@@H]1C[C@H]1C ZINC000423221752 388002211 /nfs/dbraw/zinc/00/22/11/388002211.db2.gz XXVMHQQTPBVKGB-HONMWMINSA-N 1 1 230.355 3.501 20 0 BHADMO CC[C@H]([NH2+]c1ccc2c(c1)CCN2)[C@H]1C[C@H]1C ZINC000423221753 388001508 /nfs/dbraw/zinc/00/15/08/388001508.db2.gz XXVMHQQTPBVKGB-SWHYSGLUSA-N 1 1 230.355 3.501 20 0 BHADMO CC[C@H]([NH2+]c1ccc2c(c1)CCN2)C1CCC1 ZINC000423221779 388001756 /nfs/dbraw/zinc/00/17/56/388001756.db2.gz YCLGZKHZHMBTSY-AWEZNQCLSA-N 1 1 230.355 3.645 20 0 BHADMO CC[C@@H]([NH2+]c1ccc2c(c1)CCN2)C1CCC1 ZINC000423221780 388001897 /nfs/dbraw/zinc/00/18/97/388001897.db2.gz YCLGZKHZHMBTSY-CQSZACIVSA-N 1 1 230.355 3.645 20 0 BHADMO Cc1cccc(N2CCc3ccccc3[C@H]2C)[nH+]1 ZINC000425222906 192084418 /nfs/dbraw/zinc/08/44/18/192084418.db2.gz BJKLSSWAEZZXOB-CYBMUJFWSA-N 1 1 238.334 3.514 20 0 BHADMO Cc1cccc(N2CCc3ccccc3[C@@H]2C)[nH+]1 ZINC000425222916 192084479 /nfs/dbraw/zinc/08/44/79/192084479.db2.gz BJKLSSWAEZZXOB-ZDUSSCGKSA-N 1 1 238.334 3.514 20 0 BHADMO Cc1cc[nH+]c(N2CCc3ccccc3[C@H]2C)c1 ZINC000425239725 192084307 /nfs/dbraw/zinc/08/43/07/192084307.db2.gz XICMXCAOXMGROG-CYBMUJFWSA-N 1 1 238.334 3.514 20 0 BHADMO Cc1cc[nH+]c(N2CCc3ccccc3[C@@H]2C)c1 ZINC000425239727 192084748 /nfs/dbraw/zinc/08/47/48/192084748.db2.gz XICMXCAOXMGROG-ZDUSSCGKSA-N 1 1 238.334 3.514 20 0 BHADMO CC[N@@H+](Cc1cncn1C(C)C)C1CCCCC1 ZINC000425319538 386557377 /nfs/dbraw/zinc/55/73/77/386557377.db2.gz CUYIZAHFDDKNAD-UHFFFAOYSA-N 1 1 249.402 3.619 20 0 BHADMO CC(C)n1cncc1C[N@@H+](C)C1CCCCCC1 ZINC000425332266 386844946 /nfs/dbraw/zinc/84/49/46/386844946.db2.gz YQAKMXFRVNHAIP-UHFFFAOYSA-N 1 1 249.402 3.619 20 0 BHADMO CC[C@H]1CCCCC[N@H+]1Cc1cncn1C(C)C ZINC000425335236 386851130 /nfs/dbraw/zinc/85/11/30/386851130.db2.gz IEJYKYSQBVQPMQ-AWEZNQCLSA-N 1 1 249.402 3.619 20 0 BHADMO CC[C@@H]1CCCCC[N@H+]1Cc1cncn1C(C)C ZINC000425335239 386852007 /nfs/dbraw/zinc/85/20/07/386852007.db2.gz IEJYKYSQBVQPMQ-CQSZACIVSA-N 1 1 249.402 3.619 20 0 BHADMO CCC[C@H]1CCCC[N@H+]1Cc1cncn1C(C)C ZINC000425338401 398214820 /nfs/dbraw/zinc/21/48/20/398214820.db2.gz PGEXJRBVUZMENM-AWEZNQCLSA-N 1 1 249.402 3.619 20 0 BHADMO CCC[C@@H]1CCCC[N@H+]1Cc1cncn1C(C)C ZINC000425338402 398214761 /nfs/dbraw/zinc/21/47/61/398214761.db2.gz PGEXJRBVUZMENM-CQSZACIVSA-N 1 1 249.402 3.619 20 0 BHADMO CS[C@@H]1CC[C@H]1Nc1ccc(C2CCC2)c[nH+]1 ZINC000425367453 387026428 /nfs/dbraw/zinc/02/64/28/387026428.db2.gz IGQVOFYREPAVNX-CHWSQXEVSA-N 1 1 248.395 3.655 20 0 BHADMO CS[C@H]1CC[C@H]1Nc1ccc(C2CCC2)c[nH+]1 ZINC000425367454 387026388 /nfs/dbraw/zinc/02/63/88/387026388.db2.gz IGQVOFYREPAVNX-OLZOCXBDSA-N 1 1 248.395 3.655 20 0 BHADMO CS[C@@H]1CC[C@@H]1Nc1ccc(C2CCC2)c[nH+]1 ZINC000425367455 387027048 /nfs/dbraw/zinc/02/70/48/387027048.db2.gz IGQVOFYREPAVNX-QWHCGFSZSA-N 1 1 248.395 3.655 20 0 BHADMO CS[C@H]1CC[C@@H]1Nc1ccc(C2CCC2)c[nH+]1 ZINC000425367456 387027253 /nfs/dbraw/zinc/02/72/53/387027253.db2.gz IGQVOFYREPAVNX-STQMWFEESA-N 1 1 248.395 3.655 20 0 BHADMO CC1(C)CC[C@@H](n2c[nH+]c3c2CCCC3)C1 ZINC000425488422 386170375 /nfs/dbraw/zinc/17/03/75/386170375.db2.gz WSFPYNAXCAOLOR-LLVKDONJSA-N 1 1 218.344 3.513 20 0 BHADMO CC1(C)CC[C@H](n2c[nH+]c3c2CCCC3)C1 ZINC000425488423 386169843 /nfs/dbraw/zinc/16/98/43/386169843.db2.gz WSFPYNAXCAOLOR-NSHDSACASA-N 1 1 218.344 3.513 20 0 BHADMO C[C@@H]1CC[N@@H+](C[C@@H]2CCC(F)(F)C2)[C@H](C)C1 ZINC000425511415 386286567 /nfs/dbraw/zinc/28/65/67/386286567.db2.gz CYSLLJZVGYRHBA-IJLUTSLNSA-N 1 1 231.330 3.542 20 0 BHADMO C[C@@H]1CC[N@@H+](C[C@H]2CCC(F)(F)C2)[C@H](C)C1 ZINC000425511416 386288481 /nfs/dbraw/zinc/28/84/81/386288481.db2.gz CYSLLJZVGYRHBA-UTUOFQBUSA-N 1 1 231.330 3.542 20 0 BHADMO CC(=O)c1ccc(C[N@@H+]2CC[C@@H](C)C[C@H]2C)cc1 ZINC000425522101 386324183 /nfs/dbraw/zinc/32/41/83/386324183.db2.gz LYXBOVWBGUDRSN-CHWSQXEVSA-N 1 1 245.366 3.510 20 0 BHADMO C[C@@H]1CC[N@@H+](CCCCOC(C)(C)C)[C@H](C)C1 ZINC000425524677 386326282 /nfs/dbraw/zinc/32/62/82/386326282.db2.gz RLZPMXCZSGINIZ-ZIAGYGMSSA-N 1 1 241.419 3.702 20 0 BHADMO CC1(C)C[C@@H](c2ccccc2)[N@@H+](CCCF)C1 ZINC000425535927 386352573 /nfs/dbraw/zinc/35/25/73/386352573.db2.gz DNFAEIJIIHBAME-AWEZNQCLSA-N 1 1 235.346 3.819 20 0 BHADMO CC1(C)C[C@H](c2ccccc2)[N@@H+](CCCF)C1 ZINC000425535933 386336659 /nfs/dbraw/zinc/33/66/59/386336659.db2.gz DNFAEIJIIHBAME-CQSZACIVSA-N 1 1 235.346 3.819 20 0 BHADMO C[C@@H](C1CCCCC1)[N@@H+](C)C[C@H]1CCSC1 ZINC000425956217 387533429 /nfs/dbraw/zinc/53/34/29/387533429.db2.gz CCOUNBGDUOBRJV-QWHCGFSZSA-N 1 1 241.444 3.640 20 0 BHADMO C[C@@H](C1CCCCC1)[N@@H+](C)C[C@@H]1CCSC1 ZINC000425956222 387534892 /nfs/dbraw/zinc/53/48/92/387534892.db2.gz CCOUNBGDUOBRJV-STQMWFEESA-N 1 1 241.444 3.640 20 0 BHADMO CC1(C)CCCC[N@@H+](C/C=C/c2ccncc2)C1 ZINC000425982248 411167551 /nfs/dbraw/zinc/16/75/51/411167551.db2.gz QJTYLEJQHQHQDY-AATRIKPKSA-N 1 1 244.382 3.607 20 0 BHADMO CC1(C)CCCC[N@@H+](C/C=C\c2ccncc2)C1 ZINC000425982249 411167687 /nfs/dbraw/zinc/16/76/87/411167687.db2.gz QJTYLEJQHQHQDY-WAYWQWQTSA-N 1 1 244.382 3.607 20 0 BHADMO CC(C)[N@@H+](C/C=C\c1ccncc1)CC1CCC1 ZINC000425984848 398223138 /nfs/dbraw/zinc/22/31/38/398223138.db2.gz MFAXDJLNWLKBAF-DAXSKMNVSA-N 1 1 244.382 3.605 20 0 BHADMO CC(C)[N@@H+](C/C=C/c1ccncc1)CC1CCC1 ZINC000425984849 398222539 /nfs/dbraw/zinc/22/25/39/398222539.db2.gz MFAXDJLNWLKBAF-QPJJXVBHSA-N 1 1 244.382 3.605 20 0 BHADMO Clc1csc(C[N@H+]2CCCC23CCC3)c1 ZINC000426001147 386007169 /nfs/dbraw/zinc/00/71/69/386007169.db2.gz WINDLVIMSBZMPX-UHFFFAOYSA-N 1 1 241.787 3.920 20 0 BHADMO CCCC[N@@H+](C)Cc1ccc2nc(C)sc2c1 ZINC000426032632 387536079 /nfs/dbraw/zinc/53/60/79/387536079.db2.gz BWSNSBVHSDYDTA-UHFFFAOYSA-N 1 1 248.395 3.837 20 0 BHADMO CCCC[N@@H+](CC)Cc1nc(CCC)cs1 ZINC000426034429 387535767 /nfs/dbraw/zinc/53/57/67/387535767.db2.gz FWYPCMOMAQZCDC-UHFFFAOYSA-N 1 1 240.416 3.718 20 0 BHADMO CCCc1csc(C[N@@H+](C)[C@H](C)C(C)C)n1 ZINC000426038207 386527562 /nfs/dbraw/zinc/52/75/62/386527562.db2.gz WWMXWXUPWMHAQE-LLVKDONJSA-N 1 1 240.416 3.572 20 0 BHADMO CCCc1csc(C[N@@H+](C)[C@@H](C)C(C)C)n1 ZINC000426038208 386526389 /nfs/dbraw/zinc/52/63/89/386526389.db2.gz WWMXWXUPWMHAQE-NSHDSACASA-N 1 1 240.416 3.572 20 0 BHADMO CC[N@@H+](Cc1ccc2nc(C)sc2c1)C1CC1 ZINC000426041467 386540214 /nfs/dbraw/zinc/54/02/14/386540214.db2.gz FKRCUPJIEDJYAF-UHFFFAOYSA-N 1 1 246.379 3.589 20 0 BHADMO CCC[N@@H+](CC)Cc1ccc2nc(C)sc2c1 ZINC000426043575 387536680 /nfs/dbraw/zinc/53/66/80/387536680.db2.gz IEGREVKRUREHLQ-UHFFFAOYSA-N 1 1 248.395 3.837 20 0 BHADMO CC[N@@H+](Cc1ccc2nc(C)sc2c1)C(C)C ZINC000426062853 386648896 /nfs/dbraw/zinc/64/88/96/386648896.db2.gz YQJNINOYBVYENP-UHFFFAOYSA-N 1 1 248.395 3.835 20 0 BHADMO CCCc1csc(C[N@@H+](CC)CC(C)C)n1 ZINC000426064370 386647894 /nfs/dbraw/zinc/64/78/94/386647894.db2.gz TWEQWKOZAKWQHN-UHFFFAOYSA-N 1 1 240.416 3.574 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1ccc2nc(C)sc2c1 ZINC000426073229 387535499 /nfs/dbraw/zinc/53/54/99/387535499.db2.gz AJJZRGUZCRNNCQ-JTQLQIEISA-N 1 1 248.395 3.835 20 0 BHADMO CC[C@@H](C)[N@@H+](C)Cc1ccc2nc(C)sc2c1 ZINC000426073230 387537340 /nfs/dbraw/zinc/53/73/40/387537340.db2.gz AJJZRGUZCRNNCQ-SNVBAGLBSA-N 1 1 248.395 3.835 20 0 BHADMO Cc1nc2ccc(C[N@H+](C)CC(C)C)cc2s1 ZINC000426074825 386650202 /nfs/dbraw/zinc/65/02/02/386650202.db2.gz DVZWVVFQRPTZDY-UHFFFAOYSA-N 1 1 248.395 3.693 20 0 BHADMO CCCc1csc(C[N@H+](C)[C@H](C)CCC)n1 ZINC000426076914 323182550 /nfs/dbraw/zinc/18/25/50/323182550.db2.gz JZLHKVLAVFPEPB-LLVKDONJSA-N 1 1 240.416 3.716 20 0 BHADMO CCCc1csc(C[N@H+](C)[C@@H](C)CCC)n1 ZINC000426076915 323182513 /nfs/dbraw/zinc/18/25/13/323182513.db2.gz JZLHKVLAVFPEPB-NSHDSACASA-N 1 1 240.416 3.716 20 0 BHADMO CCC[N@@H+](Cc1ccccc1)CC(C)(C)COC ZINC000426078967 386651291 /nfs/dbraw/zinc/65/12/91/386651291.db2.gz ORSDPGHQJRDYPR-UHFFFAOYSA-N 1 1 249.398 3.571 20 0 BHADMO CCCCC[N@@H+](CC(C)(C)COC)C(C)C ZINC000426082634 386652735 /nfs/dbraw/zinc/65/27/35/386652735.db2.gz ZTDHDVZMPDCIKH-UHFFFAOYSA-N 1 1 229.408 3.560 20 0 BHADMO Clc1csc(C[N@H+]2CC[C@H]3CCC[C@H]32)c1 ZINC000426163412 387544007 /nfs/dbraw/zinc/54/40/07/387544007.db2.gz WGLJXWQOWCZIJL-BXKDBHETSA-N 1 1 241.787 3.776 20 0 BHADMO Clc1csc(C[N@H+]2CC[C@@H]3CCC[C@@H]32)c1 ZINC000426163413 387543819 /nfs/dbraw/zinc/54/38/19/387543819.db2.gz WGLJXWQOWCZIJL-CABZTGNLSA-N 1 1 241.787 3.776 20 0 BHADMO Clc1csc(C[N@H+]2CC[C@@H]3CCC[C@H]32)c1 ZINC000426163414 387543190 /nfs/dbraw/zinc/54/31/90/387543190.db2.gz WGLJXWQOWCZIJL-JOYOIKCWSA-N 1 1 241.787 3.776 20 0 BHADMO Clc1csc(C[N@H+]2CC[C@H]3CCC[C@@H]32)c1 ZINC000426163415 387542212 /nfs/dbraw/zinc/54/22/12/387542212.db2.gz WGLJXWQOWCZIJL-SKDRFNHKSA-N 1 1 241.787 3.776 20 0 BHADMO CCC[C@@H]1CCCC[N@H+]1C/C=C/c1ccncc1 ZINC000426164242 387544790 /nfs/dbraw/zinc/54/47/90/387544790.db2.gz YIVYQPKWZGSROC-BIENSFFJSA-N 1 1 244.382 3.749 20 0 BHADMO CCC[C@@H]1CCCC[N@H+]1C/C=C\c1ccncc1 ZINC000426164243 387545078 /nfs/dbraw/zinc/54/50/78/387545078.db2.gz YIVYQPKWZGSROC-GMNBZTITSA-N 1 1 244.382 3.749 20 0 BHADMO CCC[C@H]1CCCC[N@H+]1C/C=C\c1ccncc1 ZINC000426164244 387544963 /nfs/dbraw/zinc/54/49/63/387544963.db2.gz YIVYQPKWZGSROC-WRLNGNIRSA-N 1 1 244.382 3.749 20 0 BHADMO CCC[C@H]1CCCC[N@H+]1C/C=C/c1ccncc1 ZINC000426164245 387543725 /nfs/dbraw/zinc/54/37/25/387543725.db2.gz YIVYQPKWZGSROC-YERXGYGTSA-N 1 1 244.382 3.749 20 0 BHADMO CCc1ccc([C@@H](C)[NH2+]Cc2occc2C)o1 ZINC000426336449 191019837 /nfs/dbraw/zinc/01/98/37/191019837.db2.gz VFCWFFIJGMEYCH-LLVKDONJSA-N 1 1 233.311 3.594 20 0 BHADMO CCc1ccc([C@H](C)[NH2+]Cc2occc2C)o1 ZINC000426336450 191019150 /nfs/dbraw/zinc/01/91/50/191019150.db2.gz VFCWFFIJGMEYCH-NSHDSACASA-N 1 1 233.311 3.594 20 0 BHADMO Cc1cccc(C[N@H+]2CCS[C@H](C)CC2)c1C ZINC000426368660 387560748 /nfs/dbraw/zinc/56/07/48/387560748.db2.gz BLKLGGIHYLTRJB-CYBMUJFWSA-N 1 1 249.423 3.631 20 0 BHADMO Cc1cccc(C[N@H+]2CCS[C@@H](C)CC2)c1C ZINC000426368661 387560550 /nfs/dbraw/zinc/56/05/50/387560550.db2.gz BLKLGGIHYLTRJB-ZDUSSCGKSA-N 1 1 249.423 3.631 20 0 BHADMO C/C(=C/c1ccccc1)C[N@H+](C)C[C@@H]1C[C@@H]1C ZINC000426378836 200981735 /nfs/dbraw/zinc/98/17/35/200981735.db2.gz QZVYTTSMFZKVHM-DVKXPDSUSA-N 1 1 229.367 3.678 20 0 BHADMO C/C(=C\c1ccccc1)C[N@H+](C)C[C@@H]1C[C@H]1C ZINC000426378846 387563555 /nfs/dbraw/zinc/56/35/55/387563555.db2.gz QZVYTTSMFZKVHM-NBBUPCKLSA-N 1 1 229.367 3.678 20 0 BHADMO C/C(=C/c1ccccc1)C[N@H+](C)C[C@@H]1C[C@H]1C ZINC000426378847 387562496 /nfs/dbraw/zinc/56/24/96/387562496.db2.gz QZVYTTSMFZKVHM-NTWITZMVSA-N 1 1 229.367 3.678 20 0 BHADMO C/C(=C\c1ccccc1)C[N@H+](C)C[C@@H]1C[C@@H]1C ZINC000426378848 387562161 /nfs/dbraw/zinc/56/21/61/387562161.db2.gz QZVYTTSMFZKVHM-OOFRTQJVSA-N 1 1 229.367 3.678 20 0 BHADMO Cc1ccc(C[N@H+]2CCS[C@@H](C)CC2)cc1C ZINC000426383255 387563027 /nfs/dbraw/zinc/56/30/27/387563027.db2.gz AQFUKBASMLGOSD-AWEZNQCLSA-N 1 1 249.423 3.631 20 0 BHADMO Cc1ccc(C[N@H+]2CCS[C@H](C)CC2)cc1C ZINC000426383256 387563398 /nfs/dbraw/zinc/56/33/98/387563398.db2.gz AQFUKBASMLGOSD-CQSZACIVSA-N 1 1 249.423 3.631 20 0 BHADMO C[C@@H]1CC[N@@H+](C/C=C\c2ccccc2)CCS1 ZINC000426388698 387563299 /nfs/dbraw/zinc/56/32/99/387563299.db2.gz AEMLITQYVWGIEZ-BMWLXYDHSA-N 1 1 247.407 3.527 20 0 BHADMO C[C@H]1CC[N@@H+](C/C=C\c2ccccc2)CCS1 ZINC000426388699 387563471 /nfs/dbraw/zinc/56/34/71/387563471.db2.gz AEMLITQYVWGIEZ-PODYEWJSSA-N 1 1 247.407 3.527 20 0 BHADMO COCC(C)(C)C[N@H+]1CCC[C@@H]1CC(C)(C)C ZINC000426392444 387563375 /nfs/dbraw/zinc/56/33/75/387563375.db2.gz ACIQPFXTIVXVOU-CYBMUJFWSA-N 1 1 241.419 3.560 20 0 BHADMO COCC(C)(C)C[N@H+]1CCC[C@H]1CC(C)(C)C ZINC000426392445 387562372 /nfs/dbraw/zinc/56/23/72/387562372.db2.gz ACIQPFXTIVXVOU-ZDUSSCGKSA-N 1 1 241.419 3.560 20 0 BHADMO Cc1ccc(C[N@H+]2CCS[C@@H](C)CC2)c(C)c1 ZINC000426393692 387562193 /nfs/dbraw/zinc/56/21/93/387562193.db2.gz GZNHULOSCNOPHF-AWEZNQCLSA-N 1 1 249.423 3.631 20 0 BHADMO Cc1ccc(C[N@H+]2CCS[C@H](C)CC2)c(C)c1 ZINC000426393693 387563077 /nfs/dbraw/zinc/56/30/77/387563077.db2.gz GZNHULOSCNOPHF-CQSZACIVSA-N 1 1 249.423 3.631 20 0 BHADMO COCC(C)(C)C[N@@H+](CC(C)C)C1CCCC1 ZINC000426403879 387565097 /nfs/dbraw/zinc/56/50/97/387565097.db2.gz XSJYPEAXCYRACG-UHFFFAOYSA-N 1 1 241.419 3.560 20 0 BHADMO CCCc1csc(C[N@@H+](C)CC(C)(C)C)n1 ZINC000426408737 387564890 /nfs/dbraw/zinc/56/48/90/387564890.db2.gz CEULNTDVJPFRSX-UHFFFAOYSA-N 1 1 240.416 3.574 20 0 BHADMO Cc1nc2ccc(C[N@@H+]3CCC[C@@H]3C)cc2s1 ZINC000426412002 387566834 /nfs/dbraw/zinc/56/68/34/387566834.db2.gz SOTYTXDFMYTDMZ-JTQLQIEISA-N 1 1 246.379 3.589 20 0 BHADMO Cc1nc2ccc(C[N@@H+]3CCC[C@H]3C)cc2s1 ZINC000426412111 387567555 /nfs/dbraw/zinc/56/75/55/387567555.db2.gz SOTYTXDFMYTDMZ-SNVBAGLBSA-N 1 1 246.379 3.589 20 0 BHADMO CCCCC[C@H]1CCC[N@H+]1CC(C)(C)COC ZINC000426413231 387567379 /nfs/dbraw/zinc/56/73/79/387567379.db2.gz RLLMHCJENIPWAM-AWEZNQCLSA-N 1 1 241.419 3.704 20 0 BHADMO CCCCC[C@@H]1CCC[N@H+]1CC(C)(C)COC ZINC000426413232 387560733 /nfs/dbraw/zinc/56/07/33/387560733.db2.gz RLLMHCJENIPWAM-CQSZACIVSA-N 1 1 241.419 3.704 20 0 BHADMO CCCc1csc(C[N@@H+](C)C[C@H](C)CC)n1 ZINC000426413586 387567502 /nfs/dbraw/zinc/56/75/02/387567502.db2.gz TUDFOPYTAWUNQX-LLVKDONJSA-N 1 1 240.416 3.574 20 0 BHADMO CCCc1csc(C[N@@H+](C)C[C@@H](C)CC)n1 ZINC000426413587 387567764 /nfs/dbraw/zinc/56/77/64/387567764.db2.gz TUDFOPYTAWUNQX-NSHDSACASA-N 1 1 240.416 3.574 20 0 BHADMO Cc1nc2ccc(C[N@H+](C)C3CCC3)cc2s1 ZINC000426414182 191044396 /nfs/dbraw/zinc/04/43/96/191044396.db2.gz AAQOAYXQYKMFOD-UHFFFAOYSA-N 1 1 246.379 3.589 20 0 BHADMO CCC(C)(C)[C@H]1CCC[N@H+]1CC(C)(C)COC ZINC000426416016 387566480 /nfs/dbraw/zinc/56/64/80/387566480.db2.gz GGUCWVNVZXSXEK-CYBMUJFWSA-N 1 1 241.419 3.560 20 0 BHADMO CCC(C)(C)[C@@H]1CCC[N@H+]1CC(C)(C)COC ZINC000426416017 387566469 /nfs/dbraw/zinc/56/64/69/387566469.db2.gz GGUCWVNVZXSXEK-ZDUSSCGKSA-N 1 1 241.419 3.560 20 0 BHADMO CCC[C@H](C)[C@@H]1CCC[N@H+]1CC(C)(C)COC ZINC000426423631 206048257 /nfs/dbraw/zinc/04/82/57/206048257.db2.gz ZMNAMAKEDQDEFI-KBPBESRZSA-N 1 1 241.419 3.560 20 0 BHADMO CCC[C@@H](C)[C@@H]1CCC[N@H+]1CC(C)(C)COC ZINC000426423632 206046338 /nfs/dbraw/zinc/04/63/38/206046338.db2.gz ZMNAMAKEDQDEFI-KGLIPLIRSA-N 1 1 241.419 3.560 20 0 BHADMO CCC[C@H](C)[C@H]1CCC[N@H+]1CC(C)(C)COC ZINC000426423633 206046304 /nfs/dbraw/zinc/04/63/04/206046304.db2.gz ZMNAMAKEDQDEFI-UONOGXRCSA-N 1 1 241.419 3.560 20 0 BHADMO CCC[C@@H](C)[C@H]1CCC[N@H+]1CC(C)(C)COC ZINC000426423634 206047220 /nfs/dbraw/zinc/04/72/20/206047220.db2.gz ZMNAMAKEDQDEFI-ZIAGYGMSSA-N 1 1 241.419 3.560 20 0 BHADMO Fc1cccc(CCC[N@H+]2CC[C@H]3CCC[C@H]32)c1 ZINC000426454261 387569246 /nfs/dbraw/zinc/56/92/46/387569246.db2.gz NYGVMMULIMSDOW-GDBMZVCRSA-N 1 1 247.357 3.633 20 0 BHADMO Fc1cccc(CCC[N@H+]2CC[C@@H]3CCC[C@H]32)c1 ZINC000426454262 387568718 /nfs/dbraw/zinc/56/87/18/387568718.db2.gz NYGVMMULIMSDOW-GOEBONIOSA-N 1 1 247.357 3.633 20 0 BHADMO Fc1cccc(CCC[N@H+]2CC[C@@H]3CCC[C@@H]32)c1 ZINC000426454263 387569929 /nfs/dbraw/zinc/56/99/29/387569929.db2.gz NYGVMMULIMSDOW-HOCLYGCPSA-N 1 1 247.357 3.633 20 0 BHADMO Fc1cccc(CCC[N@H+]2CC[C@H]3CCC[C@@H]32)c1 ZINC000426454264 387569327 /nfs/dbraw/zinc/56/93/27/387569327.db2.gz NYGVMMULIMSDOW-ZBFHGGJFSA-N 1 1 247.357 3.633 20 0 BHADMO c1cc(C[N@H+]2CC[C@@H]3CCC[C@H]32)cc2c1CCC2 ZINC000426455938 387568340 /nfs/dbraw/zinc/56/83/40/387568340.db2.gz VERJICVXSKIOIY-DOTOQJQBSA-N 1 1 241.378 3.550 20 0 BHADMO c1cc(C[N@H+]2CC[C@H]3CCC[C@H]32)cc2c1CCC2 ZINC000426455942 387570294 /nfs/dbraw/zinc/57/02/94/387570294.db2.gz VERJICVXSKIOIY-NVXWUHKLSA-N 1 1 241.378 3.550 20 0 BHADMO c1cc(C[N@H+]2CC[C@@H]3CCC[C@@H]32)cc2c1CCC2 ZINC000426455943 387569104 /nfs/dbraw/zinc/56/91/04/387569104.db2.gz VERJICVXSKIOIY-RDJZCZTQSA-N 1 1 241.378 3.550 20 0 BHADMO c1cc(C[N@H+]2CC[C@H]3CCC[C@@H]32)cc2c1CCC2 ZINC000426455944 387570003 /nfs/dbraw/zinc/57/00/03/387570003.db2.gz VERJICVXSKIOIY-WBVHZDCISA-N 1 1 241.378 3.550 20 0 BHADMO Cc1ccc(C)c(C[N@H+]2CC[C@H]3CCC[C@H]32)c1 ZINC000426458682 387571359 /nfs/dbraw/zinc/57/13/59/387571359.db2.gz IYBLARXXJRYOLB-GDBMZVCRSA-N 1 1 229.367 3.678 20 0 BHADMO Cc1ccc(C)c(C[N@H+]2CC[C@@H]3CCC[C@H]32)c1 ZINC000426458683 387570949 /nfs/dbraw/zinc/57/09/49/387570949.db2.gz IYBLARXXJRYOLB-GOEBONIOSA-N 1 1 229.367 3.678 20 0 BHADMO Cc1ccc(C)c(C[N@H+]2CC[C@@H]3CCC[C@@H]32)c1 ZINC000426458684 387571762 /nfs/dbraw/zinc/57/17/62/387571762.db2.gz IYBLARXXJRYOLB-HOCLYGCPSA-N 1 1 229.367 3.678 20 0 BHADMO Cc1ccc(C)c(C[N@H+]2CC[C@H]3CCC[C@@H]32)c1 ZINC000426458685 387572028 /nfs/dbraw/zinc/57/20/28/387572028.db2.gz IYBLARXXJRYOLB-ZBFHGGJFSA-N 1 1 229.367 3.678 20 0 BHADMO Cc1cc(C[N@H+]2CC[C@@H]3CCC[C@H]32)c(C)s1 ZINC000426459284 387571503 /nfs/dbraw/zinc/57/15/03/387571503.db2.gz KBOKZZBQXNYVPZ-GXTWGEPZSA-N 1 1 235.396 3.739 20 0 BHADMO Cc1cc(C[N@H+]2CC[C@@H]3CCC[C@@H]32)c(C)s1 ZINC000426459285 387572622 /nfs/dbraw/zinc/57/26/22/387572622.db2.gz KBOKZZBQXNYVPZ-JSGCOSHPSA-N 1 1 235.396 3.739 20 0 BHADMO Cc1cc(C[N@H+]2CC[C@H]3CCC[C@@H]32)c(C)s1 ZINC000426459286 387572671 /nfs/dbraw/zinc/57/26/71/387572671.db2.gz KBOKZZBQXNYVPZ-OCCSQVGLSA-N 1 1 235.396 3.739 20 0 BHADMO Cc1cc(C[N@H+]2CC[C@H]3CCC[C@H]32)c(C)s1 ZINC000426459287 387571528 /nfs/dbraw/zinc/57/15/28/387571528.db2.gz KBOKZZBQXNYVPZ-TZMCWYRMSA-N 1 1 235.396 3.739 20 0 BHADMO c1c2ccccc2oc1C[N@H+]1CC[C@H]2CCC[C@@H]21 ZINC000426462233 384820728 /nfs/dbraw/zinc/82/07/28/384820728.db2.gz QLLZFIOPXVYCRD-DOMZBBRYSA-N 1 1 241.334 3.807 20 0 BHADMO c1c2ccccc2oc1C[N@H+]1CC[C@H]2CCC[C@H]21 ZINC000426462234 384818649 /nfs/dbraw/zinc/81/86/49/384818649.db2.gz QLLZFIOPXVYCRD-IUODEOHRSA-N 1 1 241.334 3.807 20 0 BHADMO c1c2ccccc2oc1C[N@H+]1CC[C@@H]2CCC[C@H]21 ZINC000426462235 384820228 /nfs/dbraw/zinc/82/02/28/384820228.db2.gz QLLZFIOPXVYCRD-SWLSCSKDSA-N 1 1 241.334 3.807 20 0 BHADMO c1c2ccccc2oc1C[N@H+]1CC[C@@H]2CCC[C@@H]21 ZINC000426462236 384818043 /nfs/dbraw/zinc/81/80/43/384818043.db2.gz QLLZFIOPXVYCRD-WFASDCNBSA-N 1 1 241.334 3.807 20 0 BHADMO C(=C/c1ccccc1)\C[N@H+]1CC[C@@H]2CCC[C@H]21 ZINC000426462867 384819869 /nfs/dbraw/zinc/81/98/69/384819869.db2.gz WGPWFNRULKUIRW-AUPUMLSVSA-N 1 1 227.351 3.574 20 0 BHADMO c1cc(CCC[N@H+]2CC[C@@H]3CCC[C@@H]32)cs1 ZINC000426462868 384817776 /nfs/dbraw/zinc/81/77/76/384817776.db2.gz UOTVWXRXKAPPNZ-KBPBESRZSA-N 1 1 235.396 3.555 20 0 BHADMO c1cc(CCC[N@H+]2CC[C@H]3CCC[C@@H]32)cs1 ZINC000426462871 384820805 /nfs/dbraw/zinc/82/08/05/384820805.db2.gz UOTVWXRXKAPPNZ-KGLIPLIRSA-N 1 1 235.396 3.555 20 0 BHADMO c1cc(CCC[N@H+]2CC[C@@H]3CCC[C@H]32)cs1 ZINC000426462872 384819639 /nfs/dbraw/zinc/81/96/39/384819639.db2.gz UOTVWXRXKAPPNZ-UONOGXRCSA-N 1 1 235.396 3.555 20 0 BHADMO c1cc(CCC[N@H+]2CC[C@H]3CCC[C@H]32)cs1 ZINC000426462874 384819581 /nfs/dbraw/zinc/81/95/81/384819581.db2.gz UOTVWXRXKAPPNZ-ZIAGYGMSSA-N 1 1 235.396 3.555 20 0 BHADMO C(=C\c1ccccc1)\C[N@H+]1CC[C@@H]2CCC[C@H]21 ZINC000426462880 384818508 /nfs/dbraw/zinc/81/85/08/384818508.db2.gz WGPWFNRULKUIRW-OXUBUWLOSA-N 1 1 227.351 3.574 20 0 BHADMO C(=C\c1ccccc1)\C[N@H+]1CC[C@@H]2CCC[C@@H]21 ZINC000426462884 384818702 /nfs/dbraw/zinc/81/87/02/384818702.db2.gz WGPWFNRULKUIRW-QBGJIXDNSA-N 1 1 227.351 3.574 20 0 BHADMO C(=C/c1ccccc1)\C[N@H+]1CC[C@@H]2CCC[C@@H]21 ZINC000426462886 384817652 /nfs/dbraw/zinc/81/76/52/384817652.db2.gz WGPWFNRULKUIRW-TWZSPHTKSA-N 1 1 227.351 3.574 20 0 BHADMO C[C@H](C[N@H+]1CC[C@H]2CCC[C@@H]21)c1ccccc1 ZINC000426464073 387570834 /nfs/dbraw/zinc/57/08/34/387570834.db2.gz XSNVFQPENIJAHL-BMFZPTHFSA-N 1 1 229.367 3.665 20 0 BHADMO C[C@H](C[N@H+]1CC[C@H]2CCC[C@H]21)c1ccccc1 ZINC000426464074 387572767 /nfs/dbraw/zinc/57/27/67/387572767.db2.gz XSNVFQPENIJAHL-FVQBIDKESA-N 1 1 229.367 3.665 20 0 BHADMO C[C@H](C[N@H+]1CC[C@@H]2CCC[C@@H]21)c1ccccc1 ZINC000426464075 387572482 /nfs/dbraw/zinc/57/24/82/387572482.db2.gz XSNVFQPENIJAHL-KBMXLJTQSA-N 1 1 229.367 3.665 20 0 BHADMO C[C@H](C[N@H+]1CC[C@@H]2CCC[C@H]21)c1ccccc1 ZINC000426464076 387571817 /nfs/dbraw/zinc/57/18/17/387571817.db2.gz XSNVFQPENIJAHL-VNQPRFMTSA-N 1 1 229.367 3.665 20 0 BHADMO Clc1cccc(C[N@H+]2CC[C@@H]3CCC[C@H]32)c1 ZINC000426471776 387572557 /nfs/dbraw/zinc/57/25/57/387572557.db2.gz TUZIFZWHHMNKDS-GXTWGEPZSA-N 1 1 235.758 3.714 20 0 BHADMO Clc1cccc(C[N@H+]2CC[C@@H]3CCC[C@@H]32)c1 ZINC000426471777 387571923 /nfs/dbraw/zinc/57/19/23/387571923.db2.gz TUZIFZWHHMNKDS-JSGCOSHPSA-N 1 1 235.758 3.714 20 0 BHADMO Clc1cccc(C[N@H+]2CC[C@H]3CCC[C@@H]32)c1 ZINC000426471778 387570908 /nfs/dbraw/zinc/57/09/08/387570908.db2.gz TUZIFZWHHMNKDS-OCCSQVGLSA-N 1 1 235.758 3.714 20 0 BHADMO Clc1cccc(C[N@H+]2CC[C@H]3CCC[C@H]32)c1 ZINC000426471779 387572139 /nfs/dbraw/zinc/57/21/39/387572139.db2.gz TUZIFZWHHMNKDS-TZMCWYRMSA-N 1 1 235.758 3.714 20 0 BHADMO c1ccc(SCC[N@H+]2CC[C@@H]3CCC[C@H]32)cc1 ZINC000426474214 384831172 /nfs/dbraw/zinc/83/11/72/384831172.db2.gz ZWYNUCOOXJYDPU-DZGCQCFKSA-N 1 1 247.407 3.653 20 0 BHADMO c1ccc(SCC[N@H+]2CC[C@H]3CCC[C@@H]32)cc1 ZINC000426474215 384831360 /nfs/dbraw/zinc/83/13/60/384831360.db2.gz ZWYNUCOOXJYDPU-HIFRSBDPSA-N 1 1 247.407 3.653 20 0 BHADMO c1ccc(SCC[N@H+]2CC[C@H]3CCC[C@H]32)cc1 ZINC000426474216 219848605 /nfs/dbraw/zinc/84/86/05/219848605.db2.gz ZWYNUCOOXJYDPU-UKRRQHHQSA-N 1 1 247.407 3.653 20 0 BHADMO c1ccc(SCC[N@H+]2CC[C@@H]3CCC[C@@H]32)cc1 ZINC000426474217 384830013 /nfs/dbraw/zinc/83/00/13/384830013.db2.gz ZWYNUCOOXJYDPU-ZFWWWQNUSA-N 1 1 247.407 3.653 20 0 BHADMO Clc1ccc(C[N@H+]2CC[C@@H]3CCC[C@H]32)s1 ZINC000426477025 384831181 /nfs/dbraw/zinc/83/11/81/384831181.db2.gz YWXDOYJQNZJXFQ-GXSJLCMTSA-N 1 1 241.787 3.776 20 0 BHADMO Clc1ccc(C[N@H+]2CC[C@H]3CCC[C@@H]32)s1 ZINC000426477026 384831326 /nfs/dbraw/zinc/83/13/26/384831326.db2.gz YWXDOYJQNZJXFQ-KOLCDFICSA-N 1 1 241.787 3.776 20 0 BHADMO Clc1ccc(C[N@H+]2CC[C@H]3CCC[C@H]32)s1 ZINC000426477027 384829516 /nfs/dbraw/zinc/82/95/16/384829516.db2.gz YWXDOYJQNZJXFQ-MWLCHTKSSA-N 1 1 241.787 3.776 20 0 BHADMO Clc1ccc(C[N@H+]2CC[C@@H]3CCC[C@@H]32)s1 ZINC000426477028 384830095 /nfs/dbraw/zinc/83/00/95/384830095.db2.gz YWXDOYJQNZJXFQ-ONGXEEELSA-N 1 1 241.787 3.776 20 0 BHADMO CC(C)CCC[N@@H+](C)CCc1cccs1 ZINC000426477058 384830995 /nfs/dbraw/zinc/83/09/95/384830995.db2.gz ZGPWANOXBOGJFA-UHFFFAOYSA-N 1 1 225.401 3.659 20 0 BHADMO CC(C)CCC[N@@H+](C)Cc1nc2ccccc2o1 ZINC000426477071 384831680 /nfs/dbraw/zinc/83/16/80/384831680.db2.gz ZLTOSDKEJJUDLQ-UHFFFAOYSA-N 1 1 246.354 3.696 20 0 BHADMO COc1cccc(C[N@@H+](C)CCCC(C)C)c1 ZINC000426478368 387573416 /nfs/dbraw/zinc/57/34/16/387573416.db2.gz BEIXRCUWCOZESN-UHFFFAOYSA-N 1 1 235.371 3.563 20 0 BHADMO CC(C)CSCCC[N@H+]1CC[C@@H]2CCC[C@@H]21 ZINC000426478617 200988210 /nfs/dbraw/zinc/98/82/10/200988210.db2.gz DWXLHKLZMOQVBC-KBPBESRZSA-N 1 1 241.444 3.640 20 0 BHADMO CC(C)CSCCC[N@H+]1CC[C@H]2CCC[C@@H]21 ZINC000426478618 387573262 /nfs/dbraw/zinc/57/32/62/387573262.db2.gz DWXLHKLZMOQVBC-KGLIPLIRSA-N 1 1 241.444 3.640 20 0 BHADMO CC(C)CSCCC[N@H+]1CC[C@@H]2CCC[C@H]21 ZINC000426478619 387574300 /nfs/dbraw/zinc/57/43/00/387574300.db2.gz DWXLHKLZMOQVBC-UONOGXRCSA-N 1 1 241.444 3.640 20 0 BHADMO CC(C)CSCCC[N@H+]1CC[C@H]2CCC[C@H]21 ZINC000426478620 387574812 /nfs/dbraw/zinc/57/48/12/387574812.db2.gz DWXLHKLZMOQVBC-ZIAGYGMSSA-N 1 1 241.444 3.640 20 0 BHADMO FC(F)(F)CCCC[N@H+]1CC[C@H]2CCC[C@H]21 ZINC000426480962 387574136 /nfs/dbraw/zinc/57/41/36/387574136.db2.gz XMHYAQFIHDQEMX-GHMZBOCLSA-N 1 1 235.293 3.593 20 0 BHADMO FC(F)(F)CCCC[N@H+]1CC[C@H]2CCC[C@@H]21 ZINC000426480964 387574173 /nfs/dbraw/zinc/57/41/73/387574173.db2.gz XMHYAQFIHDQEMX-MNOVXSKESA-N 1 1 235.293 3.593 20 0 BHADMO FC(F)(F)CCCC[N@H+]1CC[C@@H]2CCC[C@@H]21 ZINC000426480965 387574336 /nfs/dbraw/zinc/57/43/36/387574336.db2.gz XMHYAQFIHDQEMX-QWRGUYRKSA-N 1 1 235.293 3.593 20 0 BHADMO FC(F)(F)CCCC[N@H+]1CC[C@@H]2CCC[C@H]21 ZINC000426480966 387573489 /nfs/dbraw/zinc/57/34/89/387573489.db2.gz XMHYAQFIHDQEMX-WDEREUQCSA-N 1 1 235.293 3.593 20 0 BHADMO Cc1cc(F)ccc1C[N@H+]1CC[C@H]2CCC[C@@H]21 ZINC000426481481 387575310 /nfs/dbraw/zinc/57/53/10/387575310.db2.gz AHSUSAGWUTXOKR-DOMZBBRYSA-N 1 1 233.330 3.509 20 0 BHADMO Cc1cc(F)ccc1C[N@H+]1CC[C@H]2CCC[C@H]21 ZINC000426481482 387573086 /nfs/dbraw/zinc/57/30/86/387573086.db2.gz AHSUSAGWUTXOKR-IUODEOHRSA-N 1 1 233.330 3.509 20 0 BHADMO Cc1cc(F)ccc1C[N@H+]1CC[C@@H]2CCC[C@H]21 ZINC000426481483 387574343 /nfs/dbraw/zinc/57/43/43/387574343.db2.gz AHSUSAGWUTXOKR-SWLSCSKDSA-N 1 1 233.330 3.509 20 0 BHADMO Cc1cc(F)ccc1C[N@H+]1CC[C@@H]2CCC[C@@H]21 ZINC000426481484 387573295 /nfs/dbraw/zinc/57/32/95/387573295.db2.gz AHSUSAGWUTXOKR-WFASDCNBSA-N 1 1 233.330 3.509 20 0 BHADMO CSc1ccc(C[N@H+]2CC[C@@H]3CCC[C@H]32)cc1 ZINC000426482935 387574209 /nfs/dbraw/zinc/57/42/09/387574209.db2.gz NNXNTYRTKYPRRU-DZGCQCFKSA-N 1 1 247.407 3.783 20 0 BHADMO CSc1ccc(C[N@H+]2CC[C@H]3CCC[C@@H]32)cc1 ZINC000426482936 387573994 /nfs/dbraw/zinc/57/39/94/387573994.db2.gz NNXNTYRTKYPRRU-HIFRSBDPSA-N 1 1 247.407 3.783 20 0 BHADMO CSc1ccc(C[N@H+]2CC[C@H]3CCC[C@H]32)cc1 ZINC000426482937 387573484 /nfs/dbraw/zinc/57/34/84/387573484.db2.gz NNXNTYRTKYPRRU-UKRRQHHQSA-N 1 1 247.407 3.783 20 0 BHADMO CSc1ccc(C[N@H+]2CC[C@@H]3CCC[C@@H]32)cc1 ZINC000426482938 387575165 /nfs/dbraw/zinc/57/51/65/387575165.db2.gz NNXNTYRTKYPRRU-ZFWWWQNUSA-N 1 1 247.407 3.783 20 0 BHADMO CSc1ccccc1C[N@H+]1CC[C@@H]2CCC[C@H]21 ZINC000426482968 387573143 /nfs/dbraw/zinc/57/31/43/387573143.db2.gz HCHIZVREIOSHCC-GXTWGEPZSA-N 1 1 247.407 3.783 20 0 BHADMO CSc1ccccc1C[N@H+]1CC[C@@H]2CCC[C@@H]21 ZINC000426482969 387574144 /nfs/dbraw/zinc/57/41/44/387574144.db2.gz HCHIZVREIOSHCC-JSGCOSHPSA-N 1 1 247.407 3.783 20 0 BHADMO CSc1ccccc1C[N@H+]1CC[C@H]2CCC[C@@H]21 ZINC000426482970 387574152 /nfs/dbraw/zinc/57/41/52/387574152.db2.gz HCHIZVREIOSHCC-OCCSQVGLSA-N 1 1 247.407 3.783 20 0 BHADMO CSc1ccccc1C[N@H+]1CC[C@H]2CCC[C@H]21 ZINC000426482971 387575100 /nfs/dbraw/zinc/57/51/00/387575100.db2.gz HCHIZVREIOSHCC-TZMCWYRMSA-N 1 1 247.407 3.783 20 0 BHADMO C[N@@H+](Cc1ccsc1)C1(C)CCCC1 ZINC000426494744 387577090 /nfs/dbraw/zinc/57/70/90/387577090.db2.gz CIBBOFZYFPSPQF-UHFFFAOYSA-N 1 1 209.358 3.513 20 0 BHADMO C[N@@H+](C[C@@H]1CC=CCC1)C1(C)CCCC1 ZINC000426494956 387577485 /nfs/dbraw/zinc/57/74/85/387577485.db2.gz IOXNVEODXZAFRJ-CYBMUJFWSA-N 1 1 207.361 3.607 20 0 BHADMO C[N@@H+](C[C@H]1CC=CCC1)C1(C)CCCC1 ZINC000426494957 387577260 /nfs/dbraw/zinc/57/72/60/387577260.db2.gz IOXNVEODXZAFRJ-ZDUSSCGKSA-N 1 1 207.361 3.607 20 0 BHADMO C[N@@H+](Cc1ccc(Cl)o1)C1(C)CCCC1 ZINC000426495153 387577540 /nfs/dbraw/zinc/57/75/40/387577540.db2.gz JSQFKMIPIRLMLL-UHFFFAOYSA-N 1 1 227.735 3.698 20 0 BHADMO C[N@@H+](Cc1cccc2[nH]ccc21)C1(C)CCCC1 ZINC000426495328 387577075 /nfs/dbraw/zinc/57/70/75/387577075.db2.gz GGBGCSVGHRXXEH-UHFFFAOYSA-N 1 1 242.366 3.932 20 0 BHADMO CCOc1cccc(C[N@@H+](C)C2(C)CCCC2)c1 ZINC000426495989 387576498 /nfs/dbraw/zinc/57/64/98/387576498.db2.gz NATNMNKILOVIQM-UHFFFAOYSA-N 1 1 247.382 3.850 20 0 BHADMO COc1ccsc1C[N@@H+](C)C1(C)CCCC1 ZINC000426504100 191093469 /nfs/dbraw/zinc/09/34/69/191093469.db2.gz KVMPHARIHAQCDG-UHFFFAOYSA-N 1 1 239.384 3.521 20 0 BHADMO COc1ccc(C[N@@H+](C)C2(C)CCCC2)cc1C ZINC000426506258 191093766 /nfs/dbraw/zinc/09/37/66/191093766.db2.gz DGDIVHUWUNZSMJ-UHFFFAOYSA-N 1 1 247.382 3.768 20 0 BHADMO Cc1ccc(C[N@H+](C)C2(C)CCCC2)s1 ZINC000426509284 387575726 /nfs/dbraw/zinc/57/57/26/387575726.db2.gz LZGQQBHSBNJFSC-UHFFFAOYSA-N 1 1 223.385 3.821 20 0 BHADMO Cc1cccc(C)c1C[N@H+]1CC[C@H]2CCC[C@H]21 ZINC000426519724 191095396 /nfs/dbraw/zinc/09/53/96/191095396.db2.gz CEUHTCNQVFKALE-GDBMZVCRSA-N 1 1 229.367 3.678 20 0 BHADMO Cc1cccc(C)c1C[N@H+]1CC[C@@H]2CCC[C@H]21 ZINC000426519725 191096406 /nfs/dbraw/zinc/09/64/06/191096406.db2.gz CEUHTCNQVFKALE-GOEBONIOSA-N 1 1 229.367 3.678 20 0 BHADMO Cc1cccc(C)c1C[N@H+]1CC[C@@H]2CCC[C@@H]21 ZINC000426519726 191096355 /nfs/dbraw/zinc/09/63/55/191096355.db2.gz CEUHTCNQVFKALE-HOCLYGCPSA-N 1 1 229.367 3.678 20 0 BHADMO Cc1cccc(C)c1C[N@H+]1CC[C@H]2CCC[C@@H]21 ZINC000426519727 191096222 /nfs/dbraw/zinc/09/62/22/191096222.db2.gz CEUHTCNQVFKALE-ZBFHGGJFSA-N 1 1 229.367 3.678 20 0 BHADMO Clc1ccccc1C[N@H+]1CC[C@H]2CCC[C@H]21 ZINC000426522637 387578602 /nfs/dbraw/zinc/57/86/02/387578602.db2.gz KTNOAMLBUQTVKT-BXUZGUMPSA-N 1 1 235.758 3.714 20 0 BHADMO Clc1ccccc1C[N@H+]1CC[C@@H]2CCC[C@@H]21 ZINC000426522638 387578713 /nfs/dbraw/zinc/57/87/13/387578713.db2.gz KTNOAMLBUQTVKT-FZMZJTMJSA-N 1 1 235.758 3.714 20 0 BHADMO Clc1ccccc1C[N@H+]1CC[C@H]2CCC[C@@H]21 ZINC000426522639 387578705 /nfs/dbraw/zinc/57/87/05/387578705.db2.gz KTNOAMLBUQTVKT-RISCZKNCSA-N 1 1 235.758 3.714 20 0 BHADMO Clc1ccccc1C[N@H+]1CC[C@@H]2CCC[C@H]21 ZINC000426522640 387578516 /nfs/dbraw/zinc/57/85/16/387578516.db2.gz KTNOAMLBUQTVKT-SMDDNHRTSA-N 1 1 235.758 3.714 20 0 BHADMO 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WQURUNXDSQXKOR-NNTXTVRGSA-N 1 1 233.330 3.569 20 0 BHADMO C[N@@H+](C/C=C\c1ccc(F)cc1)[C@H]1CC1(C)C ZINC000426541871 387579698 /nfs/dbraw/zinc/57/96/98/387579698.db2.gz WQURUNXDSQXKOR-WSNITJDQSA-N 1 1 233.330 3.569 20 0 BHADMO C[N@@H+](C/C=C\c1ccc(F)cc1)[C@@H]1CC1(C)C ZINC000426541872 387581484 /nfs/dbraw/zinc/58/14/84/387581484.db2.gz WQURUNXDSQXKOR-ZRUQZJFASA-N 1 1 233.330 3.569 20 0 BHADMO C[N@@H+](Cc1cc2ccc(F)cc2[nH]1)[C@H]1CC1(C)C ZINC000426549949 387580927 /nfs/dbraw/zinc/58/09/27/387580927.db2.gz UZGGIPNYVZORBB-AWEZNQCLSA-N 1 1 246.329 3.537 20 0 BHADMO C[N@@H+](Cc1cc2ccc(F)cc2[nH]1)[C@@H]1CC1(C)C ZINC000426549950 387580187 /nfs/dbraw/zinc/58/01/87/387580187.db2.gz UZGGIPNYVZORBB-CQSZACIVSA-N 1 1 246.329 3.537 20 0 BHADMO C[N@@H+](Cc1ccsc1Cl)[C@@H]1CC1(C)C ZINC000426560133 206050553 /nfs/dbraw/zinc/05/05/53/206050553.db2.gz KMODFXULQJCTEB-SECBINFHSA-N 1 1 229.776 3.632 20 0 BHADMO C[N@H+](Cc1ccsc1Cl)[C@@H]1CC1(C)C ZINC000426560133 206050550 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CC(C)O[C@H](C[N@H+]1CCC[C@H]1C)c1ccccc1 ZINC000428241489 206055938 /nfs/dbraw/zinc/05/59/38/206055938.db2.gz KIRUMURUCHVIEG-GDBMZVCRSA-N 1 1 247.382 3.637 20 0 BHADMO CC(C)O[C@H](C[N@H+]1CCC[C@@H]1C)c1ccccc1 ZINC000428241490 206057137 /nfs/dbraw/zinc/05/71/37/206057137.db2.gz KIRUMURUCHVIEG-GOEBONIOSA-N 1 1 247.382 3.637 20 0 BHADMO CC(C)O[C@@H](C[N@H+]1CCC[C@@H]1C)c1ccccc1 ZINC000428241492 206057145 /nfs/dbraw/zinc/05/71/45/206057145.db2.gz KIRUMURUCHVIEG-HOCLYGCPSA-N 1 1 247.382 3.637 20 0 BHADMO CC(C)O[C@@H](C[N@H+]1CCC[C@H]1C)c1ccccc1 ZINC000428241495 206056287 /nfs/dbraw/zinc/05/62/87/206056287.db2.gz KIRUMURUCHVIEG-ZBFHGGJFSA-N 1 1 247.382 3.637 20 0 BHADMO CC[C@@H](C)C[N@@H+](C)Cc1oc(C(C)C)nc1C ZINC000428251820 201004081 /nfs/dbraw/zinc/00/40/81/201004081.db2.gz YUUVANJSJYKPIU-LLVKDONJSA-N 1 1 238.375 3.584 20 0 BHADMO CC[C@H](C)C[N@@H+](C)Cc1oc(C(C)C)nc1C ZINC000428251821 201003444 /nfs/dbraw/zinc/00/34/44/201003444.db2.gz YUUVANJSJYKPIU-NSHDSACASA-N 1 1 238.375 3.584 20 0 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MPIZEQMCOIORHU-ZDUSSCGKSA-N 1 1 221.388 3.687 20 0 BHADMO CC(C)[C@H]1[N@@H+](Cc2cccs2)CC12CCC2 ZINC000430089924 201143332 /nfs/dbraw/zinc/14/33/32/201143332.db2.gz ZYWLBUJWHJRJJR-CYBMUJFWSA-N 1 1 235.396 3.759 20 0 BHADMO CC(C)[C@@H]1[N@@H+](Cc2cccs2)CC12CCC2 ZINC000430089927 201143623 /nfs/dbraw/zinc/14/36/23/201143623.db2.gz ZYWLBUJWHJRJJR-ZDUSSCGKSA-N 1 1 235.396 3.759 20 0 BHADMO CCC(CC)C[N@H+]1CC(C)(C)[C@@H]1c1cccnc1 ZINC000430090242 201141710 /nfs/dbraw/zinc/14/17/10/201141710.db2.gz PVAJFHFYZZDQKP-HNNXBMFYSA-N 1 1 246.398 3.901 20 0 BHADMO CCC(CC)C[N@H+]1CC(C)(C)[C@H]1c1cccnc1 ZINC000430090243 201143321 /nfs/dbraw/zinc/14/33/21/201143321.db2.gz PVAJFHFYZZDQKP-OAHLLOKOSA-N 1 1 246.398 3.901 20 0 BHADMO CC(C)[C@H]1[N@@H+](Cc2ccsc2)CC12CCC2 ZINC000430094055 201142823 /nfs/dbraw/zinc/14/28/23/201142823.db2.gz IDLPEAZWZHMLTI-CYBMUJFWSA-N 1 1 235.396 3.759 20 0 BHADMO CC(C)[C@@H]1[N@@H+](Cc2ccsc2)CC12CCC2 ZINC000430094056 201142666 /nfs/dbraw/zinc/14/26/66/201142666.db2.gz IDLPEAZWZHMLTI-ZDUSSCGKSA-N 1 1 235.396 3.759 20 0 BHADMO Cc1ccc(C[N@H+]2CC3(CCC3)[C@@H]2C(C)C)o1 ZINC000430095071 201143353 /nfs/dbraw/zinc/14/33/53/201143353.db2.gz AIHCZKHSKLFHSD-AWEZNQCLSA-N 1 1 233.355 3.599 20 0 BHADMO Cc1ccc(C[N@H+]2CC3(CCC3)[C@H]2C(C)C)o1 ZINC000430095072 201141815 /nfs/dbraw/zinc/14/18/15/201141815.db2.gz AIHCZKHSKLFHSD-CQSZACIVSA-N 1 1 233.355 3.599 20 0 BHADMO CSC1(C[N@@H+](C)Cc2cccc(C)c2C)CC1 ZINC000430102159 201145440 /nfs/dbraw/zinc/14/54/40/201145440.db2.gz XRUSJKYQUQEFPQ-UHFFFAOYSA-N 1 1 249.423 3.631 20 0 BHADMO CCC[C@H](C)C[N@H+]1CC(C)(C)[C@H]1c1cccnc1 ZINC000430102605 201144082 /nfs/dbraw/zinc/14/40/82/201144082.db2.gz RADRCEYVJODPQA-DZGCQCFKSA-N 1 1 246.398 3.901 20 0 BHADMO CCC[C@@H](C)C[N@H+]1CC(C)(C)[C@@H]1c1cccnc1 ZINC000430102608 201145753 /nfs/dbraw/zinc/14/57/53/201145753.db2.gz RADRCEYVJODPQA-HIFRSBDPSA-N 1 1 246.398 3.901 20 0 BHADMO CCC[C@@H](C)C[N@H+]1CC(C)(C)[C@H]1c1cccnc1 ZINC000430102612 201144642 /nfs/dbraw/zinc/14/46/42/201144642.db2.gz RADRCEYVJODPQA-UKRRQHHQSA-N 1 1 246.398 3.901 20 0 BHADMO CCC[C@H](C)C[N@H+]1CC(C)(C)[C@@H]1c1cccnc1 ZINC000430102615 201144875 /nfs/dbraw/zinc/14/48/75/201144875.db2.gz RADRCEYVJODPQA-ZFWWWQNUSA-N 1 1 246.398 3.901 20 0 BHADMO CC1(C)C[N@H+](CC2(C)CCC2)[C@H]1c1cccnc1 ZINC000430102987 191325644 /nfs/dbraw/zinc/32/56/44/191325644.db2.gz KVQJCEWOGGMFDG-AWEZNQCLSA-N 1 1 244.382 3.655 20 0 BHADMO CC1(C)C[N@H+](CC2(C)CCC2)[C@@H]1c1cccnc1 ZINC000430102988 191325715 /nfs/dbraw/zinc/32/57/15/191325715.db2.gz KVQJCEWOGGMFDG-CQSZACIVSA-N 1 1 244.382 3.655 20 0 BHADMO Cc1ccoc1C[N@H+](C)Cc1cccc(C)c1C ZINC000430104526 201143875 /nfs/dbraw/zinc/14/38/75/201143875.db2.gz UYSVVZZUELCEIY-UHFFFAOYSA-N 1 1 243.350 3.837 20 0 BHADMO CC(C)(C)CC[N@H+]1CC(C)(C)[C@@H]1c1cccnc1 ZINC000430109441 201144368 /nfs/dbraw/zinc/14/43/68/201144368.db2.gz ZYXPDZBHWGEAKU-AWEZNQCLSA-N 1 1 246.398 3.901 20 0 BHADMO CC(C)(C)CC[N@H+]1CC(C)(C)[C@H]1c1cccnc1 ZINC000430109442 201145698 /nfs/dbraw/zinc/14/56/98/201145698.db2.gz ZYXPDZBHWGEAKU-CQSZACIVSA-N 1 1 246.398 3.901 20 0 BHADMO Cc1ccoc1C[N@H+]1CC2(CCC2)[C@@H]1C(C)C ZINC000430109884 201144114 /nfs/dbraw/zinc/14/41/14/201144114.db2.gz WFNLBOCFHWMNSQ-AWEZNQCLSA-N 1 1 233.355 3.599 20 0 BHADMO Cc1ccoc1C[N@H+]1CC2(CCC2)[C@H]1C(C)C ZINC000430109885 201143821 /nfs/dbraw/zinc/14/38/21/201143821.db2.gz WFNLBOCFHWMNSQ-CQSZACIVSA-N 1 1 233.355 3.599 20 0 BHADMO COCC(C)(C)[N@@H+](C)CC[C@H](C)c1ccccc1 ZINC000430113238 201144466 /nfs/dbraw/zinc/14/44/66/201144466.db2.gz IZBNXAPKWNIRBL-AWEZNQCLSA-N 1 1 249.398 3.537 20 0 BHADMO COCC(C)(C)[N@@H+](C)CC[C@@H](C)c1ccccc1 ZINC000430113239 201143887 /nfs/dbraw/zinc/14/38/87/201143887.db2.gz IZBNXAPKWNIRBL-CQSZACIVSA-N 1 1 249.398 3.537 20 0 BHADMO CC[C@@H](C[N@@H+](C)C(C)(C)COC)c1ccccc1 ZINC000430136759 201147351 /nfs/dbraw/zinc/14/73/51/201147351.db2.gz UPSXAAVDPZJWOB-AWEZNQCLSA-N 1 1 249.398 3.537 20 0 BHADMO CC[C@H](C[N@@H+](C)C(C)(C)COC)c1ccccc1 ZINC000430136761 201146171 /nfs/dbraw/zinc/14/61/71/201146171.db2.gz UPSXAAVDPZJWOB-CQSZACIVSA-N 1 1 249.398 3.537 20 0 BHADMO Cc1ccoc1C[N@H+](C)Cc1cc(C)ccc1F ZINC000430153705 201147208 /nfs/dbraw/zinc/14/72/08/201147208.db2.gz VTUWBADYHUXAQV-UHFFFAOYSA-N 1 1 247.313 3.668 20 0 BHADMO Cc1ccoc1C[N@@H+](C)Cc1cc(C)ccc1F ZINC000430153705 201147206 /nfs/dbraw/zinc/14/72/06/201147206.db2.gz VTUWBADYHUXAQV-UHFFFAOYSA-N 1 1 247.313 3.668 20 0 BHADMO CC[C@@H](C[N@H+]1CC[C@H]1CC)c1ccccc1 ZINC000430184453 201152360 /nfs/dbraw/zinc/15/23/60/201152360.db2.gz AONJLHSFEVKVEM-DZGCQCFKSA-N 1 1 217.356 3.665 20 0 BHADMO CC[C@H](C[N@H+]1CC[C@@H]1CC)c1ccccc1 ZINC000430184454 201152751 /nfs/dbraw/zinc/15/27/51/201152751.db2.gz AONJLHSFEVKVEM-HIFRSBDPSA-N 1 1 217.356 3.665 20 0 BHADMO CC[C@H](C[N@H+]1CC[C@H]1CC)c1ccccc1 ZINC000430184455 201152715 /nfs/dbraw/zinc/15/27/15/201152715.db2.gz AONJLHSFEVKVEM-UKRRQHHQSA-N 1 1 217.356 3.665 20 0 BHADMO CC[C@@H](C[N@H+]1CC[C@@H]1CC)c1ccccc1 ZINC000430184457 201152505 /nfs/dbraw/zinc/15/25/05/201152505.db2.gz AONJLHSFEVKVEM-ZFWWWQNUSA-N 1 1 217.356 3.665 20 0 BHADMO CC[C@H]1CC[N@H+]1Cc1cc(C)c(C)cc1C ZINC000430185339 201152907 /nfs/dbraw/zinc/15/29/07/201152907.db2.gz DHABVOWWSSELMS-HNNXBMFYSA-N 1 1 217.356 3.596 20 0 BHADMO CC[C@@H]1CC[N@H+]1Cc1cc(C)c(C)cc1C ZINC000430185342 201150255 /nfs/dbraw/zinc/15/02/55/201150255.db2.gz DHABVOWWSSELMS-OAHLLOKOSA-N 1 1 217.356 3.596 20 0 BHADMO CC[C@@H]1CC[N@H+]1Cc1c(C)oc2ccccc21 ZINC000430185348 201152186 /nfs/dbraw/zinc/15/21/86/201152186.db2.gz DHMUUEIJTPNYAB-GFCCVEGCSA-N 1 1 229.323 3.726 20 0 BHADMO CC[C@H]1CC[N@H+]1Cc1c(C)oc2ccccc21 ZINC000430185350 201151805 /nfs/dbraw/zinc/15/18/05/201151805.db2.gz DHMUUEIJTPNYAB-LBPRGKRZSA-N 1 1 229.323 3.726 20 0 BHADMO CC[C@H]1CC[N@H+]1Cc1cc(C)c2ncccc2c1 ZINC000430191118 201151449 /nfs/dbraw/zinc/15/14/49/201151449.db2.gz FIBXTOCGFZAQAJ-HNNXBMFYSA-N 1 1 240.350 3.528 20 0 BHADMO CC[C@@H]1CC[N@H+]1Cc1cc(C)c2ncccc2c1 ZINC000430191120 201152465 /nfs/dbraw/zinc/15/24/65/201152465.db2.gz FIBXTOCGFZAQAJ-OAHLLOKOSA-N 1 1 240.350 3.528 20 0 BHADMO CC[C@@H]1CC[N@H+]1Cc1ccc(C)c(Cl)c1 ZINC000430191536 201152028 /nfs/dbraw/zinc/15/20/28/201152028.db2.gz KKGLFMSTRKLSPS-GFCCVEGCSA-N 1 1 223.747 3.633 20 0 BHADMO CC[C@H]1CC[N@H+]1Cc1ccc(C)c(Cl)c1 ZINC000430191538 201151111 /nfs/dbraw/zinc/15/11/11/201151111.db2.gz KKGLFMSTRKLSPS-LBPRGKRZSA-N 1 1 223.747 3.633 20 0 BHADMO CC[C@H]1CC[N@H+]1Cc1ccc(OCC(C)C)cc1 ZINC000430191788 201151702 /nfs/dbraw/zinc/15/17/02/201151702.db2.gz HSNYERLVGLLKMG-HNNXBMFYSA-N 1 1 247.382 3.706 20 0 BHADMO CC[C@@H]1CC[N@H+]1Cc1ccc(OCC(C)C)cc1 ZINC000430191789 201152255 /nfs/dbraw/zinc/15/22/55/201152255.db2.gz HSNYERLVGLLKMG-OAHLLOKOSA-N 1 1 247.382 3.706 20 0 BHADMO CC[C@H]1CC[N@H+]1Cc1cccc(OCC(C)C)c1 ZINC000430192697 201151588 /nfs/dbraw/zinc/15/15/88/201151588.db2.gz CXWXIXTULINAIQ-HNNXBMFYSA-N 1 1 247.382 3.706 20 0 BHADMO CC[C@@H]1CC[N@H+]1Cc1cccc(OCC(C)C)c1 ZINC000430192699 201150710 /nfs/dbraw/zinc/15/07/10/201150710.db2.gz CXWXIXTULINAIQ-OAHLLOKOSA-N 1 1 247.382 3.706 20 0 BHADMO CC[C@@H]1CC[N@H+]1Cc1ccc(Cl)c(C)c1 ZINC000430192863 201151390 /nfs/dbraw/zinc/15/13/90/201151390.db2.gz DMRUUDSVDOSSHT-GFCCVEGCSA-N 1 1 223.747 3.633 20 0 BHADMO CC[C@H]1CC[N@H+]1Cc1ccc(Cl)c(C)c1 ZINC000430192865 201151601 /nfs/dbraw/zinc/15/16/01/201151601.db2.gz DMRUUDSVDOSSHT-LBPRGKRZSA-N 1 1 223.747 3.633 20 0 BHADMO CC[C@H]1CC[N@H+]1CCCCCOc1ccccc1 ZINC000430194710 201152320 /nfs/dbraw/zinc/15/23/20/201152320.db2.gz KGTKAGTZFRCCNP-HNNXBMFYSA-N 1 1 247.382 3.720 20 0 BHADMO CC[C@@H]1CC[N@H+]1CCCCCOc1ccccc1 ZINC000430194711 201151797 /nfs/dbraw/zinc/15/17/97/201151797.db2.gz KGTKAGTZFRCCNP-OAHLLOKOSA-N 1 1 247.382 3.720 20 0 BHADMO CC[C@@H]1CC[N@H+]1[C@@H]1CC[C@@](C)(c2ccccc2)C1 ZINC000430195189 201150776 /nfs/dbraw/zinc/15/07/76/201150776.db2.gz NDSJIDPRTNSYMG-BRWVUGGUSA-N 1 1 243.394 3.981 20 0 BHADMO CC[C@@H]1CC[N@H+]1[C@H]1CC[C@](C)(c2ccccc2)C1 ZINC000430195190 201152922 /nfs/dbraw/zinc/15/29/22/201152922.db2.gz NDSJIDPRTNSYMG-IKGGRYGDSA-N 1 1 243.394 3.981 20 0 BHADMO CC[C@@H]1CC[N@H+]1[C@H]1CC[C@@](C)(c2ccccc2)C1 ZINC000430195191 201152553 /nfs/dbraw/zinc/15/25/53/201152553.db2.gz NDSJIDPRTNSYMG-IXDOHACOSA-N 1 1 243.394 3.981 20 0 BHADMO CC[C@@H]1CC[N@H+]1[C@@H]1CC[C@](C)(c2ccccc2)C1 ZINC000430195192 351219862 /nfs/dbraw/zinc/21/98/62/351219862.db2.gz NDSJIDPRTNSYMG-ZACQAIPSSA-N 1 1 243.394 3.981 20 0 BHADMO CC[C@H]1CC[N@H+]1Cc1ccc(-c2ccccc2)o1 ZINC000430195325 201152575 /nfs/dbraw/zinc/15/25/75/201152575.db2.gz ZNINWEKDIWBKCO-AWEZNQCLSA-N 1 1 241.334 3.931 20 0 BHADMO CC[C@@H]1CC[N@H+]1Cc1ccc(-c2ccccc2)o1 ZINC000430195326 201152963 /nfs/dbraw/zinc/15/29/63/201152963.db2.gz ZNINWEKDIWBKCO-CQSZACIVSA-N 1 1 241.334 3.931 20 0 BHADMO CC[C@@H]1CC[N@H+]1CCc1ccc(F)cc1Cl ZINC000430197090 201152080 /nfs/dbraw/zinc/15/20/80/201152080.db2.gz UJFHMEZMQYKTMI-GFCCVEGCSA-N 1 1 241.737 3.506 20 0 BHADMO CC[C@H]1CC[N@H+]1CCc1ccc(F)cc1Cl ZINC000430197093 201150451 /nfs/dbraw/zinc/15/04/51/201150451.db2.gz UJFHMEZMQYKTMI-LBPRGKRZSA-N 1 1 241.737 3.506 20 0 BHADMO CCSc1cccc(C[N@H+]2CC[C@H]2CC)c1 ZINC000430197638 201151324 /nfs/dbraw/zinc/15/13/24/201151324.db2.gz VUKHTFQCTZJYGT-CYBMUJFWSA-N 1 1 235.396 3.783 20 0 BHADMO CCSc1cccc(C[N@H+]2CC[C@@H]2CC)c1 ZINC000430197640 201152141 /nfs/dbraw/zinc/15/21/41/201152141.db2.gz VUKHTFQCTZJYGT-ZDUSSCGKSA-N 1 1 235.396 3.783 20 0 BHADMO CC[C@@H]1CC[N@H+]1CC[C@H](C)c1ccccc1 ZINC000430198091 201152284 /nfs/dbraw/zinc/15/22/84/201152284.db2.gz XRZSNOFKQAKFRZ-DZGCQCFKSA-N 1 1 217.356 3.665 20 0 BHADMO CC[C@H]1CC[N@H+]1CC[C@@H](C)c1ccccc1 ZINC000430198092 201151052 /nfs/dbraw/zinc/15/10/52/201151052.db2.gz XRZSNOFKQAKFRZ-HIFRSBDPSA-N 1 1 217.356 3.665 20 0 BHADMO CC[C@@H]1CC[N@H+]1CC[C@@H](C)c1ccccc1 ZINC000430198093 201150901 /nfs/dbraw/zinc/15/09/01/201150901.db2.gz XRZSNOFKQAKFRZ-UKRRQHHQSA-N 1 1 217.356 3.665 20 0 BHADMO CC[C@H]1CC[N@H+]1CC[C@H](C)c1ccccc1 ZINC000430198094 201152949 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/nfs/dbraw/zinc/15/12/51/201151251.db2.gz ZNUMJRXFLZDQBO-FQNOHDAGSA-N 1 1 215.340 3.574 20 0 BHADMO CC[C@@H]1CC[N@H+]1C/C(C)=C/c1ccccc1 ZINC000430198674 201150363 /nfs/dbraw/zinc/15/03/63/201150363.db2.gz ZNUMJRXFLZDQBO-HFBDAHEESA-N 1 1 215.340 3.574 20 0 BHADMO CC[C@H]1CC[N@H+]1C/C(C)=C\c1ccccc1 ZINC000430198676 201151637 /nfs/dbraw/zinc/15/16/37/201151637.db2.gz ZNUMJRXFLZDQBO-HVCHUGMYSA-N 1 1 215.340 3.574 20 0 BHADMO CC[C@@H]1CC[N@H+]1Cc1ccc2nc(C)sc2c1 ZINC000430199992 201153267 /nfs/dbraw/zinc/15/32/67/201153267.db2.gz VTDGINAZNAXQEM-GFCCVEGCSA-N 1 1 246.379 3.589 20 0 BHADMO CC[C@H]1CC[N@H+]1Cc1ccc2nc(C)sc2c1 ZINC000430199995 201155001 /nfs/dbraw/zinc/15/50/01/201155001.db2.gz VTDGINAZNAXQEM-LBPRGKRZSA-N 1 1 246.379 3.589 20 0 BHADMO CC[C@H]1CC[N@H+]1[C@H](C)CCc1cccc(F)c1 ZINC000430200319 201153742 /nfs/dbraw/zinc/15/37/42/201153742.db2.gz UKPWAYKORUBYJU-DOMZBBRYSA-N 1 1 235.346 3.631 20 0 BHADMO CC[C@@H]1CC[N@H+]1[C@H](C)CCc1cccc(F)c1 ZINC000430200320 201153993 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ZINC000430266221 387602947 /nfs/dbraw/zinc/60/29/47/387602947.db2.gz BYQGLNVWWVWAJT-AAEUAGOBSA-N 1 1 233.330 3.785 20 0 BHADMO CC1=C[C@@H](C)C[N@H+]([C@H](C)c2ccccc2F)C1 ZINC000430266222 387602963 /nfs/dbraw/zinc/60/29/63/387602963.db2.gz BYQGLNVWWVWAJT-DGCLKSJQSA-N 1 1 233.330 3.785 20 0 BHADMO CC1=C[C@H](C)C[N@H+]([C@H](C)c2ccccc2F)C1 ZINC000430266223 387603785 /nfs/dbraw/zinc/60/37/85/387603785.db2.gz BYQGLNVWWVWAJT-WCQYABFASA-N 1 1 233.330 3.785 20 0 BHADMO CC1=C[C@@H](C)C[N@H+]([C@@H](C)c2ccccc2F)C1 ZINC000430266224 387602977 /nfs/dbraw/zinc/60/29/77/387602977.db2.gz BYQGLNVWWVWAJT-YPMHNXCESA-N 1 1 233.330 3.785 20 0 BHADMO CC1=C[C@@H](C)C[N@@H+](Cc2ccc(Cl)s2)C1 ZINC000430267085 385996998 /nfs/dbraw/zinc/99/69/98/385996998.db2.gz ISBVAWJFGRJAQN-SECBINFHSA-N 1 1 241.787 3.800 20 0 BHADMO CC1=C[C@H](C)C[N@@H+](Cc2ccc(Cl)s2)C1 ZINC000430267086 385998420 /nfs/dbraw/zinc/99/84/20/385998420.db2.gz ISBVAWJFGRJAQN-VIFPVBQESA-N 1 1 241.787 3.800 20 0 BHADMO CC1=C[C@@H](C)C[N@@H+](C/C=C\c2ccccc2)C1 ZINC000430267732 387603878 /nfs/dbraw/zinc/60/38/78/387603878.db2.gz KSVSUEYJBIRABU-DEBLGDTFSA-N 1 1 227.351 3.598 20 0 BHADMO CC1=C[C@H](C)C[N@@H+](C/C=C/c2ccccc2)C1 ZINC000430267733 387602837 /nfs/dbraw/zinc/60/28/37/387602837.db2.gz KSVSUEYJBIRABU-MRZGDXHCSA-N 1 1 227.351 3.598 20 0 BHADMO CC1=C[C@H](C)C[N@@H+](C/C=C\c2ccccc2)C1 ZINC000430267734 387603939 /nfs/dbraw/zinc/60/39/39/387603939.db2.gz KSVSUEYJBIRABU-PIZKADEWSA-N 1 1 227.351 3.598 20 0 BHADMO CC1=C[C@@H](C)C[N@@H+](C/C=C/c2ccccc2)C1 ZINC000430267735 387602218 /nfs/dbraw/zinc/60/22/18/387602218.db2.gz KSVSUEYJBIRABU-VIIAAUOXSA-N 1 1 227.351 3.598 20 0 BHADMO CC1=C[C@H](C)C[N@H+]([C@@H](C)c2cccc(F)c2)C1 ZINC000430268681 387606213 /nfs/dbraw/zinc/60/62/13/387606213.db2.gz OBNVZBZRPFQUFA-AAEUAGOBSA-N 1 1 233.330 3.785 20 0 BHADMO CC1=C[C@@H](C)C[N@H+]([C@H](C)c2cccc(F)c2)C1 ZINC000430268782 387605964 /nfs/dbraw/zinc/60/59/64/387605964.db2.gz OBNVZBZRPFQUFA-DGCLKSJQSA-N 1 1 233.330 3.785 20 0 BHADMO CC1=C[C@H](C)C[N@H+]([C@H](C)c2cccc(F)c2)C1 ZINC000430268783 387604400 /nfs/dbraw/zinc/60/44/00/387604400.db2.gz OBNVZBZRPFQUFA-WCQYABFASA-N 1 1 233.330 3.785 20 0 BHADMO CC1=C[C@@H](C)C[N@H+]([C@@H](C)c2cccc(F)c2)C1 ZINC000430268784 387604410 /nfs/dbraw/zinc/60/44/10/387604410.db2.gz OBNVZBZRPFQUFA-YPMHNXCESA-N 1 1 233.330 3.785 20 0 BHADMO CC1=C[C@H](C)C[N@H+]([C@@H](C)c2ccc(F)cc2)C1 ZINC000430268988 387606091 /nfs/dbraw/zinc/60/60/91/387606091.db2.gz OSJHCJUVIYFGGC-AAEUAGOBSA-N 1 1 233.330 3.785 20 0 BHADMO CC1=C[C@@H](C)C[N@H+]([C@H](C)c2ccc(F)cc2)C1 ZINC000430268989 387604856 /nfs/dbraw/zinc/60/48/56/387604856.db2.gz OSJHCJUVIYFGGC-DGCLKSJQSA-N 1 1 233.330 3.785 20 0 BHADMO CC1=C[C@H](C)C[N@H+]([C@H](C)c2ccc(F)cc2)C1 ZINC000430268990 387606449 /nfs/dbraw/zinc/60/64/49/387606449.db2.gz OSJHCJUVIYFGGC-WCQYABFASA-N 1 1 233.330 3.785 20 0 BHADMO CC1=C[C@@H](C)C[N@H+]([C@@H](C)c2ccc(F)cc2)C1 ZINC000430268991 387606197 /nfs/dbraw/zinc/60/61/97/387606197.db2.gz 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ZINC000430283697 398226166 /nfs/dbraw/zinc/22/61/66/398226166.db2.gz ZVVHQXIKVMZCKW-ZBEGNZNMSA-N 1 1 245.341 3.711 20 0 BHADMO CSc1ccccc1C[N@@H+]1CC(C)=C[C@@H](C)C1 ZINC000430283824 398227059 /nfs/dbraw/zinc/22/70/59/398227059.db2.gz LGDZJJNGFNIYNH-GFCCVEGCSA-N 1 1 247.407 3.807 20 0 BHADMO CSc1ccccc1C[N@@H+]1CC(C)=C[C@H](C)C1 ZINC000430283825 398227107 /nfs/dbraw/zinc/22/71/07/398227107.db2.gz LGDZJJNGFNIYNH-LBPRGKRZSA-N 1 1 247.407 3.807 20 0 BHADMO CC1=C[C@H](C)C[N@@H+](CCCCC(F)(F)F)C1 ZINC000430284222 398226933 /nfs/dbraw/zinc/22/69/33/398226933.db2.gz NEESYDCWOCQGRY-JTQLQIEISA-N 1 1 235.293 3.617 20 0 BHADMO CC1=C[C@@H](C)C[N@@H+](CCCCC(F)(F)F)C1 ZINC000430284223 398227041 /nfs/dbraw/zinc/22/70/41/398227041.db2.gz NEESYDCWOCQGRY-SNVBAGLBSA-N 1 1 235.293 3.617 20 0 BHADMO CC(C)C[N@@H+](C)CCSCc1ccccc1 ZINC000430718180 387642634 /nfs/dbraw/zinc/64/26/34/387642634.db2.gz GLPXKOWNDZYJDE-UHFFFAOYSA-N 1 1 237.412 3.508 20 0 BHADMO CC[C@@H](C)[N@@H+](C)CCSCc1ccccc1 ZINC000430720084 386579773 /nfs/dbraw/zinc/57/97/73/386579773.db2.gz LYZKDKCYMDPSCF-CYBMUJFWSA-N 1 1 237.412 3.650 20 0 BHADMO CC[C@H](C)[N@@H+](C)CCSCc1ccccc1 ZINC000430720085 386579876 /nfs/dbraw/zinc/57/98/76/386579876.db2.gz LYZKDKCYMDPSCF-ZDUSSCGKSA-N 1 1 237.412 3.650 20 0 BHADMO CC(C)[N@@H+](CCSCc1ccccc1)C1CC1 ZINC000430726834 387644914 /nfs/dbraw/zinc/64/49/14/387644914.db2.gz WFANFSAFCKUYMT-UHFFFAOYSA-N 1 1 249.423 3.793 20 0 BHADMO C[N@@H+](CCSCc1ccccc1)CC1CCC1 ZINC000430728671 387644181 /nfs/dbraw/zinc/64/41/81/387644181.db2.gz LNQQJNDUVBZQDE-UHFFFAOYSA-N 1 1 249.423 3.652 20 0 BHADMO CC[N@@H+](CCSCc1ccccc1)C(C)C ZINC000430730201 387644845 /nfs/dbraw/zinc/64/48/45/387644845.db2.gz QWCVQEMGMNAINL-UHFFFAOYSA-N 1 1 237.412 3.650 20 0 BHADMO C[N@@H+](CCSCc1ccccc1)C1CCCC1 ZINC000430739509 387647298 /nfs/dbraw/zinc/64/72/98/387647298.db2.gz HVZXNRSMFHTGLJ-UHFFFAOYSA-N 1 1 249.423 3.794 20 0 BHADMO C[C@H](C1CC1)[N@@H+](C)CCSCc1ccccc1 ZINC000430748012 387646158 /nfs/dbraw/zinc/64/61/58/387646158.db2.gz ZMYHHRWTBRNNEA-CYBMUJFWSA-N 1 1 249.423 3.650 20 0 BHADMO C[C@@H](C1CC1)[N@@H+](C)CCSCc1ccccc1 ZINC000430748013 387646344 /nfs/dbraw/zinc/64/63/44/387646344.db2.gz ZMYHHRWTBRNNEA-ZDUSSCGKSA-N 1 1 249.423 3.650 20 0 BHADMO CC1=CC[N@@H+](CCSCc2ccccc2)CC1 ZINC000430750585 398230013 /nfs/dbraw/zinc/23/00/13/398230013.db2.gz BYMNEFWSRQJXIP-UHFFFAOYSA-N 1 1 247.407 3.572 20 0 BHADMO CCC[N@@H+](CC)CCSCc1ccccc1 ZINC000430751960 398230388 /nfs/dbraw/zinc/23/03/88/398230388.db2.gz DLQPWQVEUVKQCW-UHFFFAOYSA-N 1 1 237.412 3.652 20 0 BHADMO CC[N@@H+](CCSCc1ccccc1)CC1CC1 ZINC000430755672 398230373 /nfs/dbraw/zinc/23/03/73/398230373.db2.gz RDAQCCGUXKBQIP-UHFFFAOYSA-N 1 1 249.423 3.652 20 0 BHADMO C[N@@H+](CCSCc1ccccc1)CCC1CC1 ZINC000430757264 398230450 /nfs/dbraw/zinc/23/04/50/398230450.db2.gz VNQVQJNCCSVYBP-UHFFFAOYSA-N 1 1 249.423 3.652 20 0 BHADMO CC[N@@H+](CCSCc1ccccc1)C1CCC1 ZINC000430759401 398230964 /nfs/dbraw/zinc/23/09/64/398230964.db2.gz GGJAQLJBPIQIQX-UHFFFAOYSA-N 1 1 249.423 3.794 20 0 BHADMO CC(C)[C@@H]1CC[N@H+]1CCSCc1ccccc1 ZINC000430761804 398230851 /nfs/dbraw/zinc/23/08/51/398230851.db2.gz MRIJWOUHVUGUPU-HNNXBMFYSA-N 1 1 249.423 3.650 20 0 BHADMO CC(C)[C@H]1CC[N@H+]1CCSCc1ccccc1 ZINC000430761805 398231221 /nfs/dbraw/zinc/23/12/21/398231221.db2.gz MRIJWOUHVUGUPU-OAHLLOKOSA-N 1 1 249.423 3.650 20 0 BHADMO c1ccc(CSCC[N@H+]2CCC23CCC3)cc1 ZINC000430765219 398232240 /nfs/dbraw/zinc/23/22/40/398232240.db2.gz VCOHSSAJHFVWII-UHFFFAOYSA-N 1 1 247.407 3.548 20 0 BHADMO CCCC[N@@H+](C)CCSCc1ccccc1 ZINC000430767256 398232168 /nfs/dbraw/zinc/23/21/68/398232168.db2.gz ZYOUMLVAHWBPBE-UHFFFAOYSA-N 1 1 237.412 3.652 20 0 BHADMO C(C1CCC1)[N@H+]1CCSC2(CCCCC2)C1 ZINC000430771365 387648492 /nfs/dbraw/zinc/64/84/92/387648492.db2.gz YYIMBTUAJCZKIE-UHFFFAOYSA-N 1 1 239.428 3.538 20 0 BHADMO CCCC[N@H+]1CCSC2(CCCCC2)C1 ZINC000430773088 192890860 /nfs/dbraw/zinc/89/08/60/192890860.db2.gz QDFVNQQDCNPGOC-UHFFFAOYSA-N 1 1 227.417 3.538 20 0 BHADMO CC1=C[C@@H](C)C[N@@H+](Cc2cccc3cc[nH]c32)C1 ZINC000430869871 387657086 /nfs/dbraw/zinc/65/70/86/387657086.db2.gz RKJHMJBUDRGRSO-GFCCVEGCSA-N 1 1 240.350 3.566 20 0 BHADMO CC1=C[C@H](C)C[N@@H+](Cc2cccc3cc[nH]c32)C1 ZINC000430869873 387656134 /nfs/dbraw/zinc/65/61/34/387656134.db2.gz RKJHMJBUDRGRSO-LBPRGKRZSA-N 1 1 240.350 3.566 20 0 BHADMO CC1=C[C@@H](C)C[N@@H+](C/C=C\c2ccc(F)cc2)C1 ZINC000430869886 387655447 /nfs/dbraw/zinc/65/54/47/387655447.db2.gz RNIURCRFIGZAEG-DHCBQETCSA-N 1 1 245.341 3.737 20 0 BHADMO CC1=C[C@@H](C)C[N@@H+](C/C=C/c2ccc(F)cc2)C1 ZINC000430869887 387655417 /nfs/dbraw/zinc/65/54/17/387655417.db2.gz RNIURCRFIGZAEG-ITDFMYJTSA-N 1 1 245.341 3.737 20 0 BHADMO CC1=C[C@H](C)C[N@@H+](C/C=C/c2ccc(F)cc2)C1 ZINC000430869889 387656711 /nfs/dbraw/zinc/65/67/11/387656711.db2.gz RNIURCRFIGZAEG-OOPCZODUSA-N 1 1 245.341 3.737 20 0 BHADMO CC1=C[C@H](C)C[N@@H+](C/C=C\c2ccc(F)cc2)C1 ZINC000430869891 387656968 /nfs/dbraw/zinc/65/69/68/387656968.db2.gz RNIURCRFIGZAEG-SCOBNMCVSA-N 1 1 245.341 3.737 20 0 BHADMO CC1=C[C@@H](C)C[N@@H+](Cc2ccsc2Cl)C1 ZINC000430873877 387656372 /nfs/dbraw/zinc/65/63/72/387656372.db2.gz AKCWGUZKYVISFN-SECBINFHSA-N 1 1 241.787 3.800 20 0 BHADMO CC1=C[C@H](C)C[N@@H+](Cc2ccsc2Cl)C1 ZINC000430873878 387656329 /nfs/dbraw/zinc/65/63/29/387656329.db2.gz AKCWGUZKYVISFN-VIFPVBQESA-N 1 1 241.787 3.800 20 0 BHADMO CC1=C[C@H](C)C[N@@H+](C[C@H]2C[C@@H]2c2ccccc2)C1 ZINC000430875987 387656231 /nfs/dbraw/zinc/65/62/31/387656231.db2.gz PNCFYCFYKHFCFV-IAOVAPTHSA-N 1 1 241.378 3.688 20 0 BHADMO CC1=C[C@H](C)C[N@@H+](C[C@@H]2C[C@H]2c2ccccc2)C1 ZINC000430875988 387657101 /nfs/dbraw/zinc/65/71/01/387657101.db2.gz PNCFYCFYKHFCFV-JQFCIGGWSA-N 1 1 241.378 3.688 20 0 BHADMO CC1=C[C@H](C)C[N@@H+](C[C@@H]2C[C@@H]2c2ccccc2)C1 ZINC000430875989 387656989 /nfs/dbraw/zinc/65/69/89/387656989.db2.gz PNCFYCFYKHFCFV-RRQGHBQHSA-N 1 1 241.378 3.688 20 0 BHADMO CC1=C[C@H](C)C[N@@H+](C[C@H]2C[C@H]2c2ccccc2)C1 ZINC000430875990 387656295 /nfs/dbraw/zinc/65/62/95/387656295.db2.gz PNCFYCFYKHFCFV-XKQJLSEDSA-N 1 1 241.378 3.688 20 0 BHADMO CC1=C[C@@H](C)C[N@@H+](Cc2cc(Cl)cs2)C1 ZINC000430879264 387655903 /nfs/dbraw/zinc/65/59/03/387655903.db2.gz NFFRYMYURAJFBL-SECBINFHSA-N 1 1 241.787 3.800 20 0 BHADMO CC1=C[C@H](C)C[N@@H+](Cc2cc(Cl)cs2)C1 ZINC000430879266 387656674 /nfs/dbraw/zinc/65/66/74/387656674.db2.gz NFFRYMYURAJFBL-VIFPVBQESA-N 1 1 241.787 3.800 20 0 BHADMO CC1=C[C@@H](C)C[N@@H+](Cc2coc3ccccc23)C1 ZINC000430879901 387657209 /nfs/dbraw/zinc/65/72/09/387657209.db2.gz VLDAROPVYPEDDU-GFCCVEGCSA-N 1 1 241.334 3.831 20 0 BHADMO CC1=C[C@H](C)C[N@@H+](Cc2coc3ccccc23)C1 ZINC000430879902 387657141 /nfs/dbraw/zinc/65/71/41/387657141.db2.gz VLDAROPVYPEDDU-LBPRGKRZSA-N 1 1 241.334 3.831 20 0 BHADMO CC1=C[C@@H](C)C[N@@H+](Cc2cccc3[nH]ccc32)C1 ZINC000430881476 387656100 /nfs/dbraw/zinc/65/61/00/387656100.db2.gz BLYNYOUIGMPJGR-GFCCVEGCSA-N 1 1 240.350 3.566 20 0 BHADMO CC1=C[C@H](C)C[N@@H+](Cc2cccc3[nH]ccc32)C1 ZINC000430881477 387657391 /nfs/dbraw/zinc/65/73/91/387657391.db2.gz BLYNYOUIGMPJGR-LBPRGKRZSA-N 1 1 240.350 3.566 20 0 BHADMO C[C@H](CCSc1ccccc1)[N@@H+](C)CC1CC1 ZINC000431601348 192148044 /nfs/dbraw/zinc/14/80/44/192148044.db2.gz SEODCXNZPGHFRF-CYBMUJFWSA-N 1 1 249.423 3.899 20 0 BHADMO C[C@@H](CCSc1ccccc1)[N@@H+](C)CC1CC1 ZINC000431601349 192148172 /nfs/dbraw/zinc/14/81/72/192148172.db2.gz SEODCXNZPGHFRF-ZDUSSCGKSA-N 1 1 249.423 3.899 20 0 BHADMO CCC[N@@H+](C)[C@H](C)CCSc1ccccc1 ZINC000431601835 387719537 /nfs/dbraw/zinc/71/95/37/387719537.db2.gz UZWOKNSIOCIQFD-CYBMUJFWSA-N 1 1 237.412 3.899 20 0 BHADMO CCC[N@@H+](C)[C@@H](C)CCSc1ccccc1 ZINC000431601836 387719398 /nfs/dbraw/zinc/71/93/98/387719398.db2.gz UZWOKNSIOCIQFD-ZDUSSCGKSA-N 1 1 237.412 3.899 20 0 BHADMO C[C@@H](CCSc1ccccc1)[N@H+]1CC[C@H](C)C1 ZINC000431605590 387722668 /nfs/dbraw/zinc/72/26/68/387722668.db2.gz SHODNTXHZUMYPC-KBPBESRZSA-N 1 1 249.423 3.899 20 0 BHADMO C[C@@H](CCSc1ccccc1)[N@H+]1CC[C@@H](C)C1 ZINC000431605591 387721434 /nfs/dbraw/zinc/72/14/34/387721434.db2.gz SHODNTXHZUMYPC-KGLIPLIRSA-N 1 1 249.423 3.899 20 0 BHADMO C[C@H](CCSc1ccccc1)[N@H+]1CC[C@H](C)C1 ZINC000431605592 387722620 /nfs/dbraw/zinc/72/26/20/387722620.db2.gz SHODNTXHZUMYPC-UONOGXRCSA-N 1 1 249.423 3.899 20 0 BHADMO C[C@H](CCSc1ccccc1)[N@H+]1CC[C@@H](C)C1 ZINC000431605593 387721285 /nfs/dbraw/zinc/72/12/85/387721285.db2.gz SHODNTXHZUMYPC-ZIAGYGMSSA-N 1 1 249.423 3.899 20 0 BHADMO CCC[N@H+](Cc1cccc(OCC)c1)CC1CC1 ZINC000431708683 387728239 /nfs/dbraw/zinc/72/82/39/387728239.db2.gz IWUXKYWCPDNYFD-UHFFFAOYSA-N 1 1 247.382 3.707 20 0 BHADMO CCC[N@H+]1CCCC[C@H]1c1ccc(F)cc1F ZINC000432011142 387744419 /nfs/dbraw/zinc/74/44/19/387744419.db2.gz GVAZLNVKDGCIJJ-AWEZNQCLSA-N 1 1 239.309 3.902 20 0 BHADMO CCC[N@H+]1CCCC[C@@H]1c1ccc(F)cc1F ZINC000432011143 387742812 /nfs/dbraw/zinc/74/28/12/387742812.db2.gz GVAZLNVKDGCIJJ-CQSZACIVSA-N 1 1 239.309 3.902 20 0 BHADMO CC[N@H+]1CCCC[C@@H]1c1ccc(F)cc1F ZINC000432013064 387745708 /nfs/dbraw/zinc/74/57/08/387745708.db2.gz PLDOWHJGYVYHLK-CYBMUJFWSA-N 1 1 225.282 3.512 20 0 BHADMO CC[N@H+]1CCCC[C@H]1c1ccc(F)cc1F ZINC000432013065 387745948 /nfs/dbraw/zinc/74/59/48/387745948.db2.gz PLDOWHJGYVYHLK-ZDUSSCGKSA-N 1 1 225.282 3.512 20 0 BHADMO Cc1ccccc1SCC[C@H]1CCC[N@@H+]1C ZINC000432235670 387775623 /nfs/dbraw/zinc/77/56/23/387775623.db2.gz LCWZCIZWFRXHOS-CYBMUJFWSA-N 1 1 235.396 3.571 20 0 BHADMO Cc1ccccc1SCC[C@@H]1CCC[N@@H+]1C ZINC000432235671 387774458 /nfs/dbraw/zinc/77/44/58/387774458.db2.gz LCWZCIZWFRXHOS-ZDUSSCGKSA-N 1 1 235.396 3.571 20 0 BHADMO Cc1cccc(SCC[C@H]2CCC[N@@H+]2C)c1 ZINC000432241643 387777152 /nfs/dbraw/zinc/77/71/52/387777152.db2.gz QVNKNMKDJWNMHZ-CYBMUJFWSA-N 1 1 235.396 3.571 20 0 BHADMO Cc1cccc(SCC[C@@H]2CCC[N@@H+]2C)c1 ZINC000432241644 387777235 /nfs/dbraw/zinc/77/72/35/387777235.db2.gz QVNKNMKDJWNMHZ-ZDUSSCGKSA-N 1 1 235.396 3.571 20 0 BHADMO Cc1ccc(SCC[C@H]2CCC[N@@H+]2C)cc1 ZINC000432246940 387777755 /nfs/dbraw/zinc/77/77/55/387777755.db2.gz OPFYHFXKEVYEQV-CYBMUJFWSA-N 1 1 235.396 3.571 20 0 BHADMO Cc1ccc(SCC[C@@H]2CCC[N@@H+]2C)cc1 ZINC000432246941 387777995 /nfs/dbraw/zinc/77/79/95/387777995.db2.gz OPFYHFXKEVYEQV-ZDUSSCGKSA-N 1 1 235.396 3.571 20 0 BHADMO c1nc(C[N@@H+]2CCC[C@H]2CCC2CCCC2)co1 ZINC000432722361 206063748 /nfs/dbraw/zinc/06/37/48/206063748.db2.gz KXGOPOMWGLCHFC-HNNXBMFYSA-N 1 1 248.370 3.609 20 0 BHADMO c1nc(C[N@@H+]2CCC[C@@H]2CCC2CCCC2)co1 ZINC000432722362 206063774 /nfs/dbraw/zinc/06/37/74/206063774.db2.gz KXGOPOMWGLCHFC-OAHLLOKOSA-N 1 1 248.370 3.609 20 0 BHADMO FC(F)(F)c1ccc(C[NH+]2CCCCC2)s1 ZINC000432728582 206063865 /nfs/dbraw/zinc/06/38/65/206063865.db2.gz MXUQKRGDZBXCFO-UHFFFAOYSA-N 1 1 249.301 3.753 20 0 BHADMO CC[N@@H+](Cc1ccc(C(F)(F)F)s1)C1CC1 ZINC000432737138 387812976 /nfs/dbraw/zinc/81/29/76/387812976.db2.gz AZDHCPWZKLHNFT-UHFFFAOYSA-N 1 1 249.301 3.751 20 0 BHADMO C[C@@H]1CC[N@@H+](Cc2ccc(C(F)(F)F)s2)C1 ZINC000432737732 387811186 /nfs/dbraw/zinc/81/11/86/387811186.db2.gz FCXVSZNIBAKLDW-MRVPVSSYSA-N 1 1 249.301 3.609 20 0 BHADMO C[C@H]1CC[N@@H+](Cc2ccc(C(F)(F)F)s2)C1 ZINC000432737733 387812142 /nfs/dbraw/zinc/81/21/42/387812142.db2.gz FCXVSZNIBAKLDW-QMMMGPOBSA-N 1 1 249.301 3.609 20 0 BHADMO CC[N@@H+](C)Cc1ccc(F)c(Cl)c1Cl ZINC000432739029 387811201 /nfs/dbraw/zinc/81/12/01/387811201.db2.gz OKSITIKKKWBDHC-UHFFFAOYSA-N 1 1 236.117 3.584 20 0 BHADMO CC[N@H+](C)Cc1ccc(F)c(Cl)c1Cl ZINC000432739029 387811197 /nfs/dbraw/zinc/81/11/97/387811197.db2.gz OKSITIKKKWBDHC-UHFFFAOYSA-N 1 1 236.117 3.584 20 0 BHADMO C[N@@H+](Cc1ccc(F)c(Cl)c1Cl)C1CC1 ZINC000432741109 387812597 /nfs/dbraw/zinc/81/25/97/387812597.db2.gz ZYFCCPKYBYWSLJ-UHFFFAOYSA-N 1 1 248.128 3.727 20 0 BHADMO C[N@H+](Cc1ccc(F)c(Cl)c1Cl)C1CC1 ZINC000432741109 387812595 /nfs/dbraw/zinc/81/25/95/387812595.db2.gz ZYFCCPKYBYWSLJ-UHFFFAOYSA-N 1 1 248.128 3.727 20 0 BHADMO C[N@@H+](Cc1ccc(C(F)(F)F)s1)C1CCC1 ZINC000432742208 387812570 /nfs/dbraw/zinc/81/25/70/387812570.db2.gz QYIVONQQZZLBQH-UHFFFAOYSA-N 1 1 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CC1(C[N@H+](CC(F)F)CC2CCC2)CCC1 ZINC000432774502 387815176 /nfs/dbraw/zinc/81/51/76/387815176.db2.gz PLSAFIOWWFXQDK-UHFFFAOYSA-N 1 1 231.330 3.544 20 0 BHADMO C[C@H](c1ccco1)[N@@H+](CC1(C)CCC1)C1CC1 ZINC000432776226 387816236 /nfs/dbraw/zinc/81/62/36/387816236.db2.gz MCBVURZJUKKYQI-GFCCVEGCSA-N 1 1 233.355 3.995 20 0 BHADMO C[C@@H](c1ccco1)[N@@H+](CC1(C)CCC1)C1CC1 ZINC000432776228 387355155 /nfs/dbraw/zinc/35/51/55/387355155.db2.gz MCBVURZJUKKYQI-LBPRGKRZSA-N 1 1 233.355 3.995 20 0 BHADMO C[C@H]1CC2(CCC2)C[N@H+]1Cc1ccc(Cl)o1 ZINC000432786173 387819262 /nfs/dbraw/zinc/81/92/62/387819262.db2.gz CCCQHLWSAGUNCL-JTQLQIEISA-N 1 1 239.746 3.698 20 0 BHADMO C[C@@H]1CC2(CCC2)C[N@H+]1Cc1ccc(Cl)o1 ZINC000432786176 387820306 /nfs/dbraw/zinc/82/03/06/387820306.db2.gz CCCQHLWSAGUNCL-SNVBAGLBSA-N 1 1 239.746 3.698 20 0 BHADMO C[C@H]1C[C@@H]1C[N@@H+](C)Cc1ccc(F)c(Cl)c1 ZINC000432787024 387820077 /nfs/dbraw/zinc/82/00/77/387820077.db2.gz QUMQRSPMGOHRCD-GXSJLCMTSA-N 1 1 241.737 3.567 20 0 BHADMO 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ZINC000433025118 387852136 /nfs/dbraw/zinc/85/21/36/387852136.db2.gz HRPDGSNMMSUZPF-GFCCVEGCSA-N 1 1 233.330 3.590 20 0 BHADMO C[C@H]1CC2(CCC2)C[N@H+]1Cc1ccccc1F ZINC000433025119 387852272 /nfs/dbraw/zinc/85/22/72/387852272.db2.gz HRPDGSNMMSUZPF-LBPRGKRZSA-N 1 1 233.330 3.590 20 0 BHADMO CC(C)C1CCC([N@@H+](C)Cc2ccccn2)CC1 ZINC000433026563 387851742 /nfs/dbraw/zinc/85/17/42/387851742.db2.gz GKSDQCBVBOFDSA-UHFFFAOYSA-N 1 1 246.398 3.728 20 0 BHADMO CC(C)C1CCC([N@@H+](C)Cc2ccncc2)CC1 ZINC000433028711 387853003 /nfs/dbraw/zinc/85/30/03/387853003.db2.gz POUZRLRURFUJDZ-UHFFFAOYSA-N 1 1 246.398 3.728 20 0 BHADMO C[N@@H+](CCSCC1CCC1)Cc1ccccc1 ZINC000433030237 387853568 /nfs/dbraw/zinc/85/35/68/387853568.db2.gz VNRABGSNSMFMNV-UHFFFAOYSA-N 1 1 249.423 3.652 20 0 BHADMO CC(C)C1CCC([N@@H+](C)Cc2cccnc2)CC1 ZINC000433030866 387853812 /nfs/dbraw/zinc/85/38/12/387853812.db2.gz XIIAWAXXOMVKFV-UHFFFAOYSA-N 1 1 246.398 3.728 20 0 BHADMO C[N@@H+](CCSC1CCCC1)Cc1ccccc1 ZINC000433033864 387854375 /nfs/dbraw/zinc/85/43/75/387854375.db2.gz QRVWVQCLTVEWKY-UHFFFAOYSA-N 1 1 249.423 3.794 20 0 BHADMO C[C@@H]1CC[C@H]([N@@H+](C)C[C@@H]2C[C@@H]2c2ccccc2)C1 ZINC000433036350 387854430 /nfs/dbraw/zinc/85/44/30/387854430.db2.gz UICNTPMJMPIUAD-BSWAZPDLSA-N 1 1 243.394 3.911 20 0 BHADMO C[C@@H]1CC[C@H]([N@@H+](C)C[C@@H]2C[C@H]2c2ccccc2)C1 ZINC000433036351 387853076 /nfs/dbraw/zinc/85/30/76/387853076.db2.gz UICNTPMJMPIUAD-IWCQGFGOSA-N 1 1 243.394 3.911 20 0 BHADMO C[C@@H]1CC[C@H]([N@@H+](C)C[C@H]2C[C@@H]2c2ccccc2)C1 ZINC000433036352 387855774 /nfs/dbraw/zinc/85/57/74/387855774.db2.gz UICNTPMJMPIUAD-MXASKKJJSA-N 1 1 243.394 3.911 20 0 BHADMO C[C@@H]1CC[C@H]([N@@H+](C)C[C@H]2C[C@H]2c2ccccc2)C1 ZINC000433036353 387854903 /nfs/dbraw/zinc/85/49/03/387854903.db2.gz UICNTPMJMPIUAD-SIXLDLHFSA-N 1 1 243.394 3.911 20 0 BHADMO CC[C@@H](C)SCC[N@@H+](C)Cc1ccccc1 ZINC000433041451 387855245 /nfs/dbraw/zinc/85/52/45/387855245.db2.gz UTTMEEJRCKIWIQ-CYBMUJFWSA-N 1 1 237.412 3.650 20 0 BHADMO CC[C@H](C)SCC[N@@H+](C)Cc1ccccc1 ZINC000433041452 387855442 /nfs/dbraw/zinc/85/54/42/387855442.db2.gz UTTMEEJRCKIWIQ-ZDUSSCGKSA-N 1 1 237.412 3.650 20 0 BHADMO CCOc1cccc(C[N@@H+](C)[C@@H]2CC[C@H](C)C2)c1 ZINC000433044049 397915817 /nfs/dbraw/zinc/91/58/17/397915817.db2.gz HQLJZVAZQLGWSC-DZGCQCFKSA-N 1 1 247.382 3.706 20 0 BHADMO CCOc1cccc(C[N@@H+](C)[C@H]2CC[C@@H](C)C2)c1 ZINC000433044050 397915631 /nfs/dbraw/zinc/91/56/31/397915631.db2.gz HQLJZVAZQLGWSC-HIFRSBDPSA-N 1 1 247.382 3.706 20 0 BHADMO CCOc1cccc(C[N@@H+](C)[C@@H]2CC[C@@H](C)C2)c1 ZINC000433044051 397916095 /nfs/dbraw/zinc/91/60/95/397916095.db2.gz HQLJZVAZQLGWSC-UKRRQHHQSA-N 1 1 247.382 3.706 20 0 BHADMO CCOc1cccc(C[N@@H+](C)[C@H]2CC[C@H](C)C2)c1 ZINC000433044052 397915824 /nfs/dbraw/zinc/91/58/24/397915824.db2.gz HQLJZVAZQLGWSC-ZFWWWQNUSA-N 1 1 247.382 3.706 20 0 BHADMO CC[C@H](C)[N@H+]1CCC[C@@H](c2ccccc2)C1 ZINC000433048951 397917812 /nfs/dbraw/zinc/91/78/12/397917812.db2.gz ZVLDRIREXISWEV-DZGCQCFKSA-N 1 1 217.356 3.665 20 0 BHADMO CC[C@@H](C)[N@H+]1CCC[C@@H](c2ccccc2)C1 ZINC000433048952 397917781 /nfs/dbraw/zinc/91/77/81/397917781.db2.gz ZVLDRIREXISWEV-UKRRQHHQSA-N 1 1 217.356 3.665 20 0 BHADMO Cc1cccc2c1C[N@@H+](Cc1ccsc1)CC2 ZINC000433049037 397917799 /nfs/dbraw/zinc/91/77/99/397917799.db2.gz PTONXKSFXBJYLF-UHFFFAOYSA-N 1 1 243.375 3.615 20 0 BHADMO CC[C@H](F)C[N@H+]1CCC[C@@H](c2ccccc2)C1 ZINC000433049355 192422745 /nfs/dbraw/zinc/42/27/45/192422745.db2.gz SYPRDPSJZHUSTO-CABCVRRESA-N 1 1 235.346 3.614 20 0 BHADMO CC[C@H](F)C[N@H+]1CCC[C@H](c2ccccc2)C1 ZINC000433049356 387587589 /nfs/dbraw/zinc/58/75/89/387587589.db2.gz SYPRDPSJZHUSTO-GJZGRUSLSA-N 1 1 235.346 3.614 20 0 BHADMO CC[C@@H](F)C[N@H+]1CCC[C@@H](c2ccccc2)C1 ZINC000433049357 192422753 /nfs/dbraw/zinc/42/27/53/192422753.db2.gz SYPRDPSJZHUSTO-HUUCEWRRSA-N 1 1 235.346 3.614 20 0 BHADMO CC[C@@H](F)C[N@H+]1CCC[C@H](c2ccccc2)C1 ZINC000433049358 387587425 /nfs/dbraw/zinc/58/74/25/387587425.db2.gz SYPRDPSJZHUSTO-LSDHHAIUSA-N 1 1 235.346 3.614 20 0 BHADMO CCc1ccc([C@H]2CC[N@@H+](CCCCF)C2)cc1 ZINC000433049391 387857181 /nfs/dbraw/zinc/85/71/81/387857181.db2.gz UEXSFMLCVFLSGZ-INIZCTEOSA-N 1 1 249.373 3.788 20 0 BHADMO CCc1ccc([C@@H]2CC[N@@H+](CCCCF)C2)cc1 ZINC000433049392 387856942 /nfs/dbraw/zinc/85/69/42/387856942.db2.gz UEXSFMLCVFLSGZ-MRXNPFEDSA-N 1 1 249.373 3.788 20 0 BHADMO c1ccc([C@H]2CCC[N@H+](CC3CCC3)C2)cc1 ZINC000433053753 387856481 /nfs/dbraw/zinc/85/64/81/387856481.db2.gz QQYJNZCQMNOMRL-INIZCTEOSA-N 1 1 229.367 3.666 20 0 BHADMO c1ccc([C@@H]2CCC[N@H+](CC3CCC3)C2)cc1 ZINC000433053754 387857199 /nfs/dbraw/zinc/85/71/99/387857199.db2.gz QQYJNZCQMNOMRL-MRXNPFEDSA-N 1 1 229.367 3.666 20 0 BHADMO CSCCC[N@H+]1CCC[C@H](c2ccccc2)C1 ZINC000433055202 387858385 /nfs/dbraw/zinc/85/83/85/387858385.db2.gz DKPULERLZSXYPN-HNNXBMFYSA-N 1 1 249.423 3.619 20 0 BHADMO CSCCC[N@H+]1CCC[C@@H](c2ccccc2)C1 ZINC000433055205 387858280 /nfs/dbraw/zinc/85/82/80/387858280.db2.gz DKPULERLZSXYPN-OAHLLOKOSA-N 1 1 249.423 3.619 20 0 BHADMO C[C@@H]1CC[C@@H]([N@@H+](C)Cc2ccc(Cl)o2)C1 ZINC000433057941 387858329 /nfs/dbraw/zinc/85/83/29/387858329.db2.gz NVILJAKOXXBJTH-NXEZZACHSA-N 1 1 227.735 3.553 20 0 BHADMO C[C@H]1CC[C@H]([N@@H+](C)Cc2ccc(Cl)o2)C1 ZINC000433057943 387858093 /nfs/dbraw/zinc/85/80/93/387858093.db2.gz NVILJAKOXXBJTH-UWVGGRQHSA-N 1 1 227.735 3.553 20 0 BHADMO C[C@H]1CC[C@@H]([N@@H+](C)Cc2ccc(Cl)o2)C1 ZINC000433057945 387858190 /nfs/dbraw/zinc/85/81/90/387858190.db2.gz NVILJAKOXXBJTH-VHSXEESVSA-N 1 1 227.735 3.553 20 0 BHADMO C[C@@H]1CC[C@H]([N@@H+](C)Cc2ccc(Cl)o2)C1 ZINC000433057946 387857774 /nfs/dbraw/zinc/85/77/74/387857774.db2.gz NVILJAKOXXBJTH-ZJUUUORDSA-N 1 1 227.735 3.553 20 0 BHADMO c1ccc([C@H]2CCC[N@H+](CCC3CC3)C2)cc1 ZINC000433058389 397916584 /nfs/dbraw/zinc/91/65/84/397916584.db2.gz AVWAWKIRJMUPGH-INIZCTEOSA-N 1 1 229.367 3.666 20 0 BHADMO c1ccc([C@@H]2CCC[N@H+](CCC3CC3)C2)cc1 ZINC000433058390 397916891 /nfs/dbraw/zinc/91/68/91/397916891.db2.gz AVWAWKIRJMUPGH-MRXNPFEDSA-N 1 1 229.367 3.666 20 0 BHADMO FCCCC[N@H+]1CCC[C@H](c2ccccc2)C1 ZINC000433066220 387860654 /nfs/dbraw/zinc/86/06/54/387860654.db2.gz GSBYDWDJAFJBRN-HNNXBMFYSA-N 1 1 235.346 3.616 20 0 BHADMO FCCCC[N@H+]1CCC[C@@H](c2ccccc2)C1 ZINC000433066310 387860165 /nfs/dbraw/zinc/86/01/65/387860165.db2.gz GSBYDWDJAFJBRN-OAHLLOKOSA-N 1 1 235.346 3.616 20 0 BHADMO C[C@H](F)CC[N@H+]1CCC[C@@H](c2ccccc2)C1 ZINC000433079106 387861144 /nfs/dbraw/zinc/86/11/44/387861144.db2.gz YCQZLDJXQPWOEF-DZGCQCFKSA-N 1 1 235.346 3.614 20 0 BHADMO C[C@@H](F)CC[N@H+]1CCC[C@H](c2ccccc2)C1 ZINC000433079107 387861375 /nfs/dbraw/zinc/86/13/75/387861375.db2.gz YCQZLDJXQPWOEF-HIFRSBDPSA-N 1 1 235.346 3.614 20 0 BHADMO C[C@@H](F)CC[N@H+]1CCC[C@@H](c2ccccc2)C1 ZINC000433079108 387861340 /nfs/dbraw/zinc/86/13/40/387861340.db2.gz YCQZLDJXQPWOEF-UKRRQHHQSA-N 1 1 235.346 3.614 20 0 BHADMO C[C@H](F)CC[N@H+]1CCC[C@H](c2ccccc2)C1 ZINC000433079109 387861654 /nfs/dbraw/zinc/86/16/54/387861654.db2.gz YCQZLDJXQPWOEF-ZFWWWQNUSA-N 1 1 235.346 3.614 20 0 BHADMO CCc1ccc([C@H]2CC[N@@H+](CC[C@H](C)F)C2)cc1 ZINC000433083754 387862429 /nfs/dbraw/zinc/86/24/29/387862429.db2.gz QPZSUCGPSBTIGR-BBRMVZONSA-N 1 1 249.373 3.786 20 0 BHADMO CCc1ccc([C@H]2CC[N@@H+](CC[C@@H](C)F)C2)cc1 ZINC000433083755 387863114 /nfs/dbraw/zinc/86/31/14/387863114.db2.gz QPZSUCGPSBTIGR-CJNGLKHVSA-N 1 1 249.373 3.786 20 0 BHADMO CCc1ccc([C@@H]2CC[N@@H+](CC[C@@H](C)F)C2)cc1 ZINC000433083757 387862419 /nfs/dbraw/zinc/86/24/19/387862419.db2.gz QPZSUCGPSBTIGR-CZUORRHYSA-N 1 1 249.373 3.786 20 0 BHADMO CCc1ccc([C@@H]2CC[N@@H+](CC[C@H](C)F)C2)cc1 ZINC000433083759 192982509 /nfs/dbraw/zinc/98/25/09/192982509.db2.gz QPZSUCGPSBTIGR-XJKSGUPXSA-N 1 1 249.373 3.786 20 0 BHADMO CC(C)[N@@H+](CC1CCC1)CC1(C)CCC1 ZINC000433207010 201167920 /nfs/dbraw/zinc/16/79/20/201167920.db2.gz PIMXNSICGPMSLQ-UHFFFAOYSA-N 1 1 209.377 3.687 20 0 BHADMO CC(C)[N@H+]1CC[C@@H](c2cccc(Cl)c2)C1 ZINC000433290733 201175712 /nfs/dbraw/zinc/17/57/12/201175712.db2.gz UGAHVCJYHFBENN-GFCCVEGCSA-N 1 1 223.747 3.538 20 0 BHADMO CC(C)[N@H+]1CC[C@H](c2cccc(Cl)c2)C1 ZINC000433290741 201176480 /nfs/dbraw/zinc/17/64/80/201176480.db2.gz UGAHVCJYHFBENN-LBPRGKRZSA-N 1 1 223.747 3.538 20 0 BHADMO Clc1cccc([C@H]2CC[N@@H+](CC3CCC3)C2)c1 ZINC000433309915 201178688 /nfs/dbraw/zinc/17/86/88/201178688.db2.gz FIDXPTHQWGZAGV-AWEZNQCLSA-N 1 1 249.785 3.929 20 0 BHADMO Clc1cccc([C@@H]2CC[N@@H+](CC3CCC3)C2)c1 ZINC000433309916 201179639 /nfs/dbraw/zinc/17/96/39/201179639.db2.gz FIDXPTHQWGZAGV-CQSZACIVSA-N 1 1 249.785 3.929 20 0 BHADMO CCC[N@H+]1CC[C@@H](c2cccc(Cl)c2)C1 ZINC000433313053 201178026 /nfs/dbraw/zinc/17/80/26/201178026.db2.gz TWAPYDPZXDQNFS-GFCCVEGCSA-N 1 1 223.747 3.539 20 0 BHADMO CCC[N@H+]1CC[C@H](c2cccc(Cl)c2)C1 ZINC000433313055 201178090 /nfs/dbraw/zinc/17/80/90/201178090.db2.gz TWAPYDPZXDQNFS-LBPRGKRZSA-N 1 1 223.747 3.539 20 0 BHADMO CC[C@H](C)[N@H+]1CC[C@H](c2cccc(Cl)c2)C1 ZINC000433314334 201178345 /nfs/dbraw/zinc/17/83/45/201178345.db2.gz AEPYLDYJUJOCHS-AAEUAGOBSA-N 1 1 237.774 3.928 20 0 BHADMO CC[C@@H](C)[N@H+]1CC[C@@H](c2cccc(Cl)c2)C1 ZINC000433314337 201178352 /nfs/dbraw/zinc/17/83/52/201178352.db2.gz AEPYLDYJUJOCHS-DGCLKSJQSA-N 1 1 237.774 3.928 20 0 BHADMO CC[C@H](C)[N@H+]1CC[C@@H](c2cccc(Cl)c2)C1 ZINC000433314338 201180156 /nfs/dbraw/zinc/18/01/56/201180156.db2.gz AEPYLDYJUJOCHS-WCQYABFASA-N 1 1 237.774 3.928 20 0 BHADMO CC[C@@H](C)[N@H+]1CC[C@H](c2cccc(Cl)c2)C1 ZINC000433314340 201178657 /nfs/dbraw/zinc/17/86/57/201178657.db2.gz AEPYLDYJUJOCHS-YPMHNXCESA-N 1 1 237.774 3.928 20 0 BHADMO Clc1cccc([C@H]2CC[N@@H+](CCC3CC3)C2)c1 ZINC000433321792 201182273 /nfs/dbraw/zinc/18/22/73/201182273.db2.gz WGSKXOKNHAJMKJ-AWEZNQCLSA-N 1 1 249.785 3.929 20 0 BHADMO Clc1cccc([C@@H]2CC[N@@H+](CCC3CC3)C2)c1 ZINC000433321793 201182021 /nfs/dbraw/zinc/18/20/21/201182021.db2.gz WGSKXOKNHAJMKJ-CQSZACIVSA-N 1 1 249.785 3.929 20 0 BHADMO Cc1nc(NC2CCC3(CC3)CC2)c(C)c(C)[nH+]1 ZINC000433809859 201196623 /nfs/dbraw/zinc/19/66/23/201196623.db2.gz WVQAGZQUUXUEIL-UHFFFAOYSA-N 1 1 245.370 3.537 20 0 BHADMO COCC[C@H](C)[N@@H+](C)Cc1ccc(C(C)C)cc1 ZINC000434420084 537892145 /nfs/dbraw/zinc/89/21/45/537892145.db2.gz CZSDOJLQADFAHM-AWEZNQCLSA-N 1 1 249.398 3.667 20 0 BHADMO COCC[C@@H](C)[N@@H+](C)Cc1ccc(C(C)C)cc1 ZINC000434420085 537892256 /nfs/dbraw/zinc/89/22/56/537892256.db2.gz CZSDOJLQADFAHM-CQSZACIVSA-N 1 1 249.398 3.667 20 0 BHADMO C[N@@H+](CCc1cccc(Cl)c1Cl)C1CC1 ZINC000434535197 201225825 /nfs/dbraw/zinc/22/58/25/201225825.db2.gz MKOJUPNERQDGPZ-UHFFFAOYSA-N 1 1 244.165 3.630 20 0 BHADMO CCC[N@@H+](C)CCc1cccc(Cl)c1Cl ZINC000434541458 201227218 /nfs/dbraw/zinc/22/72/18/201227218.db2.gz VBHGODJXSKYNIG-UHFFFAOYSA-N 1 1 246.181 3.878 20 0 BHADMO CC(C)[C@@H](c1ccc(F)cc1)[N@@H+](C)CC1CC1 ZINC000434611240 201229635 /nfs/dbraw/zinc/22/96/35/201229635.db2.gz FDHINIIVQUDLQL-HNNXBMFYSA-N 1 1 235.346 3.865 20 0 BHADMO CC(C)[C@H](c1ccc(F)cc1)[N@@H+](C)CC1CC1 ZINC000434611241 201230185 /nfs/dbraw/zinc/23/01/85/201230185.db2.gz FDHINIIVQUDLQL-OAHLLOKOSA-N 1 1 235.346 3.865 20 0 BHADMO CC(C)[C@@H](c1ccc(F)cc1)[N@@H+](C)CCCF ZINC000434612892 201228725 /nfs/dbraw/zinc/22/87/25/201228725.db2.gz XQJMUJDTVPAZDG-AWEZNQCLSA-N 1 1 241.325 3.814 20 0 BHADMO CC(C)[C@H](c1ccc(F)cc1)[N@@H+](C)CCCF ZINC000434612893 201228029 /nfs/dbraw/zinc/22/80/29/201228029.db2.gz XQJMUJDTVPAZDG-CQSZACIVSA-N 1 1 241.325 3.814 20 0 BHADMO CCC[N@@H+](C)[C@H](c1ccc(F)cc1)C(C)C ZINC000434613205 201228089 /nfs/dbraw/zinc/22/80/89/201228089.db2.gz BFUKKDXFMKIUMN-AWEZNQCLSA-N 1 1 223.335 3.865 20 0 BHADMO CCC[N@@H+](C)[C@@H](c1ccc(F)cc1)C(C)C ZINC000434613206 201228472 /nfs/dbraw/zinc/22/84/72/201228472.db2.gz BFUKKDXFMKIUMN-CQSZACIVSA-N 1 1 223.335 3.865 20 0 BHADMO Cc1cccc(C[N@H+]2CCSC(C)(C)CC2)c1 ZINC000434669711 201232482 /nfs/dbraw/zinc/23/24/82/201232482.db2.gz LSNVTHKGAUYBBI-UHFFFAOYSA-N 1 1 249.423 3.713 20 0 BHADMO Cc1ccccc1C[N@H+]1CCSC(C)(C)CC1 ZINC000434678094 201231804 /nfs/dbraw/zinc/23/18/04/201231804.db2.gz BZRMQTRGYNYRBI-UHFFFAOYSA-N 1 1 249.423 3.713 20 0 BHADMO C[C@H](c1ccccc1)[N@H+]1CCSC(C)(C)CC1 ZINC000434694330 201234061 /nfs/dbraw/zinc/23/40/61/201234061.db2.gz KZYJSWFHDDPMEX-CYBMUJFWSA-N 1 1 249.423 3.965 20 0 BHADMO C[C@@H](c1ccccc1)[N@H+]1CCSC(C)(C)CC1 ZINC000434694331 201234898 /nfs/dbraw/zinc/23/48/98/201234898.db2.gz KZYJSWFHDDPMEX-ZDUSSCGKSA-N 1 1 249.423 3.965 20 0 BHADMO CC/C=C/CC[N@H+]1CCSC(C)(C)CC1 ZINC000434712173 201236766 /nfs/dbraw/zinc/23/67/66/201236766.db2.gz UPTHKSYMPLONPW-AATRIKPKSA-N 1 1 227.417 3.560 20 0 BHADMO CC/C=C\CC[N@H+]1CCSC(C)(C)CC1 ZINC000434712174 201237753 /nfs/dbraw/zinc/23/77/53/201237753.db2.gz UPTHKSYMPLONPW-WAYWQWQTSA-N 1 1 227.417 3.560 20 0 BHADMO CCCC[N@H+]1CC[C@@H](c2ccccc2)[C@@H]1C ZINC000434894161 201245057 /nfs/dbraw/zinc/24/50/57/201245057.db2.gz FMQSAUSBPUBHHB-DZGCQCFKSA-N 1 1 217.356 3.665 20 0 BHADMO CCCC[N@H+]1CC[C@H](c2ccccc2)[C@H]1C ZINC000434894162 201246076 /nfs/dbraw/zinc/24/60/76/201246076.db2.gz FMQSAUSBPUBHHB-HIFRSBDPSA-N 1 1 217.356 3.665 20 0 BHADMO CCCC[N@H+]1CC[C@@H](c2ccccc2)[C@H]1C ZINC000434894163 201245116 /nfs/dbraw/zinc/24/51/16/201245116.db2.gz FMQSAUSBPUBHHB-UKRRQHHQSA-N 1 1 217.356 3.665 20 0 BHADMO CCCC[N@H+]1CC[C@H](c2ccccc2)[C@@H]1C ZINC000434894164 201246167 /nfs/dbraw/zinc/24/61/67/201246167.db2.gz FMQSAUSBPUBHHB-ZFWWWQNUSA-N 1 1 217.356 3.665 20 0 BHADMO C[C@H]1[C@@H](c2ccccc2)CC[N@H+]1CC1CCC1 ZINC000434898998 201245031 /nfs/dbraw/zinc/24/50/31/201245031.db2.gz YQJKHVCRJFMGPM-BBRMVZONSA-N 1 1 229.367 3.665 20 0 BHADMO C[C@@H]1[C@@H](c2ccccc2)CC[N@H+]1CC1CCC1 ZINC000434898999 201246000 /nfs/dbraw/zinc/24/60/00/201246000.db2.gz YQJKHVCRJFMGPM-CJNGLKHVSA-N 1 1 229.367 3.665 20 0 BHADMO C[C@@H]1[C@H](c2ccccc2)CC[N@H+]1CC1CCC1 ZINC000434899000 201244859 /nfs/dbraw/zinc/24/48/59/201244859.db2.gz YQJKHVCRJFMGPM-CZUORRHYSA-N 1 1 229.367 3.665 20 0 BHADMO C[C@H]1[C@H](c2ccccc2)CC[N@H+]1CC1CCC1 ZINC000434899001 201245578 /nfs/dbraw/zinc/24/55/78/201245578.db2.gz YQJKHVCRJFMGPM-XJKSGUPXSA-N 1 1 229.367 3.665 20 0 BHADMO CCC[N@@H+]1CC=C(c2ccc(Cl)cc2)CC1 ZINC000434899126 201245130 /nfs/dbraw/zinc/24/51/30/201245130.db2.gz ZVOGQNPRGFYBJI-UHFFFAOYSA-N 1 1 235.758 3.839 20 0 BHADMO C[C@@H]1[C@H](c2ccccc2)CC[N@H+]1[C@@H]1C=CCCC1 ZINC000434899986 201244822 /nfs/dbraw/zinc/24/48/22/201244822.db2.gz LDKCKNRASCZZNS-DJIMGWMZSA-N 1 1 241.378 3.973 20 0 BHADMO C[C@@H]1[C@H](c2ccccc2)CC[N@H+]1[C@H]1C=CCCC1 ZINC000434899987 201244978 /nfs/dbraw/zinc/24/49/78/201244978.db2.gz LDKCKNRASCZZNS-HYVNUMGLSA-N 1 1 241.378 3.973 20 0 BHADMO C[C@@H]1[C@@H](c2ccccc2)CC[N@H+]1[C@@H]1C=CCCC1 ZINC000434899989 191263676 /nfs/dbraw/zinc/26/36/76/191263676.db2.gz LDKCKNRASCZZNS-OIISXLGYSA-N 1 1 241.378 3.973 20 0 BHADMO C[C@@H]1[C@@H](c2ccccc2)CC[N@H+]1[C@H]1C=CCCC1 ZINC000434899992 191263453 /nfs/dbraw/zinc/26/34/53/191263453.db2.gz LDKCKNRASCZZNS-PVAVHDDUSA-N 1 1 241.378 3.973 20 0 BHADMO C[C@H](C[N@H+]1CCSC(C)(C)C1)c1ccccc1 ZINC000434904493 201245892 /nfs/dbraw/zinc/24/58/92/201245892.db2.gz FORCQABTLZEADR-CYBMUJFWSA-N 1 1 249.423 3.618 20 0 BHADMO C[C@@H](C[N@H+]1CCSC(C)(C)C1)c1ccccc1 ZINC000434904494 201245268 /nfs/dbraw/zinc/24/52/68/201245268.db2.gz FORCQABTLZEADR-ZDUSSCGKSA-N 1 1 249.423 3.618 20 0 BHADMO Cc1cccc([C@@H](C)[N@H+]2CCSC(C)(C)C2)c1 ZINC000434907459 201244926 /nfs/dbraw/zinc/24/49/26/201244926.db2.gz RYEZHJGCNYHCRK-CYBMUJFWSA-N 1 1 249.423 3.883 20 0 BHADMO Cc1cccc([C@H](C)[N@H+]2CCSC(C)(C)C2)c1 ZINC000434907560 201244762 /nfs/dbraw/zinc/24/47/62/201244762.db2.gz RYEZHJGCNYHCRK-ZDUSSCGKSA-N 1 1 249.423 3.883 20 0 BHADMO CCC[N@@H+](CC)Cc1ccc([C@H]2C[C@@H]2C)o1 ZINC000434980762 201247854 /nfs/dbraw/zinc/24/78/54/201247854.db2.gz BEVGZPSAHUELAF-AAEUAGOBSA-N 1 1 221.344 3.635 20 0 BHADMO CCC[N@@H+](CC)Cc1ccc([C@@H]2C[C@H]2C)o1 ZINC000434980763 201248872 /nfs/dbraw/zinc/24/88/72/201248872.db2.gz BEVGZPSAHUELAF-DGCLKSJQSA-N 1 1 221.344 3.635 20 0 BHADMO CCC[N@@H+](CC)Cc1ccc([C@@H]2C[C@@H]2C)o1 ZINC000434980764 201248881 /nfs/dbraw/zinc/24/88/81/201248881.db2.gz BEVGZPSAHUELAF-WCQYABFASA-N 1 1 221.344 3.635 20 0 BHADMO CCC[N@@H+](CC)Cc1ccc([C@H]2C[C@H]2C)o1 ZINC000434980765 201247570 /nfs/dbraw/zinc/24/75/70/201247570.db2.gz BEVGZPSAHUELAF-YPMHNXCESA-N 1 1 221.344 3.635 20 0 BHADMO CCC[N@@H+](CC)Cc1cnc(C2CCC2)s1 ZINC000434980774 201247077 /nfs/dbraw/zinc/24/70/77/201247077.db2.gz BIISANNBCFWRED-UHFFFAOYSA-N 1 1 238.400 3.643 20 0 BHADMO CCC[N@@H+](CC)Cc1ccccc1OCC1CC1 ZINC000434981195 201247868 /nfs/dbraw/zinc/24/78/68/201247868.db2.gz DTODYDPKJWZZMQ-UHFFFAOYSA-N 1 1 247.382 3.707 20 0 BHADMO Cc1ccoc1C[N@H+]1CC[C@H]1c1ccccc1 ZINC000434981643 201247009 /nfs/dbraw/zinc/24/70/09/201247009.db2.gz LBRPLNZDGFVWAW-AWEZNQCLSA-N 1 1 227.307 3.535 20 0 BHADMO Cc1ccoc1C[N@H+]1CC[C@@H]1c1ccccc1 ZINC000434981644 201247155 /nfs/dbraw/zinc/24/71/55/201247155.db2.gz LBRPLNZDGFVWAW-CQSZACIVSA-N 1 1 227.307 3.535 20 0 BHADMO CCc1ccc(C[N@H+]2CC[C@H]2c2ccccc2)o1 ZINC000434982492 201248317 /nfs/dbraw/zinc/24/83/17/201248317.db2.gz PKHSOONNMDIVGH-INIZCTEOSA-N 1 1 241.334 3.789 20 0 BHADMO CCc1ccc(C[N@H+]2CC[C@@H]2c2ccccc2)o1 ZINC000434982493 201248277 /nfs/dbraw/zinc/24/82/77/201248277.db2.gz PKHSOONNMDIVGH-MRXNPFEDSA-N 1 1 241.334 3.789 20 0 BHADMO CCC[N@@H+](CC)Cc1cnc(C(C)(C)C)s1 ZINC000434982584 201247049 /nfs/dbraw/zinc/24/70/49/201247049.db2.gz MBDDHYLLPWLRSV-UHFFFAOYSA-N 1 1 240.416 3.673 20 0 BHADMO CCC[N@@H+](CC)Cc1cccc(C)c1C ZINC000434983041 201248768 /nfs/dbraw/zinc/24/87/68/201248768.db2.gz PAAIYPLAYATDHS-UHFFFAOYSA-N 1 1 205.345 3.535 20 0 BHADMO CCC[N@@H+](CC)Cc1ccc(Cl)c(F)c1 ZINC000434983410 201248067 /nfs/dbraw/zinc/24/80/67/201248067.db2.gz QXYICZYYUKFVGB-UHFFFAOYSA-N 1 1 229.726 3.711 20 0 BHADMO Cc1ccc(C[N@H+]2CC[C@H]2c2ccccc2)o1 ZINC000434985487 201246772 /nfs/dbraw/zinc/24/67/72/201246772.db2.gz IZTHPTZFEOPXPS-HNNXBMFYSA-N 1 1 227.307 3.535 20 0 BHADMO Cc1ccc(C[N@H+]2CC[C@@H]2c2ccccc2)o1 ZINC000434985488 201247786 /nfs/dbraw/zinc/24/77/86/201247786.db2.gz IZTHPTZFEOPXPS-OAHLLOKOSA-N 1 1 227.307 3.535 20 0 BHADMO CCC[N@@H+](CC)Cc1cc(C)c(OC)c(C)c1 ZINC000434985569 201248838 /nfs/dbraw/zinc/24/88/38/201248838.db2.gz BSSZRBVMKDOCPP-UHFFFAOYSA-N 1 1 235.371 3.544 20 0 BHADMO c1cc(C[N@H+]2CC[C@H]2c2ccccc2)cs1 ZINC000434986351 201245530 /nfs/dbraw/zinc/24/55/30/201245530.db2.gz OEPKCQAVUIOXGI-AWEZNQCLSA-N 1 1 229.348 3.695 20 0 BHADMO c1cc(C[N@H+]2CC[C@@H]2c2ccccc2)cs1 ZINC000434986354 201246314 /nfs/dbraw/zinc/24/63/14/201246314.db2.gz OEPKCQAVUIOXGI-CQSZACIVSA-N 1 1 229.348 3.695 20 0 BHADMO CCC[N@@H+](CC)C/C(C)=C\c1ccccc1 ZINC000434993386 201248459 /nfs/dbraw/zinc/24/84/59/201248459.db2.gz YLVKLYNPBXXIEU-OWBHPGMISA-N 1 1 217.356 3.822 20 0 BHADMO CCC[N@@H+](CC)C/C(C)=C/c1ccccc1 ZINC000434993387 201248338 /nfs/dbraw/zinc/24/83/38/201248338.db2.gz YLVKLYNPBXXIEU-WYMLVPIESA-N 1 1 217.356 3.822 20 0 BHADMO CCC[N@@H+](CC)Cc1cc2cc(F)ccc2o1 ZINC000434993388 201248668 /nfs/dbraw/zinc/24/86/68/201248668.db2.gz YMHVNEIBBQRVEJ-UHFFFAOYSA-N 1 1 235.302 3.804 20 0 BHADMO CCCC[N@H+]1C[C@H](c2ccccc2C)OC[C@H]1C ZINC000435043793 201249936 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UJZWXMYPDDACIO-RISCZKNCSA-N 1 1 233.355 3.635 20 0 BHADMO C[C@H]1C[C@H]1c1ccc(C[N@@H+](C)CC2CCC2)o1 ZINC000435771225 201288619 /nfs/dbraw/zinc/28/86/19/201288619.db2.gz UJZWXMYPDDACIO-SMDDNHRTSA-N 1 1 233.355 3.635 20 0 BHADMO CCCOc1cccc(C[N@@H+](C)CC2CCC2)c1 ZINC000435771494 201288698 /nfs/dbraw/zinc/28/86/98/201288698.db2.gz VWWYGIKOVMIJIW-UHFFFAOYSA-N 1 1 247.382 3.707 20 0 BHADMO CCc1ccccc1CCn1cc[nH+]c1C(C)C ZINC000435787316 201287323 /nfs/dbraw/zinc/28/73/23/201287323.db2.gz ZSDQPYIMPLTNPP-UHFFFAOYSA-N 1 1 242.366 3.812 20 0 BHADMO CCCc1[nH+]ccn1CCc1ccccc1CC ZINC000435792106 201287777 /nfs/dbraw/zinc/28/77/77/201287777.db2.gz SMWMSVNQJFJJOO-UHFFFAOYSA-N 1 1 242.366 3.641 20 0 BHADMO C[C@H](c1cccc(F)c1)[NH+]1Cc2ccccc2C1 ZINC000436126998 201310811 /nfs/dbraw/zinc/31/08/11/201310811.db2.gz RTZBLWMVFVMWPQ-GFCCVEGCSA-N 1 1 241.309 3.903 20 0 BHADMO C[C@@H](c1cccc(F)c1)[NH+]1Cc2ccccc2C1 ZINC000436126999 201309989 /nfs/dbraw/zinc/30/99/89/201309989.db2.gz RTZBLWMVFVMWPQ-LBPRGKRZSA-N 1 1 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BHADMO C/C(=C/c1ccccc1)C[N@H+]1CCC=C(C)C1 ZINC000437342435 201351253 /nfs/dbraw/zinc/35/12/53/201351253.db2.gz DXHQEDZFYUCTRJ-PTNGSMBKSA-N 1 1 227.351 3.742 20 0 BHADMO C/C(=C\c1ccccc1)C[N@H+]1CCC=C(C)C1 ZINC000437342438 201352365 /nfs/dbraw/zinc/35/23/65/201352365.db2.gz DXHQEDZFYUCTRJ-RVDMUPIBSA-N 1 1 227.351 3.742 20 0 BHADMO CC1=CCC[N@H+](Cc2cccn2CCC(C)C)C1 ZINC000437342990 201351096 /nfs/dbraw/zinc/35/10/96/201351096.db2.gz CDLUVCRVEAROOG-UHFFFAOYSA-N 1 1 246.398 3.686 20 0 BHADMO CCCOc1cccc(C[N@H+]2CCC=C(C)C2)c1 ZINC000437345066 201350848 /nfs/dbraw/zinc/35/08/48/201350848.db2.gz JWMIWBYUSPKHCH-UHFFFAOYSA-N 1 1 245.366 3.627 20 0 BHADMO CC1=CCC[N@@H+](Cc2ccsc2Cl)C1 ZINC000437345722 201351982 /nfs/dbraw/zinc/35/19/82/201351982.db2.gz PRFBAJZNCXBGNJ-UHFFFAOYSA-N 1 1 227.760 3.554 20 0 BHADMO CC1=CCC[N@H+](Cc2ccsc2Cl)C1 ZINC000437345722 201351979 /nfs/dbraw/zinc/35/19/79/201351979.db2.gz PRFBAJZNCXBGNJ-UHFFFAOYSA-N 1 1 227.760 3.554 20 0 BHADMO CC1=CCC[N@@H+](Cc2cc(F)cc(Cl)c2)C1 ZINC000437347933 201350746 /nfs/dbraw/zinc/35/07/46/201350746.db2.gz QXJFWYVDHVKNJE-UHFFFAOYSA-N 1 1 239.721 3.631 20 0 BHADMO CC1=CCC[N@H+](Cc2cc(F)cc(Cl)c2)C1 ZINC000437347933 201350742 /nfs/dbraw/zinc/35/07/42/201350742.db2.gz QXJFWYVDHVKNJE-UHFFFAOYSA-N 1 1 239.721 3.631 20 0 BHADMO CC1=CCC[N@H+](CC[C@H](C)c2ccccc2)C1 ZINC000437348269 201351946 /nfs/dbraw/zinc/35/19/46/201351946.db2.gz VIMKDKIJZQHVRZ-HNNXBMFYSA-N 1 1 229.367 3.832 20 0 BHADMO CC1=CCC[N@H+](CC[C@@H](C)c2ccccc2)C1 ZINC000437348338 201351002 /nfs/dbraw/zinc/35/10/02/201351002.db2.gz VIMKDKIJZQHVRZ-OAHLLOKOSA-N 1 1 229.367 3.832 20 0 BHADMO Cc1oc2ccccc2c1C[N@H+]1CCC=C(C)C1 ZINC000437348361 201351728 /nfs/dbraw/zinc/35/17/28/201351728.db2.gz SENNBNSYCUHYSV-UHFFFAOYSA-N 1 1 241.334 3.893 20 0 BHADMO CC1=CCC[N@H+](C[C@@H](C)c2ccc(F)cc2)C1 ZINC000437348745 201351504 /nfs/dbraw/zinc/35/15/04/201351504.db2.gz WPHOBGRWVNUTPJ-CYBMUJFWSA-N 1 1 233.330 3.581 20 0 BHADMO CC1=CCC[N@H+](C[C@H](C)c2ccc(F)cc2)C1 ZINC000437348747 201350758 /nfs/dbraw/zinc/35/07/58/201350758.db2.gz WPHOBGRWVNUTPJ-ZDUSSCGKSA-N 1 1 233.330 3.581 20 0 BHADMO CC1=CCC[N@@H+](Cc2cnc(C3CCC3)s2)C1 ZINC000437349345 201351599 /nfs/dbraw/zinc/35/15/99/201351599.db2.gz XSXDRYVEZYMCGL-UHFFFAOYSA-N 1 1 248.395 3.563 20 0 BHADMO CC1=CCC[N@@H+](Cc2cc(Cl)cs2)C1 ZINC000437349669 201350656 /nfs/dbraw/zinc/35/06/56/201350656.db2.gz WKYKOGJNYYXACA-UHFFFAOYSA-N 1 1 227.760 3.554 20 0 BHADMO CC1=CCC[N@@H+](Cc2coc3ccccc23)C1 ZINC000437349677 201350783 /nfs/dbraw/zinc/35/07/83/201350783.db2.gz VMVYPQUVYAPTPQ-UHFFFAOYSA-N 1 1 227.307 3.585 20 0 BHADMO CCSc1cccc(C[N@H+]2CCC=C(C)C2)c1 ZINC000437351556 201351404 /nfs/dbraw/zinc/35/14/04/201351404.db2.gz ZRHBQQXOVZWHFU-UHFFFAOYSA-N 1 1 247.407 3.951 20 0 BHADMO CC1=CCC[N@H+](C[C@@H](C)Cc2ccccc2)C1 ZINC000437352632 201352135 /nfs/dbraw/zinc/35/21/35/201352135.db2.gz FJOWUNQOXIHXNT-HNNXBMFYSA-N 1 1 229.367 3.517 20 0 BHADMO CC1=CCC[N@H+](C[C@H](C)Cc2ccccc2)C1 ZINC000437352633 201351645 /nfs/dbraw/zinc/35/16/45/201351645.db2.gz FJOWUNQOXIHXNT-OAHLLOKOSA-N 1 1 229.367 3.517 20 0 BHADMO CC1=CCC[N@@H+](C/C=C/c2ccc(F)cc2F)C1 ZINC000437355224 201350973 /nfs/dbraw/zinc/35/09/73/201350973.db2.gz UVDRWDFGCNGTDO-HWKANZROSA-N 1 1 249.304 3.630 20 0 BHADMO CC1=CCC[N@@H+](C/C=C\c2ccc(F)cc2F)C1 ZINC000437355225 201352248 /nfs/dbraw/zinc/35/22/48/201352248.db2.gz UVDRWDFGCNGTDO-HYXAFXHYSA-N 1 1 249.304 3.630 20 0 BHADMO Cc1ccc(CC[N@H+](C)[C@@H](C)C2(C)CC2)cc1 ZINC000437520168 201354822 /nfs/dbraw/zinc/35/48/22/201354822.db2.gz QEZVNHXUJBEQDT-AWEZNQCLSA-N 1 1 231.383 3.658 20 0 BHADMO Cc1ccc(CC[N@H+](C)[C@H](C)C2(C)CC2)cc1 ZINC000437520169 201355995 /nfs/dbraw/zinc/35/59/95/201355995.db2.gz QEZVNHXUJBEQDT-CQSZACIVSA-N 1 1 231.383 3.658 20 0 BHADMO C[C@@H](C[N@@H+](C)[C@@H](C)C1(C)CC1)c1ccccc1 ZINC000437525990 201355076 /nfs/dbraw/zinc/35/50/76/201355076.db2.gz QWCGHHJCQPXRBX-KBPBESRZSA-N 1 1 231.383 3.911 20 0 BHADMO C[C@H](C[N@@H+](C)[C@@H](C)C1(C)CC1)c1ccccc1 ZINC000437525991 201356034 /nfs/dbraw/zinc/35/60/34/201356034.db2.gz QWCGHHJCQPXRBX-KGLIPLIRSA-N 1 1 231.383 3.911 20 0 BHADMO C[C@@H](C[N@@H+](C)[C@H](C)C1(C)CC1)c1ccccc1 ZINC000437525992 201355914 /nfs/dbraw/zinc/35/59/14/201355914.db2.gz QWCGHHJCQPXRBX-UONOGXRCSA-N 1 1 231.383 3.911 20 0 BHADMO C[C@@H]([N@H+](C)C[C@@H](C)c1ccccc1)C1(C)CC1 ZINC000437525993 201354435 /nfs/dbraw/zinc/35/44/35/201354435.db2.gz QWCGHHJCQPXRBX-ZIAGYGMSSA-N 1 1 231.383 3.911 20 0 BHADMO C[C@@H]([N@@H+](C)CCC1CCCC1)C1(C)CC1 ZINC000437534430 201355437 /nfs/dbraw/zinc/35/54/37/201355437.db2.gz DSBSPXJFQCJHNH-GFCCVEGCSA-N 1 1 209.377 3.687 20 0 BHADMO C[C@H]([N@@H+](C)CCC1CCCC1)C1(C)CC1 ZINC000437534437 201355487 /nfs/dbraw/zinc/35/54/87/201355487.db2.gz DSBSPXJFQCJHNH-LBPRGKRZSA-N 1 1 209.377 3.687 20 0 BHADMO C[C@@H]([N@@H+](C)CCSc1ccccc1)C1(C)CC1 ZINC000437541392 201355952 /nfs/dbraw/zinc/35/59/52/201355952.db2.gz WVVMWNRPITUUNI-CYBMUJFWSA-N 1 1 249.423 3.899 20 0 BHADMO C[C@H]([N@@H+](C)CCSc1ccccc1)C1(C)CC1 ZINC000437541394 201354839 /nfs/dbraw/zinc/35/48/39/201354839.db2.gz WVVMWNRPITUUNI-ZDUSSCGKSA-N 1 1 249.423 3.899 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1cc2c(cccc2F)[nH]1 ZINC000437574220 201357927 /nfs/dbraw/zinc/35/79/27/201357927.db2.gz AUBMKXORXYFOGH-JTQLQIEISA-N 1 1 234.318 3.537 20 0 BHADMO CC[C@@H](C)[N@@H+](C)Cc1cc2c(cccc2F)[nH]1 ZINC000437574222 201357280 /nfs/dbraw/zinc/35/72/80/201357280.db2.gz AUBMKXORXYFOGH-SNVBAGLBSA-N 1 1 234.318 3.537 20 0 BHADMO CC(C)[N@@H+](C[C@@H](C)c1ccc(F)cc1)C1CC1 ZINC000437574463 201358282 /nfs/dbraw/zinc/35/82/82/201358282.db2.gz BKAQDNDCAZSJNO-GFCCVEGCSA-N 1 1 235.346 3.802 20 0 BHADMO CC(C)[N@@H+](C[C@H](C)c1ccc(F)cc1)C1CC1 ZINC000437574466 201358139 /nfs/dbraw/zinc/35/81/39/201358139.db2.gz BKAQDNDCAZSJNO-LBPRGKRZSA-N 1 1 235.346 3.802 20 0 BHADMO CC[C@H](C)[N@@H+](C)C[C@@H](C)c1ccc(F)cc1 ZINC000437574472 201356557 /nfs/dbraw/zinc/35/65/57/201356557.db2.gz BLUDVHNLXDKJCD-NEPJUHHUSA-N 1 1 223.335 3.660 20 0 BHADMO CC[C@@H](C)[N@@H+](C)C[C@H](C)c1ccc(F)cc1 ZINC000437574477 201357337 /nfs/dbraw/zinc/35/73/37/201357337.db2.gz BLUDVHNLXDKJCD-NWDGAFQWSA-N 1 1 223.335 3.660 20 0 BHADMO CC[C@H](C)[N@@H+](C)C[C@H](C)c1ccc(F)cc1 ZINC000437574478 201356475 /nfs/dbraw/zinc/35/64/75/201356475.db2.gz BLUDVHNLXDKJCD-RYUDHWBXSA-N 1 1 223.335 3.660 20 0 BHADMO CC[C@@H](C)[N@@H+](C)C[C@@H](C)c1ccc(F)cc1 ZINC000437574481 201358177 /nfs/dbraw/zinc/35/81/77/201358177.db2.gz BLUDVHNLXDKJCD-VXGBXAGGSA-N 1 1 223.335 3.660 20 0 BHADMO CCCC[N@@H+](C)Cc1cc2c(cccc2F)[nH]1 ZINC000437574850 201355640 /nfs/dbraw/zinc/35/56/40/201355640.db2.gz DIHRFAAYJOKYGZ-UHFFFAOYSA-N 1 1 234.318 3.539 20 0 BHADMO C[N@@H+](C1CC1)[C@@H]1CC[C@](C)(c2ccccc2)C1 ZINC000437577082 201357822 /nfs/dbraw/zinc/35/78/22/201357822.db2.gz DDRDVAYPDDTGPV-CVEARBPZSA-N 1 1 229.367 3.591 20 0 BHADMO C[N@@H+](C1CC1)[C@H]1CC[C@](C)(c2ccccc2)C1 ZINC000437577084 201358463 /nfs/dbraw/zinc/35/84/63/201358463.db2.gz DDRDVAYPDDTGPV-HOTGVXAUSA-N 1 1 229.367 3.591 20 0 BHADMO C[N@@H+](C1CC1)[C@@H]1CC[C@@](C)(c2ccccc2)C1 ZINC000437577086 201356289 /nfs/dbraw/zinc/35/62/89/201356289.db2.gz DDRDVAYPDDTGPV-HZPDHXFCSA-N 1 1 229.367 3.591 20 0 BHADMO C[N@@H+](C1CC1)[C@H]1CC[C@@](C)(c2ccccc2)C1 ZINC000437577088 201358393 /nfs/dbraw/zinc/35/83/93/201358393.db2.gz DDRDVAYPDDTGPV-JKSUJKDBSA-N 1 1 229.367 3.591 20 0 BHADMO CCCC[N@@H+](C)C[C@@H](C)c1ccc(F)cc1 ZINC000437577296 201357663 /nfs/dbraw/zinc/35/76/63/201357663.db2.gz JTNVJVHUOCYBCD-GFCCVEGCSA-N 1 1 223.335 3.661 20 0 BHADMO CCCC[N@@H+](C)C[C@H](C)c1ccc(F)cc1 ZINC000437577299 201358512 /nfs/dbraw/zinc/35/85/12/201358512.db2.gz JTNVJVHUOCYBCD-LBPRGKRZSA-N 1 1 223.335 3.661 20 0 BHADMO CC[N@H+](Cc1cc2c(cccc2F)[nH]1)CC(C)C ZINC000437578272 201356277 /nfs/dbraw/zinc/35/62/77/201356277.db2.gz LKTCJLMNWKZKEO-UHFFFAOYSA-N 1 1 248.345 3.785 20 0 BHADMO CC(C)[C@@H](C)[N@@H+](C)C[C@@H](C)c1ccc(F)cc1 ZINC000437579206 201356329 /nfs/dbraw/zinc/35/63/29/201356329.db2.gz NVOBDTNLCCKVHQ-CHWSQXEVSA-N 1 1 237.362 3.906 20 0 BHADMO CC(C)[C@H](C)[N@@H+](C)C[C@@H](C)c1ccc(F)cc1 ZINC000437579216 201356711 /nfs/dbraw/zinc/35/67/11/201356711.db2.gz NVOBDTNLCCKVHQ-OLZOCXBDSA-N 1 1 237.362 3.906 20 0 BHADMO CC(C)[C@@H](C)[N@@H+](C)C[C@H](C)c1ccc(F)cc1 ZINC000437579219 201356956 /nfs/dbraw/zinc/35/69/56/201356956.db2.gz NVOBDTNLCCKVHQ-QWHCGFSZSA-N 1 1 237.362 3.906 20 0 BHADMO CC(C)[C@H](C)[N@@H+](C)C[C@H](C)c1ccc(F)cc1 ZINC000437579221 201356786 /nfs/dbraw/zinc/35/67/86/201356786.db2.gz NVOBDTNLCCKVHQ-STQMWFEESA-N 1 1 237.362 3.906 20 0 BHADMO CCC[N@@H+](CC)Cc1ccc2nc(C)ccc2c1 ZINC000437579251 201358542 /nfs/dbraw/zinc/35/85/42/201358542.db2.gz LCBHHRJBJFXAHY-UHFFFAOYSA-N 1 1 242.366 3.775 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)Cc1cc2c(cccc2F)[nH]1 ZINC000437579858 201356969 /nfs/dbraw/zinc/35/69/69/201356969.db2.gz MKCJAYPESUNTGP-LLVKDONJSA-N 1 1 248.345 3.927 20 0 BHADMO CCC[C@H](C)[N@@H+](C)Cc1cc2c(cccc2F)[nH]1 ZINC000437579861 201358195 /nfs/dbraw/zinc/35/81/95/201358195.db2.gz MKCJAYPESUNTGP-NSHDSACASA-N 1 1 248.345 3.927 20 0 BHADMO CC(C)[C@@H](C)[N@@H+](C)Cc1cc2c(cccc2F)[nH]1 ZINC000437580797 201358488 /nfs/dbraw/zinc/35/84/88/201358488.db2.gz QXLKMIOWMUNWQR-LLVKDONJSA-N 1 1 248.345 3.783 20 0 BHADMO CC(C)[C@H](C)[N@@H+](C)Cc1cc2c(cccc2F)[nH]1 ZINC000437580800 201357474 /nfs/dbraw/zinc/35/74/74/201357474.db2.gz QXLKMIOWMUNWQR-NSHDSACASA-N 1 1 248.345 3.783 20 0 BHADMO CCC[N@@H+](C)CCCCCOc1ccccc1 ZINC000437580881 201357956 /nfs/dbraw/zinc/35/79/56/201357956.db2.gz KQGIDTVNTTXOFS-UHFFFAOYSA-N 1 1 235.371 3.578 20 0 BHADMO CC[C@H](C)[N@@H+](C)CCCCCOc1ccccc1 ZINC000437581446 201358747 /nfs/dbraw/zinc/35/87/47/201358747.db2.gz PNJHPTOGNSHQQT-HNNXBMFYSA-N 1 1 249.398 3.966 20 0 BHADMO CC[C@@H](C)[N@@H+](C)CCCCCOc1ccccc1 ZINC000437581448 201356392 /nfs/dbraw/zinc/35/63/92/201356392.db2.gz PNJHPTOGNSHQQT-OAHLLOKOSA-N 1 1 249.398 3.966 20 0 BHADMO CCC[N@@H+](CC)Cc1ccc(Cl)cc1F ZINC000437581494 201358243 /nfs/dbraw/zinc/35/82/43/201358243.db2.gz PTRJYWAMEQEPHV-UHFFFAOYSA-N 1 1 229.726 3.711 20 0 BHADMO C[C@H](C[N@@H+](C)Cc1ccco1)c1ccc(F)cc1 ZINC000437581563 201356408 /nfs/dbraw/zinc/35/64/08/201356408.db2.gz WGRDUVDYLMHJEF-GFCCVEGCSA-N 1 1 247.313 3.654 20 0 BHADMO C[C@@H](C[N@@H+](C)Cc1ccco1)c1ccc(F)cc1 ZINC000437581564 201356398 /nfs/dbraw/zinc/35/63/98/201356398.db2.gz WGRDUVDYLMHJEF-LBPRGKRZSA-N 1 1 247.313 3.654 20 0 BHADMO CCC[N@@H+](CC)C[C@@H](C)c1ccc(F)cc1 ZINC000437582007 201356799 /nfs/dbraw/zinc/35/67/99/201356799.db2.gz QKXCDFJCURYNOP-GFCCVEGCSA-N 1 1 223.335 3.661 20 0 BHADMO CCC[N@@H+](CC)C[C@H](C)c1ccc(F)cc1 ZINC000437582009 201358451 /nfs/dbraw/zinc/35/84/51/201358451.db2.gz QKXCDFJCURYNOP-LBPRGKRZSA-N 1 1 223.335 3.661 20 0 BHADMO CCC[N@@H+](CC)Cc1cc2c(cccc2F)[nH]1 ZINC000437582946 201357292 /nfs/dbraw/zinc/35/72/92/201357292.db2.gz RKDFZDIWGADWTP-UHFFFAOYSA-N 1 1 234.318 3.539 20 0 BHADMO CC(C)[N@@H+](Cc1cc2c(cccc2F)[nH]1)C1CC1 ZINC000437583411 201357258 /nfs/dbraw/zinc/35/72/58/201357258.db2.gz SOIHUPZIWJTNQK-UHFFFAOYSA-N 1 1 246.329 3.680 20 0 BHADMO CCC[N@@H+](C)[C@@H]1CC[C@](C)(c2ccccc2)C1 ZINC000437583740 201356853 /nfs/dbraw/zinc/35/68/53/201356853.db2.gz QFHLOLNJPKLXKY-CVEARBPZSA-N 1 1 231.383 3.839 20 0 BHADMO CCC[N@@H+](C)[C@H]1CC[C@](C)(c2ccccc2)C1 ZINC000437583742 201357265 /nfs/dbraw/zinc/35/72/65/201357265.db2.gz QFHLOLNJPKLXKY-HOTGVXAUSA-N 1 1 231.383 3.839 20 0 BHADMO CCC[N@@H+](C)[C@@H]1CC[C@@](C)(c2ccccc2)C1 ZINC000437583743 201356425 /nfs/dbraw/zinc/35/64/25/201356425.db2.gz QFHLOLNJPKLXKY-HZPDHXFCSA-N 1 1 231.383 3.839 20 0 BHADMO CCC[N@@H+](C)[C@H]1CC[C@@](C)(c2ccccc2)C1 ZINC000437583745 201356980 /nfs/dbraw/zinc/35/69/80/201356980.db2.gz QFHLOLNJPKLXKY-JKSUJKDBSA-N 1 1 231.383 3.839 20 0 BHADMO CC[N@@H+](CCCCCOc1ccccc1)C1CC1 ZINC000437583769 201357560 /nfs/dbraw/zinc/35/75/60/201357560.db2.gz QJQDKVUMQURPDB-UHFFFAOYSA-N 1 1 247.382 3.720 20 0 BHADMO CC(C)[N@@H+](Cc1ccc(Cl)cc1F)C1CC1 ZINC000437584317 201359492 /nfs/dbraw/zinc/35/94/92/201359492.db2.gz VPUZBRAXLSYKLW-UHFFFAOYSA-N 1 1 241.737 3.852 20 0 BHADMO C[C@H](C[N@@H+](C)C1CCCC1)c1ccc(F)cc1 ZINC000437584526 201358902 /nfs/dbraw/zinc/35/89/02/201358902.db2.gz WUOSDYDGFGWJEJ-GFCCVEGCSA-N 1 1 235.346 3.804 20 0 BHADMO C[C@@H](C[N@@H+](C)C1CCCC1)c1ccc(F)cc1 ZINC000437584527 201361065 /nfs/dbraw/zinc/36/10/65/201361065.db2.gz WUOSDYDGFGWJEJ-LBPRGKRZSA-N 1 1 235.346 3.804 20 0 BHADMO C[C@H](C[N@H+]1CCCC[C@H]1C)c1ccc(F)cc1 ZINC000437585590 201359729 /nfs/dbraw/zinc/35/97/29/201359729.db2.gz BLNUQHKFRZBHQS-CHWSQXEVSA-N 1 1 235.346 3.804 20 0 BHADMO C[C@H](C[N@H+]1CCCC[C@@H]1C)c1ccc(F)cc1 ZINC000437585591 201361094 /nfs/dbraw/zinc/36/10/94/201361094.db2.gz BLNUQHKFRZBHQS-OLZOCXBDSA-N 1 1 235.346 3.804 20 0 BHADMO C[C@@H](C[N@H+]1CCCC[C@H]1C)c1ccc(F)cc1 ZINC000437585594 201360656 /nfs/dbraw/zinc/36/06/56/201360656.db2.gz BLNUQHKFRZBHQS-QWHCGFSZSA-N 1 1 235.346 3.804 20 0 BHADMO C[C@@H](C[N@H+]1CCCC[C@@H]1C)c1ccc(F)cc1 ZINC000437585598 201361008 /nfs/dbraw/zinc/36/10/08/201361008.db2.gz BLNUQHKFRZBHQS-STQMWFEESA-N 1 1 235.346 3.804 20 0 BHADMO CC(C)C[N@@H+](C)CCCCCOc1ccccc1 ZINC000437587008 201359442 /nfs/dbraw/zinc/35/94/42/201359442.db2.gz FFGRYKWAQJONFM-UHFFFAOYSA-N 1 1 249.398 3.824 20 0 BHADMO C[C@H](C[N@@H+](C)[C@@H](C)C1CC1)c1ccc(F)cc1 ZINC000437587405 201359406 /nfs/dbraw/zinc/35/94/06/201359406.db2.gz FRLUOFXZWHKTHH-NEPJUHHUSA-N 1 1 235.346 3.660 20 0 BHADMO C[C@@H](C[N@@H+](C)[C@H](C)C1CC1)c1ccc(F)cc1 ZINC000437587406 201355381 /nfs/dbraw/zinc/35/53/81/201355381.db2.gz FRLUOFXZWHKTHH-NWDGAFQWSA-N 1 1 235.346 3.660 20 0 BHADMO C[N@@H+](Cc1cc2c(cccc2F)[nH]1)C1CCCC1 ZINC000437587407 201359909 /nfs/dbraw/zinc/35/99/09/201359909.db2.gz GEKQZYWIUKDHOF-UHFFFAOYSA-N 1 1 246.329 3.681 20 0 BHADMO C[C@@H](C[N@@H+](C)[C@@H](C)C1CC1)c1ccc(F)cc1 ZINC000437587408 201355476 /nfs/dbraw/zinc/35/54/76/201355476.db2.gz FRLUOFXZWHKTHH-RYUDHWBXSA-N 1 1 235.346 3.660 20 0 BHADMO C[C@H](C1CC1)[N@H+](C)C[C@@H](C)c1ccc(F)cc1 ZINC000437587409 201358258 /nfs/dbraw/zinc/35/82/58/201358258.db2.gz FRLUOFXZWHKTHH-VXGBXAGGSA-N 1 1 235.346 3.660 20 0 BHADMO CC(C)[N@@H+](C)[C@@H]1CC[C@](C)(c2ccccc2)C1 ZINC000437588984 201360886 /nfs/dbraw/zinc/36/08/86/201360886.db2.gz KLCZEYMXPKDUGA-CVEARBPZSA-N 1 1 231.383 3.837 20 0 BHADMO CC(C)[N@@H+](C)[C@H]1CC[C@](C)(c2ccccc2)C1 ZINC000437588985 201359312 /nfs/dbraw/zinc/35/93/12/201359312.db2.gz KLCZEYMXPKDUGA-HOTGVXAUSA-N 1 1 231.383 3.837 20 0 BHADMO CC(C)[N@@H+](C)[C@@H]1CC[C@@](C)(c2ccccc2)C1 ZINC000437588986 201359598 /nfs/dbraw/zinc/35/95/98/201359598.db2.gz KLCZEYMXPKDUGA-HZPDHXFCSA-N 1 1 231.383 3.837 20 0 BHADMO CC(C)[N@@H+](C)[C@H]1CC[C@@](C)(c2ccccc2)C1 ZINC000437588987 201359842 /nfs/dbraw/zinc/35/98/42/201359842.db2.gz KLCZEYMXPKDUGA-JKSUJKDBSA-N 1 1 231.383 3.837 20 0 BHADMO C[C@@H](C1CC1)[N@@H+](C)Cc1cc2c(cccc2F)[nH]1 ZINC000437589141 201359584 /nfs/dbraw/zinc/35/95/84/201359584.db2.gz JLWSEXMDTYDBNG-JTQLQIEISA-N 1 1 246.329 3.537 20 0 BHADMO C[C@H](C1CC1)[N@@H+](C)Cc1cc2c(cccc2F)[nH]1 ZINC000437589144 201358991 /nfs/dbraw/zinc/35/89/91/201358991.db2.gz JLWSEXMDTYDBNG-SNVBAGLBSA-N 1 1 246.329 3.537 20 0 BHADMO CC[N@@H+](Cc1ccc(Cl)cc1F)C(C)C ZINC000437589168 201360828 /nfs/dbraw/zinc/36/08/28/201360828.db2.gz JOOSZUZHBJUWHX-UHFFFAOYSA-N 1 1 229.726 3.709 20 0 BHADMO C[C@H](C1CC1)[N@@H+](C)Cc1ccc(Cl)cc1F ZINC000437590337 201359239 /nfs/dbraw/zinc/35/92/39/201359239.db2.gz MASOGSHHODIXLA-SECBINFHSA-N 1 1 241.737 3.709 20 0 BHADMO C[C@@H](C1CC1)[N@@H+](C)Cc1ccc(Cl)cc1F ZINC000437590339 201361270 /nfs/dbraw/zinc/36/12/70/201361270.db2.gz MASOGSHHODIXLA-VIFPVBQESA-N 1 1 241.737 3.709 20 0 BHADMO CCCC[N@@H+](CC)Cc1cc2c(cccc2F)[nH]1 ZINC000437590375 201360317 /nfs/dbraw/zinc/36/03/17/201360317.db2.gz MQFLNJHKNUOYHR-UHFFFAOYSA-N 1 1 248.345 3.929 20 0 BHADMO C[N@@H+](Cc1cc2c(cccc2F)[nH]1)CC(C)(C)C ZINC000437590396 201360423 /nfs/dbraw/zinc/36/04/23/201360423.db2.gz GZYGQOVWTYMNAQ-UHFFFAOYSA-N 1 1 248.345 3.785 20 0 BHADMO C[C@@H]1CCC[N@@H+](Cc2cc3c(cccc3F)[nH]2)C1 ZINC000437590993 201360213 /nfs/dbraw/zinc/36/02/13/201360213.db2.gz IJXPUAMIAYZLQN-LLVKDONJSA-N 1 1 246.329 3.539 20 0 BHADMO C[C@H]1CCC[N@@H+](Cc2cc3c(cccc3F)[nH]2)C1 ZINC000437590994 201360002 /nfs/dbraw/zinc/36/00/02/201360002.db2.gz IJXPUAMIAYZLQN-NSHDSACASA-N 1 1 246.329 3.539 20 0 BHADMO CC[C@@H](C)C[N@@H+](C)Cc1cc2c(cccc2F)[nH]1 ZINC000437591018 201360311 /nfs/dbraw/zinc/36/03/11/201360311.db2.gz NVXUSQCNVCEIFJ-LLVKDONJSA-N 1 1 248.345 3.785 20 0 BHADMO CC[C@H](C)C[N@@H+](C)Cc1cc2c(cccc2F)[nH]1 ZINC000437591019 201361370 /nfs/dbraw/zinc/36/13/70/201361370.db2.gz NVXUSQCNVCEIFJ-NSHDSACASA-N 1 1 248.345 3.785 20 0 BHADMO C[N@@H+](CC1CC1)[C@H]1CC[C@@](C)(c2ccccc2)C1 ZINC000437591291 201360111 /nfs/dbraw/zinc/36/01/11/201360111.db2.gz OMADTXPECMHUQZ-DLBZAZTESA-N 1 1 243.394 3.839 20 0 BHADMO C[N@@H+](CC1CC1)[C@@H]1CC[C@@](C)(c2ccccc2)C1 ZINC000437591292 201361295 /nfs/dbraw/zinc/36/12/95/201361295.db2.gz OMADTXPECMHUQZ-IAGOWNOFSA-N 1 1 243.394 3.839 20 0 BHADMO C[N@@H+](CC1CC1)[C@H]1CC[C@](C)(c2ccccc2)C1 ZINC000437591293 201360613 /nfs/dbraw/zinc/36/06/13/201360613.db2.gz OMADTXPECMHUQZ-IRXDYDNUSA-N 1 1 243.394 3.839 20 0 BHADMO C[N@@H+](CC1CC1)[C@@H]1CC[C@](C)(c2ccccc2)C1 ZINC000437591294 201359925 /nfs/dbraw/zinc/35/99/25/201359925.db2.gz OMADTXPECMHUQZ-SJORKVTESA-N 1 1 243.394 3.839 20 0 BHADMO C[C@H](C[N@H+]1CCC[C@@H](C)C1)c1ccc(F)cc1 ZINC000437592430 201361425 /nfs/dbraw/zinc/36/14/25/201361425.db2.gz LPNSHSDCSHFBRE-CHWSQXEVSA-N 1 1 235.346 3.661 20 0 BHADMO C[C@@H](C[N@H+]1CCC[C@@H](C)C1)c1ccc(F)cc1 ZINC000437592432 201360259 /nfs/dbraw/zinc/36/02/59/201360259.db2.gz LPNSHSDCSHFBRE-OLZOCXBDSA-N 1 1 235.346 3.661 20 0 BHADMO C[C@H](C[N@H+]1CCC[C@H](C)C1)c1ccc(F)cc1 ZINC000437592435 201359705 /nfs/dbraw/zinc/35/97/05/201359705.db2.gz LPNSHSDCSHFBRE-QWHCGFSZSA-N 1 1 235.346 3.661 20 0 BHADMO C[C@@H](C[N@H+]1CCC[C@H](C)C1)c1ccc(F)cc1 ZINC000437592438 201360532 /nfs/dbraw/zinc/36/05/32/201360532.db2.gz LPNSHSDCSHFBRE-STQMWFEESA-N 1 1 235.346 3.661 20 0 BHADMO CC[N@@H+](CCCCCOc1ccccc1)C(C)C ZINC000437592509 201360101 /nfs/dbraw/zinc/36/01/01/201360101.db2.gz REOBUSUAAPEMIZ-UHFFFAOYSA-N 1 1 249.398 3.966 20 0 BHADMO CCC[N@@H+](C[C@@H](C)c1ccc(F)cc1)C1CC1 ZINC000437593476 201358923 /nfs/dbraw/zinc/35/89/23/201358923.db2.gz NXIUPUYTKYYZCR-GFCCVEGCSA-N 1 1 235.346 3.804 20 0 BHADMO CCC[N@@H+](C[C@H](C)c1ccc(F)cc1)C1CC1 ZINC000437593478 201361144 /nfs/dbraw/zinc/36/11/44/201361144.db2.gz NXIUPUYTKYYZCR-LBPRGKRZSA-N 1 1 235.346 3.804 20 0 BHADMO CC[N@@H+](Cc1cc2c(cccc2F)[nH]1)C(C)C ZINC000437593891 201360672 /nfs/dbraw/zinc/36/06/72/201360672.db2.gz VBXWUZVQYIUDSN-UHFFFAOYSA-N 1 1 234.318 3.537 20 0 BHADMO CCC[N@@H+](Cc1ccc(Cl)cc1F)C1CC1 ZINC000437594025 201356884 /nfs/dbraw/zinc/35/68/84/201356884.db2.gz PCMDRVNEJAOBQO-UHFFFAOYSA-N 1 1 241.737 3.854 20 0 BHADMO C[N@H+](Cc1cc2c(cccc2F)[nH]1)CC1CCC1 ZINC000437594542 201358918 /nfs/dbraw/zinc/35/89/18/201358918.db2.gz QLHIOJPSEVKURI-UHFFFAOYSA-N 1 1 246.329 3.539 20 0 BHADMO CC(C)C[N@@H+](C)C[C@@H](C)c1ccc(F)cc1 ZINC000437594842 201361264 /nfs/dbraw/zinc/36/12/64/201361264.db2.gz XCJDJZIUEBWMPO-GFCCVEGCSA-N 1 1 223.335 3.517 20 0 BHADMO CC(C)C[N@@H+](C)C[C@H](C)c1ccc(F)cc1 ZINC000437594843 201360555 /nfs/dbraw/zinc/36/05/55/201360555.db2.gz XCJDJZIUEBWMPO-LBPRGKRZSA-N 1 1 223.335 3.517 20 0 BHADMO Cc1ccc2cc(C[N@H+](C)CC(C)C)ccc2n1 ZINC000437595659 201361229 /nfs/dbraw/zinc/36/12/29/201361229.db2.gz ZHDFDDKIMOZVAV-UHFFFAOYSA-N 1 1 242.366 3.631 20 0 BHADMO C[C@@H]1CCCC[N@H+]1Cc1cc2c(cccc2F)[nH]1 ZINC000437595688 201360990 /nfs/dbraw/zinc/36/09/90/201360990.db2.gz ZBSTWFYWLYTPGO-LLVKDONJSA-N 1 1 246.329 3.681 20 0 BHADMO C[C@H]1CCCC[N@H+]1Cc1cc2c(cccc2F)[nH]1 ZINC000437595689 201361315 /nfs/dbraw/zinc/36/13/15/201361315.db2.gz ZBSTWFYWLYTPGO-NSHDSACASA-N 1 1 246.329 3.681 20 0 BHADMO C[N@H+](Cc1ccc(Cl)cc1F)CC1CCC1 ZINC000437596471 201360914 /nfs/dbraw/zinc/36/09/14/201360914.db2.gz YILQNKKJZPUKDI-UHFFFAOYSA-N 1 1 241.737 3.711 20 0 BHADMO CC[N@@H+](C[C@@H](C)c1ccc(F)cc1)C(C)C ZINC000437596500 201360636 /nfs/dbraw/zinc/36/06/36/201360636.db2.gz YPOQLSPCDAPTLK-GFCCVEGCSA-N 1 1 223.335 3.660 20 0 BHADMO CC[N@@H+](C[C@H](C)c1ccc(F)cc1)C(C)C ZINC000437596501 201361306 /nfs/dbraw/zinc/36/13/06/201361306.db2.gz YPOQLSPCDAPTLK-LBPRGKRZSA-N 1 1 223.335 3.660 20 0 BHADMO C[C@H](C[N@@H+](C)CC1CCC1)c1ccc(F)cc1 ZINC000437596573 201359228 /nfs/dbraw/zinc/35/92/28/201359228.db2.gz ZKWGYLHELUBKJC-GFCCVEGCSA-N 1 1 235.346 3.661 20 0 BHADMO C[C@@H](C[N@@H+](C)CC1CCC1)c1ccc(F)cc1 ZINC000437596574 201358913 /nfs/dbraw/zinc/35/89/13/201358913.db2.gz ZKWGYLHELUBKJC-LBPRGKRZSA-N 1 1 235.346 3.661 20 0 BHADMO CCC[N@@H+](Cc1cc2c(cccc2F)[nH]1)C1CC1 ZINC000437596612 201359964 /nfs/dbraw/zinc/35/99/64/201359964.db2.gz ZUKJHLMNVBMQKM-UHFFFAOYSA-N 1 1 246.329 3.681 20 0 BHADMO C[C@H](C[N@@H+](C)Cc1ccoc1)c1ccc(F)cc1 ZINC000437684300 201366489 /nfs/dbraw/zinc/36/64/89/201366489.db2.gz FPVYWSFSDNNFJF-GFCCVEGCSA-N 1 1 247.313 3.654 20 0 BHADMO C[C@@H](C[N@@H+](C)Cc1ccoc1)c1ccc(F)cc1 ZINC000437684301 201366195 /nfs/dbraw/zinc/36/61/95/201366195.db2.gz FPVYWSFSDNNFJF-LBPRGKRZSA-N 1 1 247.313 3.654 20 0 BHADMO C[C@H]1CC[N@@H+](CCCCCOc2ccccc2)C1 ZINC000437684987 201367957 /nfs/dbraw/zinc/36/79/57/201367957.db2.gz DTWCKRIKLWPIFS-HNNXBMFYSA-N 1 1 247.382 3.578 20 0 BHADMO C[C@@H]1CC[N@@H+](CCCCCOc2ccccc2)C1 ZINC000437684988 201367383 /nfs/dbraw/zinc/36/73/83/201367383.db2.gz DTWCKRIKLWPIFS-OAHLLOKOSA-N 1 1 247.382 3.578 20 0 BHADMO CC[C@@H]1CCC[N@H+]1Cc1cc2c(cccc2F)[nH]1 ZINC000437686462 201368157 /nfs/dbraw/zinc/36/81/57/201368157.db2.gz MDAINHKRJAMTBB-GFCCVEGCSA-N 1 1 246.329 3.681 20 0 BHADMO CC[C@H]1CCC[N@H+]1Cc1cc2c(cccc2F)[nH]1 ZINC000437686465 201368341 /nfs/dbraw/zinc/36/83/41/201368341.db2.gz MDAINHKRJAMTBB-LBPRGKRZSA-N 1 1 246.329 3.681 20 0 BHADMO C[C@@H]1CC[N@H+]([C@@H]2CC[C@@](C)(c3ccccc3)C2)C1 ZINC000437690962 201367808 /nfs/dbraw/zinc/36/78/08/201367808.db2.gz XFIGCVVXBXSRAH-DJIMGWMZSA-N 1 1 243.394 3.839 20 0 BHADMO C[C@@H]1CC[N@H+]([C@H]2CC[C@@](C)(c3ccccc3)C2)C1 ZINC000437690963 201368522 /nfs/dbraw/zinc/36/85/22/201368522.db2.gz XFIGCVVXBXSRAH-HYVNUMGLSA-N 1 1 243.394 3.839 20 0 BHADMO C[C@@H]1CC[N@H+]([C@@H]2CC[C@](C)(c3ccccc3)C2)C1 ZINC000437690964 201368573 /nfs/dbraw/zinc/36/85/73/201368573.db2.gz XFIGCVVXBXSRAH-OIISXLGYSA-N 1 1 243.394 3.839 20 0 BHADMO C[C@@H]1CC[N@H+]([C@H]2CC[C@](C)(c3ccccc3)C2)C1 ZINC000437690965 201368626 /nfs/dbraw/zinc/36/86/26/201368626.db2.gz XFIGCVVXBXSRAH-PVAVHDDUSA-N 1 1 243.394 3.839 20 0 BHADMO CC[C@H]1CCC[N@H+]1C[C@@H](C)c1ccc(F)cc1 ZINC000437694709 201368904 /nfs/dbraw/zinc/36/89/04/201368904.db2.gz URUINOLAKSVNNO-DOMZBBRYSA-N 1 1 235.346 3.804 20 0 BHADMO CC[C@@H]1CCC[N@H+]1C[C@@H](C)c1ccc(F)cc1 ZINC000437694710 201370392 /nfs/dbraw/zinc/37/03/92/201370392.db2.gz URUINOLAKSVNNO-IUODEOHRSA-N 1 1 235.346 3.804 20 0 BHADMO CC[C@@H]1CCC[N@H+]1C[C@H](C)c1ccc(F)cc1 ZINC000437694715 201370008 /nfs/dbraw/zinc/37/00/08/201370008.db2.gz 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1 1 246.329 3.539 20 0 BHADMO C[C@H](C[N@H+]1CC[C@@H]2CCC[C@@H]21)c1ccc(F)cc1 ZINC000437965427 201380422 /nfs/dbraw/zinc/38/04/22/201380422.db2.gz SVYUWABGLNXLTC-INWMFGNUSA-N 1 1 247.357 3.804 20 0 BHADMO C[C@H](C[N@H+]1CC[C@@H]2CCC[C@H]21)c1ccc(F)cc1 ZINC000437965429 201379713 /nfs/dbraw/zinc/37/97/13/201379713.db2.gz SVYUWABGLNXLTC-IVMMDQJWSA-N 1 1 247.357 3.804 20 0 BHADMO C[C@H](C[N@H+]1CC[C@H]2CCC[C@H]21)c1ccc(F)cc1 ZINC000437965431 201381465 /nfs/dbraw/zinc/38/14/65/201381465.db2.gz SVYUWABGLNXLTC-XNRPHZJLSA-N 1 1 247.357 3.804 20 0 BHADMO C[C@H](C[N@H+]1CC[C@H]2CCC[C@@H]21)c1ccc(F)cc1 ZINC000437965432 201381576 /nfs/dbraw/zinc/38/15/76/201381576.db2.gz SVYUWABGLNXLTC-XPKDYRNWSA-N 1 1 247.357 3.804 20 0 BHADMO CC[N@@H+](C[C@@H](C)c1ccc(F)cc1)CC1CC1 ZINC000437965966 201381502 /nfs/dbraw/zinc/38/15/02/201381502.db2.gz VBEXLMNLGIMCBR-GFCCVEGCSA-N 1 1 235.346 3.661 20 0 BHADMO CC[N@@H+](C[C@H](C)c1ccc(F)cc1)CC1CC1 ZINC000437965968 201380194 /nfs/dbraw/zinc/38/01/94/201380194.db2.gz 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GNNGJWRSMOJBAR-GFCCVEGCSA-N 1 1 244.313 3.745 20 0 BHADMO Cc1ccc[nH+]c1NC[C@H](C)c1ccc(F)cc1 ZINC000438087662 201388382 /nfs/dbraw/zinc/38/83/82/201388382.db2.gz GNNGJWRSMOJBAR-LBPRGKRZSA-N 1 1 244.313 3.745 20 0 BHADMO CCC(CC)n1ccc(C[N@@H+](CC)C2CCC2)n1 ZINC000438088433 201388075 /nfs/dbraw/zinc/38/80/75/201388075.db2.gz JVMXNMQPAUXCKW-UHFFFAOYSA-N 1 1 249.402 3.619 20 0 BHADMO CC(C)[C@@H]1CC[N@H+]1Cc1cc2c(cccc2F)[nH]1 ZINC000438089634 201388850 /nfs/dbraw/zinc/38/88/50/201388850.db2.gz QTXXJRPFTGOKGG-HNNXBMFYSA-N 1 1 246.329 3.537 20 0 BHADMO CC(C)[C@H]1CC[N@H+]1Cc1cc2c(cccc2F)[nH]1 ZINC000438089635 201387345 /nfs/dbraw/zinc/38/73/45/201387345.db2.gz QTXXJRPFTGOKGG-OAHLLOKOSA-N 1 1 246.329 3.537 20 0 BHADMO CC1(C)CC[N@@H+](Cc2cc3c(cccc3F)[nH]2)C1 ZINC000438090302 386442944 /nfs/dbraw/zinc/44/29/44/386442944.db2.gz AAQFDPCOFYDRHR-UHFFFAOYSA-N 1 1 246.329 3.539 20 0 BHADMO C[C@H](C[N@H+]1CCC(C)(C)C1)c1ccc(F)cc1 ZINC000438090331 201387430 /nfs/dbraw/zinc/38/74/30/201387430.db2.gz AJMWZXBRQGHXID-GFCCVEGCSA-N 1 1 235.346 3.661 20 0 BHADMO C[C@@H](C[N@H+]1CCC(C)(C)C1)c1ccc(F)cc1 ZINC000438090332 201387258 /nfs/dbraw/zinc/38/72/58/201387258.db2.gz AJMWZXBRQGHXID-LBPRGKRZSA-N 1 1 235.346 3.661 20 0 BHADMO CC(C)[C@@H]1CC[N@H+]1CCCCOc1ccccc1 ZINC000438090737 201387198 /nfs/dbraw/zinc/38/71/98/201387198.db2.gz VSYUXCAAURTTMY-INIZCTEOSA-N 1 1 247.382 3.576 20 0 BHADMO CC(C)[C@H]1CC[N@H+]1CCCCOc1ccccc1 ZINC000438090738 201386860 /nfs/dbraw/zinc/38/68/60/201386860.db2.gz VSYUXCAAURTTMY-MRXNPFEDSA-N 1 1 247.382 3.576 20 0 BHADMO CC(C)[C@@H]1CC[N@H+]1C[C@@H](C)c1ccc(F)cc1 ZINC000438090888 201388053 /nfs/dbraw/zinc/38/80/53/201388053.db2.gz WNGQZDGPQPQFEK-DOMZBBRYSA-N 1 1 235.346 3.660 20 0 BHADMO CC(C)[C@H]1CC[N@H+]1C[C@@H](C)c1ccc(F)cc1 ZINC000438090934 201386834 /nfs/dbraw/zinc/38/68/34/201386834.db2.gz WNGQZDGPQPQFEK-IUODEOHRSA-N 1 1 235.346 3.660 20 0 BHADMO CC(C)[C@H]1CC[N@H+]1C[C@H](C)c1ccc(F)cc1 ZINC000438090935 201388747 /nfs/dbraw/zinc/38/87/47/201388747.db2.gz WNGQZDGPQPQFEK-SWLSCSKDSA-N 1 1 235.346 3.660 20 0 BHADMO CC(C)[C@@H]1CC[N@H+]1C[C@H](C)c1ccc(F)cc1 ZINC000438090936 201388517 /nfs/dbraw/zinc/38/85/17/201388517.db2.gz WNGQZDGPQPQFEK-WFASDCNBSA-N 1 1 235.346 3.660 20 0 BHADMO CC[N@@H+](Cc1cc2c(cccc2F)[nH]1)C1CCC1 ZINC000438092335 201386752 /nfs/dbraw/zinc/38/67/52/201386752.db2.gz AGTCTIWFKBYASZ-UHFFFAOYSA-N 1 1 246.329 3.681 20 0 BHADMO C[C@H](C[N@H+]1CCC2(CCC2)C1)c1ccc(F)cc1 ZINC000438092904 201387020 /nfs/dbraw/zinc/38/70/20/201387020.db2.gz BUTATBKBTZKMAG-CYBMUJFWSA-N 1 1 247.357 3.805 20 0 BHADMO C[C@@H](C[N@H+]1CCC2(CCC2)C1)c1ccc(F)cc1 ZINC000438092905 201388827 /nfs/dbraw/zinc/38/88/27/201388827.db2.gz BUTATBKBTZKMAG-ZDUSSCGKSA-N 1 1 247.357 3.805 20 0 BHADMO C[C@@H]1CC[C@H](C)[N@@H+]1Cc1cc2c(cccc2F)[nH]1 ZINC000438094112 201388980 /nfs/dbraw/zinc/38/89/80/201388980.db2.gz DUWZCQXNJGEYTI-PHIMTYICSA-N 1 1 246.329 3.680 20 0 BHADMO Fc1cc(Cl)ccc1C[N@H+]1CCC12CCC2 ZINC000438096175 201387381 /nfs/dbraw/zinc/38/73/81/201387381.db2.gz 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/nfs/dbraw/zinc/38/84/60/201388460.db2.gz SGNOZISMXVJSCY-IRXDYDNUSA-N 1 1 243.394 3.981 20 0 BHADMO C[N@@H+](C1CCC1)[C@@H]1CC[C@](C)(c2ccccc2)C1 ZINC000438098328 201388098 /nfs/dbraw/zinc/38/80/98/201388098.db2.gz SGNOZISMXVJSCY-SJORKVTESA-N 1 1 243.394 3.981 20 0 BHADMO C[C@H](C[N@H+]1CC[C@H](C2CC2)C1)c1ccc(F)cc1 ZINC000438099769 201389365 /nfs/dbraw/zinc/38/93/65/201389365.db2.gz WPNCOHMECRQEED-DOMZBBRYSA-N 1 1 247.357 3.661 20 0 BHADMO C[C@H](C[N@H+]1CC[C@@H](C2CC2)C1)c1ccc(F)cc1 ZINC000438099770 201390426 /nfs/dbraw/zinc/39/04/26/201390426.db2.gz WPNCOHMECRQEED-IUODEOHRSA-N 1 1 247.357 3.661 20 0 BHADMO C[C@@H](C[N@H+]1CC[C@@H](C2CC2)C1)c1ccc(F)cc1 ZINC000438099771 386456540 /nfs/dbraw/zinc/45/65/40/386456540.db2.gz WPNCOHMECRQEED-SWLSCSKDSA-N 1 1 247.357 3.661 20 0 BHADMO C[C@@H](C[N@H+]1CC[C@H](C2CC2)C1)c1ccc(F)cc1 ZINC000438099772 386456622 /nfs/dbraw/zinc/45/66/22/386456622.db2.gz WPNCOHMECRQEED-WFASDCNBSA-N 1 1 247.357 3.661 20 0 BHADMO C[C@H](C[N@H+]1CCC12CCC2)c1ccc(F)cc1 ZINC000438101697 201389890 /nfs/dbraw/zinc/38/98/90/201389890.db2.gz PENAUNUVTSIESH-GFCCVEGCSA-N 1 1 233.330 3.558 20 0 BHADMO C[C@@H](C[N@H+]1CCC12CCC2)c1ccc(F)cc1 ZINC000438101699 201391361 /nfs/dbraw/zinc/39/13/61/201391361.db2.gz PENAUNUVTSIESH-LBPRGKRZSA-N 1 1 233.330 3.558 20 0 BHADMO C[C@@H](C[N@H+]1C[C@H](C)C[C@@H]1C)c1ccc(F)cc1 ZINC000438102196 201386799 /nfs/dbraw/zinc/38/67/99/201386799.db2.gz HQUQISPVBFXZRN-AGIUHOORSA-N 1 1 235.346 3.660 20 0 BHADMO C[C@@H](C[N@H+]1C[C@H](C)C[C@H]1C)c1ccc(F)cc1 ZINC000438102197 201388918 /nfs/dbraw/zinc/38/89/18/201388918.db2.gz HQUQISPVBFXZRN-FRRDWIJNSA-N 1 1 235.346 3.660 20 0 BHADMO C[C@H](C[N@H+]1C[C@H](C)C[C@H]1C)c1ccc(F)cc1 ZINC000438102198 201388807 /nfs/dbraw/zinc/38/88/07/201388807.db2.gz HQUQISPVBFXZRN-JHJVBQTASA-N 1 1 235.346 3.660 20 0 BHADMO C[C@H](C[N@H+]1C[C@H](C)C[C@@H]1C)c1ccc(F)cc1 ZINC000438102199 201386759 /nfs/dbraw/zinc/38/67/59/201386759.db2.gz HQUQISPVBFXZRN-UPJWGTAASA-N 1 1 235.346 3.660 20 0 BHADMO 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/nfs/dbraw/zinc/99/44/55/387994455.db2.gz YKXQUZXBSFGPPP-ZFWWWQNUSA-N 1 1 249.423 3.618 20 0 BHADMO C[C@H]1C[C@H](c2ccccc2)CC[N@H+]1CCCF ZINC000439330777 387995055 /nfs/dbraw/zinc/99/50/55/387995055.db2.gz WZOPQKONAWWXAG-DZGCQCFKSA-N 1 1 235.346 3.614 20 0 BHADMO C[C@@H]1C[C@@H](c2ccccc2)CC[N@H+]1CCCF ZINC000439330778 387994826 /nfs/dbraw/zinc/99/48/26/387994826.db2.gz WZOPQKONAWWXAG-HIFRSBDPSA-N 1 1 235.346 3.614 20 0 BHADMO C[C@@H]1C[C@H](c2ccccc2)CC[N@H+]1CCCF ZINC000439330779 387994462 /nfs/dbraw/zinc/99/44/62/387994462.db2.gz WZOPQKONAWWXAG-UKRRQHHQSA-N 1 1 235.346 3.614 20 0 BHADMO C[C@H]1C[C@@H](c2ccccc2)CC[N@H+]1CCCF ZINC000439330780 387993714 /nfs/dbraw/zinc/99/37/14/387993714.db2.gz WZOPQKONAWWXAG-ZFWWWQNUSA-N 1 1 235.346 3.614 20 0 BHADMO CC[C@H]1C[N@H+]([C@H](C)c2ccccc2C)CCCO1 ZINC000439474662 388001805 /nfs/dbraw/zinc/00/18/05/388001805.db2.gz NNJCTNUUCZRIHM-CABCVRRESA-N 1 1 247.382 3.557 20 0 BHADMO CC[C@H]1C[N@H+]([C@@H](C)c2ccccc2C)CCCO1 ZINC000439474664 388003063 /nfs/dbraw/zinc/00/30/63/388003063.db2.gz NNJCTNUUCZRIHM-GJZGRUSLSA-N 1 1 247.382 3.557 20 0 BHADMO CC[C@@H]1C[N@H+]([C@H](C)c2ccccc2C)CCCO1 ZINC000439474665 388001747 /nfs/dbraw/zinc/00/17/47/388001747.db2.gz NNJCTNUUCZRIHM-HUUCEWRRSA-N 1 1 247.382 3.557 20 0 BHADMO CC[C@@H]1C[N@H+]([C@@H](C)c2ccccc2C)CCCO1 ZINC000439474667 201448219 /nfs/dbraw/zinc/44/82/19/201448219.db2.gz NNJCTNUUCZRIHM-LSDHHAIUSA-N 1 1 247.382 3.557 20 0 BHADMO CSCCC[N@@H+](C)[C@H](C)c1cccc(C)c1 ZINC000439475744 388002360 /nfs/dbraw/zinc/00/23/60/388002360.db2.gz FRYZYLHOLUDESD-CYBMUJFWSA-N 1 1 237.412 3.741 20 0 BHADMO CSCCC[N@@H+](C)[C@@H](C)c1cccc(C)c1 ZINC000439475745 388002415 /nfs/dbraw/zinc/00/24/15/388002415.db2.gz FRYZYLHOLUDESD-ZDUSSCGKSA-N 1 1 237.412 3.741 20 0 BHADMO CC[C@@H]1C[N@H+]([C@H](C)c2cccc(C)c2)CCCO1 ZINC000439480511 388002119 /nfs/dbraw/zinc/00/21/19/388002119.db2.gz DLHSSIWLLLCIRF-GDBMZVCRSA-N 1 1 247.382 3.557 20 0 BHADMO CC[C@@H]1C[N@H+]([C@@H](C)c2cccc(C)c2)CCCO1 ZINC000439480512 388002048 /nfs/dbraw/zinc/00/20/48/388002048.db2.gz DLHSSIWLLLCIRF-GOEBONIOSA-N 1 1 247.382 3.557 20 0 BHADMO CC[C@H]1C[N@H+]([C@@H](C)c2cccc(C)c2)CCCO1 ZINC000439480513 388002702 /nfs/dbraw/zinc/00/27/02/388002702.db2.gz DLHSSIWLLLCIRF-HOCLYGCPSA-N 1 1 247.382 3.557 20 0 BHADMO CC[C@H]1C[N@H+]([C@H](C)c2cccc(C)c2)CCCO1 ZINC000439480515 388002312 /nfs/dbraw/zinc/00/23/12/388002312.db2.gz DLHSSIWLLLCIRF-ZBFHGGJFSA-N 1 1 247.382 3.557 20 0 BHADMO CC[C@@H](c1ccccc1)[N@H+]1CCCO[C@H](CC)C1 ZINC000439483320 388003478 /nfs/dbraw/zinc/00/34/78/388003478.db2.gz IGTCSFGAFRFBEL-CVEARBPZSA-N 1 1 247.382 3.639 20 0 BHADMO CC[C@@H](c1ccccc1)[N@H+]1CCCO[C@@H](CC)C1 ZINC000439483321 388002941 /nfs/dbraw/zinc/00/29/41/388002941.db2.gz IGTCSFGAFRFBEL-HOTGVXAUSA-N 1 1 247.382 3.639 20 0 BHADMO CC[C@H](c1ccccc1)[N@H+]1CCCO[C@H](CC)C1 ZINC000439483322 388001797 /nfs/dbraw/zinc/00/17/97/388001797.db2.gz IGTCSFGAFRFBEL-HZPDHXFCSA-N 1 1 247.382 3.639 20 0 BHADMO CC[C@H](c1ccccc1)[N@H+]1CCCO[C@@H](CC)C1 ZINC000439483323 201451840 /nfs/dbraw/zinc/45/18/40/201451840.db2.gz IGTCSFGAFRFBEL-JKSUJKDBSA-N 1 1 247.382 3.639 20 0 BHADMO CSCCC[N@@H+](C)CCCC1CCCC1 ZINC000439485978 388004519 /nfs/dbraw/zinc/00/45/19/388004519.db2.gz VETPBHKEFKYKCQ-UHFFFAOYSA-N 1 1 229.433 3.642 20 0 BHADMO CC[C@H](C)[N@@H+](C)CCCc1ccccc1C ZINC000439953200 388025609 /nfs/dbraw/zinc/02/56/09/388025609.db2.gz WLZVEFBQHIJDFE-AWEZNQCLSA-N 1 1 219.372 3.658 20 0 BHADMO CC[C@@H](C)[N@@H+](C)CCCc1ccccc1C ZINC000439953201 388025921 /nfs/dbraw/zinc/02/59/21/388025921.db2.gz WLZVEFBQHIJDFE-CQSZACIVSA-N 1 1 219.372 3.658 20 0 BHADMO CC[C@@H](C)[N@@H+](C)CCSc1ccc(F)cc1 ZINC000439967085 388027671 /nfs/dbraw/zinc/02/76/71/388027671.db2.gz VVPKDCBJRKKWHQ-LLVKDONJSA-N 1 1 241.375 3.648 20 0 BHADMO CC[C@H](C)[N@@H+](C)CCSc1ccc(F)cc1 ZINC000439967086 388027430 /nfs/dbraw/zinc/02/74/30/388027430.db2.gz VVPKDCBJRKKWHQ-NSHDSACASA-N 1 1 241.375 3.648 20 0 BHADMO Cc1ccccc1CCC[N@H+](C)CC(C)C ZINC000440314607 388038922 /nfs/dbraw/zinc/03/89/22/388038922.db2.gz JKTUVHSQJGJVGT-UHFFFAOYSA-N 1 1 219.372 3.515 20 0 BHADMO Cc1ccccc1CCC[N@H+](C(C)C)C1CC1 ZINC000440316788 388038163 /nfs/dbraw/zinc/03/81/63/388038163.db2.gz PMPHZTBDSFUJNV-UHFFFAOYSA-N 1 1 231.383 3.800 20 0 BHADMO Cc1ccccc1CCC[N@H+](C)CC1CCC1 ZINC000440319691 388038219 /nfs/dbraw/zinc/03/82/19/388038219.db2.gz VIVSLDXBKANUBQ-UHFFFAOYSA-N 1 1 231.383 3.660 20 0 BHADMO Cc1ccccc1CCC[N@H+](C)C1CCCC1 ZINC000440320185 388038815 /nfs/dbraw/zinc/03/88/15/388038815.db2.gz XHWGHQWVAVWIJJ-UHFFFAOYSA-N 1 1 231.383 3.802 20 0 BHADMO Cc1ccccc1CCC[N@H+](C)Cc1ccoc1 ZINC000440321888 388039488 /nfs/dbraw/zinc/03/94/88/388039488.db2.gz BAOCNGOUKFHPSK-UHFFFAOYSA-N 1 1 243.350 3.653 20 0 BHADMO CC[N@@H+](CCCc1ccccc1C)C(C)C ZINC000440323178 388038205 /nfs/dbraw/zinc/03/82/05/388038205.db2.gz DVNNBOLLYKDOMA-UHFFFAOYSA-N 1 1 219.372 3.658 20 0 BHADMO Cc1ccccc1CCC[N@H+]1CCC12CCC2 ZINC000440327555 388038114 /nfs/dbraw/zinc/03/81/14/388038114.db2.gz OTQKIDIAFKFMCG-UHFFFAOYSA-N 1 1 229.367 3.556 20 0 BHADMO Cc1ccccc1CCC[N@H+](C)Cc1ccco1 ZINC000440328461 388038190 /nfs/dbraw/zinc/03/81/90/388038190.db2.gz SPSVYQDGHCBIOL-UHFFFAOYSA-N 1 1 243.350 3.653 20 0 BHADMO CC[N@@H+](CCCc1ccccc1C)C1CCC1 ZINC000440329833 388039224 /nfs/dbraw/zinc/03/92/24/388039224.db2.gz VCGOHWSDZSWKMH-UHFFFAOYSA-N 1 1 231.383 3.802 20 0 BHADMO CC[C@H](F)C[N@@H+](C)Cc1ccc(F)c(Cl)c1 ZINC000440483775 206076423 /nfs/dbraw/zinc/07/64/23/206076423.db2.gz DYQCHLFNIQQQMH-JTQLQIEISA-N 1 1 247.716 3.659 20 0 BHADMO CC[C@H](F)C[N@H+](C)Cc1ccc(F)c(Cl)c1 ZINC000440483775 206076420 /nfs/dbraw/zinc/07/64/20/206076420.db2.gz DYQCHLFNIQQQMH-JTQLQIEISA-N 1 1 247.716 3.659 20 0 BHADMO CC[C@@H](F)C[N@@H+](C)Cc1ccc(F)c(Cl)c1 ZINC000440483778 206077701 /nfs/dbraw/zinc/07/77/01/206077701.db2.gz DYQCHLFNIQQQMH-SNVBAGLBSA-N 1 1 247.716 3.659 20 0 BHADMO CC[C@@H](F)C[N@H+](C)Cc1ccc(F)c(Cl)c1 ZINC000440483778 206077697 /nfs/dbraw/zinc/07/76/97/206077697.db2.gz DYQCHLFNIQQQMH-SNVBAGLBSA-N 1 1 247.716 3.659 20 0 BHADMO CC[C@H](F)C[N@H+]1CC[C@@H](c2cccc(C)c2)C1 ZINC000440485932 206076990 /nfs/dbraw/zinc/07/69/90/206076990.db2.gz KSYQJGNZHTVHEG-CABCVRRESA-N 1 1 235.346 3.532 20 0 BHADMO CC[C@H](F)C[N@H+]1CC[C@H](c2cccc(C)c2)C1 ZINC000440485933 206076638 /nfs/dbraw/zinc/07/66/38/206076638.db2.gz KSYQJGNZHTVHEG-GJZGRUSLSA-N 1 1 235.346 3.532 20 0 BHADMO CC[C@@H](F)C[N@H+]1CC[C@@H](c2cccc(C)c2)C1 ZINC000440485934 206076377 /nfs/dbraw/zinc/07/63/77/206076377.db2.gz KSYQJGNZHTVHEG-HUUCEWRRSA-N 1 1 235.346 3.532 20 0 BHADMO CC[C@@H](F)C[N@H+]1CC[C@H](c2cccc(C)c2)C1 ZINC000440485935 206078657 /nfs/dbraw/zinc/07/86/57/206078657.db2.gz KSYQJGNZHTVHEG-LSDHHAIUSA-N 1 1 235.346 3.532 20 0 BHADMO CC[C@@H](F)C[N@@H+](C)CCc1ccc(Cl)cc1 ZINC000440487454 206077524 /nfs/dbraw/zinc/07/75/24/206077524.db2.gz BOXSOCUIKZBILS-CYBMUJFWSA-N 1 1 243.753 3.562 20 0 BHADMO CC[C@H](F)C[N@@H+](C)CCc1ccc(Cl)cc1 ZINC000440487458 206076935 /nfs/dbraw/zinc/07/69/35/206076935.db2.gz BOXSOCUIKZBILS-ZDUSSCGKSA-N 1 1 243.753 3.562 20 0 BHADMO CC[C@H](F)C[N@H+]1CCC[C@H]1/C=C/c1ccccc1 ZINC000440500446 388045539 /nfs/dbraw/zinc/04/55/39/388045539.db2.gz BENDJYGZRBDMLM-ISEXYEMMSA-N 1 1 247.357 3.912 20 0 BHADMO CC[C@H](F)C[N@H+]1CCC[C@@H]1/C=C\c1ccccc1 ZINC000440500447 388044235 /nfs/dbraw/zinc/04/42/35/388044235.db2.gz BENDJYGZRBDMLM-JVSIQZEQSA-N 1 1 247.357 3.912 20 0 BHADMO CC[C@H](F)C[N@H+]1CCC[C@H]1/C=C\c1ccccc1 ZINC000440500450 386741218 /nfs/dbraw/zinc/74/12/18/386741218.db2.gz BENDJYGZRBDMLM-PTVNLRSFSA-N 1 1 247.357 3.912 20 0 BHADMO CC[C@H](F)C[N@H+]1CCC[C@@H]1/C=C/c1ccccc1 ZINC000440500454 386741110 /nfs/dbraw/zinc/74/11/10/386741110.db2.gz BENDJYGZRBDMLM-ZBYDSPNZSA-N 1 1 247.357 3.912 20 0 BHADMO CC[C@@H](F)C[N@@H+](C)[C@@H](C)Cc1ccccc1C ZINC000440501881 388045330 /nfs/dbraw/zinc/04/53/30/388045330.db2.gz FFIOKJXRAVQVKD-DZGCQCFKSA-N 1 1 237.362 3.606 20 0 BHADMO CC[C@H](F)C[N@@H+](C)[C@H](C)Cc1ccccc1C ZINC000440501882 388045273 /nfs/dbraw/zinc/04/52/73/388045273.db2.gz FFIOKJXRAVQVKD-HIFRSBDPSA-N 1 1 237.362 3.606 20 0 BHADMO CC[C@@H](F)C[N@@H+](C)[C@H](C)Cc1ccccc1C ZINC000440501883 388044875 /nfs/dbraw/zinc/04/48/75/388044875.db2.gz FFIOKJXRAVQVKD-UKRRQHHQSA-N 1 1 237.362 3.606 20 0 BHADMO CC[C@H](F)C[N@@H+](C)[C@@H](C)Cc1ccccc1C ZINC000440501884 388044658 /nfs/dbraw/zinc/04/46/58/388044658.db2.gz FFIOKJXRAVQVKD-ZFWWWQNUSA-N 1 1 237.362 3.606 20 0 BHADMO CCC[N@@H+](CCc1cccs1)C[C@H](F)CC ZINC000440509160 388047946 /nfs/dbraw/zinc/04/79/46/388047946.db2.gz FLCMMXGENVSABB-GFCCVEGCSA-N 1 1 243.391 3.751 20 0 BHADMO CCC[N@@H+](CCc1cccs1)C[C@@H](F)CC ZINC000440509164 201486057 /nfs/dbraw/zinc/48/60/57/201486057.db2.gz FLCMMXGENVSABB-LBPRGKRZSA-N 1 1 243.391 3.751 20 0 BHADMO CC[C@@H](F)C[N@@H+](CC)Cc1c[nH]c2ccccc12 ZINC000440510523 386752081 /nfs/dbraw/zinc/75/20/81/386752081.db2.gz KJFCUTTVMHYTCP-CYBMUJFWSA-N 1 1 248.345 3.738 20 0 BHADMO CC[C@H](F)C[N@@H+](CC)Cc1c[nH]c2ccccc12 ZINC000440510538 386752605 /nfs/dbraw/zinc/75/26/05/386752605.db2.gz KJFCUTTVMHYTCP-ZDUSSCGKSA-N 1 1 248.345 3.738 20 0 BHADMO CC[C@H](F)C[N@@H+](CC)[C@H]1CCCC[C@H]1C ZINC000440516671 388048544 /nfs/dbraw/zinc/04/85/44/388048544.db2.gz OXFROIRYYPRYAP-AGIUHOORSA-N 1 1 215.356 3.635 20 0 BHADMO CC[C@H](F)C[N@@H+](CC)[C@H]1CCCC[C@@H]1C ZINC000440516676 388049757 /nfs/dbraw/zinc/04/97/57/388049757.db2.gz OXFROIRYYPRYAP-AVGNSLFASA-N 1 1 215.356 3.635 20 0 BHADMO CC[C@H](F)C[N@@H+](CC)[C@@H]1CCCC[C@H]1C ZINC000440516677 388049332 /nfs/dbraw/zinc/04/93/32/388049332.db2.gz OXFROIRYYPRYAP-FRRDWIJNSA-N 1 1 215.356 3.635 20 0 BHADMO CC[C@H](F)C[N@@H+](CC)[C@@H]1CCCC[C@@H]1C ZINC000440516679 388047388 /nfs/dbraw/zinc/04/73/88/388047388.db2.gz OXFROIRYYPRYAP-RWMBFGLXSA-N 1 1 215.356 3.635 20 0 BHADMO CC[C@@H](F)C[N@@H+](C)C/C(C)=C/c1ccccc1 ZINC000440517521 388048441 /nfs/dbraw/zinc/04/84/41/388048441.db2.gz IMHDAUUXVNBZDI-NRMKIYEFSA-N 1 1 235.346 3.770 20 0 BHADMO CC[C@H](F)C[N@@H+](C)C/C(C)=C/c1ccccc1 ZINC000440517522 388049098 /nfs/dbraw/zinc/04/90/98/388049098.db2.gz IMHDAUUXVNBZDI-VOMSXAGXSA-N 1 1 235.346 3.770 20 0 BHADMO CC[C@@H](F)C[N@@H+](C)C/C(C)=C\c1ccccc1 ZINC000440517524 388048728 /nfs/dbraw/zinc/04/87/28/388048728.db2.gz IMHDAUUXVNBZDI-VSKPTYQZSA-N 1 1 235.346 3.770 20 0 BHADMO CC[C@H](F)C[N@@H+](C)C/C(C)=C\c1ccccc1 ZINC000440517525 388049723 /nfs/dbraw/zinc/04/97/23/388049723.db2.gz IMHDAUUXVNBZDI-WVUXNXBLSA-N 1 1 235.346 3.770 20 0 BHADMO CC[C@H](F)C[N@@H+](C)[C@@H](C)C1CCCCC1 ZINC000440517977 388050897 /nfs/dbraw/zinc/05/08/97/388050897.db2.gz IWJVOLMWZLMNTK-AAEUAGOBSA-N 1 1 215.356 3.635 20 0 BHADMO CC[C@@H](F)C[N@@H+](C)[C@@H](C)C1CCCCC1 ZINC000440517979 388050826 /nfs/dbraw/zinc/05/08/26/388050826.db2.gz IWJVOLMWZLMNTK-WCQYABFASA-N 1 1 215.356 3.635 20 0 BHADMO CC[C@@H](F)C[N@H+]1CCCC[C@H]1c1ccccc1 ZINC000440519792 537950040 /nfs/dbraw/zinc/95/00/40/537950040.db2.gz USYDHAKLTUAZLJ-CABCVRRESA-N 1 1 235.346 3.962 20 0 BHADMO CC[C@H](F)C[N@H+]1CCCC[C@H]1c1ccccc1 ZINC000440519793 537949605 /nfs/dbraw/zinc/94/96/05/537949605.db2.gz USYDHAKLTUAZLJ-GJZGRUSLSA-N 1 1 235.346 3.962 20 0 BHADMO CC[C@@H](F)C[N@H+]1CCCC[C@@H]1c1ccccc1 ZINC000440519796 537949779 /nfs/dbraw/zinc/94/97/79/537949779.db2.gz USYDHAKLTUAZLJ-HUUCEWRRSA-N 1 1 235.346 3.962 20 0 BHADMO CC[C@H](F)C[N@H+]1CCCC[C@@H]1c1ccccc1 ZINC000440519800 537950106 /nfs/dbraw/zinc/95/01/06/537950106.db2.gz USYDHAKLTUAZLJ-LSDHHAIUSA-N 1 1 235.346 3.962 20 0 BHADMO CC[C@@H](F)C[N@@H+](C)Cc1ccccc1SC ZINC000440524183 397930296 /nfs/dbraw/zinc/93/02/96/397930296.db2.gz JEGQORPTYFKLMG-GFCCVEGCSA-N 1 1 241.375 3.588 20 0 BHADMO CC[C@@H](F)C[N@H+](C)Cc1ccccc1SC ZINC000440524183 397930292 /nfs/dbraw/zinc/93/02/92/397930292.db2.gz JEGQORPTYFKLMG-GFCCVEGCSA-N 1 1 241.375 3.588 20 0 BHADMO CC[C@H](F)C[N@@H+](C)Cc1ccccc1SC ZINC000440524184 397929840 /nfs/dbraw/zinc/92/98/40/397929840.db2.gz JEGQORPTYFKLMG-LBPRGKRZSA-N 1 1 241.375 3.588 20 0 BHADMO CC[C@H](F)C[N@H+](C)Cc1ccccc1SC ZINC000440524184 397929838 /nfs/dbraw/zinc/92/98/38/397929838.db2.gz JEGQORPTYFKLMG-LBPRGKRZSA-N 1 1 241.375 3.588 20 0 BHADMO CC[C@H](F)C[N@@H+](C)[C@H]1CCCC[C@H]1CC ZINC000440524605 397929404 /nfs/dbraw/zinc/92/94/04/397929404.db2.gz KKEQKERIHNYNQI-AGIUHOORSA-N 1 1 215.356 3.635 20 0 BHADMO CC[C@H](F)C[N@@H+](C)[C@H]1CCCC[C@@H]1CC ZINC000440524606 397929943 /nfs/dbraw/zinc/92/99/43/397929943.db2.gz KKEQKERIHNYNQI-AVGNSLFASA-N 1 1 215.356 3.635 20 0 BHADMO CC[C@H](F)C[N@@H+](C)[C@@H]1CCCC[C@H]1CC ZINC000440524607 397929993 /nfs/dbraw/zinc/92/99/93/397929993.db2.gz KKEQKERIHNYNQI-FRRDWIJNSA-N 1 1 215.356 3.635 20 0 BHADMO CC[C@H](F)C[N@@H+](C)[C@@H]1CCCC[C@@H]1CC ZINC000440524608 397929542 /nfs/dbraw/zinc/92/95/42/397929542.db2.gz KKEQKERIHNYNQI-RWMBFGLXSA-N 1 1 215.356 3.635 20 0 BHADMO CC[C@H](F)C[N@@H+](CC)[C@@H](C)Cc1ccsc1 ZINC000440525549 397929968 /nfs/dbraw/zinc/92/99/68/397929968.db2.gz INIUCGHFJLCWMG-AAEUAGOBSA-N 1 1 243.391 3.749 20 0 BHADMO CC[C@@H](F)C[N@@H+](CC)[C@H](C)Cc1ccsc1 ZINC000440525551 397929455 /nfs/dbraw/zinc/92/94/55/397929455.db2.gz INIUCGHFJLCWMG-DGCLKSJQSA-N 1 1 243.391 3.749 20 0 BHADMO CC[C@@H](F)C[N@@H+](CC)[C@@H](C)Cc1ccsc1 ZINC000440525553 397930011 /nfs/dbraw/zinc/93/00/11/397930011.db2.gz INIUCGHFJLCWMG-WCQYABFASA-N 1 1 243.391 3.749 20 0 BHADMO CC[C@H](F)C[N@@H+](CC)[C@H](C)Cc1ccsc1 ZINC000440525554 397929984 /nfs/dbraw/zinc/92/99/84/397929984.db2.gz INIUCGHFJLCWMG-YPMHNXCESA-N 1 1 243.391 3.749 20 0 BHADMO CC[C@@H](F)C[N@H+]1Cc2ccccc2C[C@@H]1CC ZINC000440531486 388052567 /nfs/dbraw/zinc/05/25/67/388052567.db2.gz JESKEPXZOOCLAT-CABCVRRESA-N 1 1 235.346 3.571 20 0 BHADMO CC[C@H](F)C[N@H+]1Cc2ccccc2C[C@@H]1CC ZINC000440531487 388053504 /nfs/dbraw/zinc/05/35/04/388053504.db2.gz JESKEPXZOOCLAT-GJZGRUSLSA-N 1 1 235.346 3.571 20 0 BHADMO CC[C@@H](F)C[N@H+]1Cc2ccccc2C[C@H]1CC ZINC000440531488 388053306 /nfs/dbraw/zinc/05/33/06/388053306.db2.gz JESKEPXZOOCLAT-HUUCEWRRSA-N 1 1 235.346 3.571 20 0 BHADMO CC[C@H](F)C[N@H+]1Cc2ccccc2C[C@H]1CC ZINC000440531489 388052449 /nfs/dbraw/zinc/05/24/49/388052449.db2.gz JESKEPXZOOCLAT-LSDHHAIUSA-N 1 1 235.346 3.571 20 0 BHADMO Cc1[nH+]ccn1CCCCSCC(C)(C)C ZINC000440599281 388060453 /nfs/dbraw/zinc/06/04/53/388060453.db2.gz XZMWYXBYWSROTJ-UHFFFAOYSA-N 1 1 240.416 3.751 20 0 BHADMO Cc1cccc(C[N@@H+](C)CCCC2CCCC2)n1 ZINC000440656768 386052170 /nfs/dbraw/zinc/05/21/70/386052170.db2.gz DEDHLQKKYUMUNL-UHFFFAOYSA-N 1 1 246.398 3.792 20 0 BHADMO CC[C@H](F)C[N@@H+]([C@@H](C)[C@@H](C)CC)C1CC1 ZINC000440689256 386064687 /nfs/dbraw/zinc/06/46/87/386064687.db2.gz APYBRLGYXQQJIO-SRVKXCTJSA-N 1 1 215.356 3.634 20 0 BHADMO CC[C@H](F)C[N@@H+]([C@H](C)[C@@H](C)CC)C1CC1 ZINC000440689257 191693573 /nfs/dbraw/zinc/69/35/73/191693573.db2.gz APYBRLGYXQQJIO-TUAOUCFPSA-N 1 1 215.356 3.634 20 0 BHADMO CC[C@@H](C)[C@@H](C)[N@H+](C[C@@H](F)CC)C1CC1 ZINC000440689258 386064847 /nfs/dbraw/zinc/06/48/47/386064847.db2.gz APYBRLGYXQQJIO-UTUOFQBUSA-N 1 1 215.356 3.634 20 0 BHADMO CC[C@@H](C)[C@H](C)[N@H+](C[C@@H](F)CC)C1CC1 ZINC000440689259 386065360 /nfs/dbraw/zinc/06/53/60/386065360.db2.gz APYBRLGYXQQJIO-WOPDTQHZSA-N 1 1 215.356 3.634 20 0 BHADMO CC[C@H](F)C[N@H+]1CCC[C@@H]1c1ccccc1C ZINC000440689446 388067834 /nfs/dbraw/zinc/06/78/34/388067834.db2.gz BXEUSPAEEGCDBE-DZGCQCFKSA-N 1 1 235.346 3.880 20 0 BHADMO CC[C@@H](F)C[N@H+]1CCC[C@H]1c1ccccc1C ZINC000440689447 388067444 /nfs/dbraw/zinc/06/74/44/388067444.db2.gz BXEUSPAEEGCDBE-HIFRSBDPSA-N 1 1 235.346 3.880 20 0 BHADMO CC[C@@H](F)C[N@H+]1CCC[C@@H]1c1ccccc1C ZINC000440689448 388067038 /nfs/dbraw/zinc/06/70/38/388067038.db2.gz BXEUSPAEEGCDBE-UKRRQHHQSA-N 1 1 235.346 3.880 20 0 BHADMO CC[C@H](F)C[N@H+]1CCC[C@H]1c1ccccc1C ZINC000440689449 388066403 /nfs/dbraw/zinc/06/64/03/388066403.db2.gz BXEUSPAEEGCDBE-ZFWWWQNUSA-N 1 1 235.346 3.880 20 0 BHADMO CCC[N@H+](Cc1ccccc1)C[C@@H](F)CC ZINC000440691592 388066264 /nfs/dbraw/zinc/06/62/64/388066264.db2.gz IXTPOUGFHYELTO-AWEZNQCLSA-N 1 1 223.335 3.647 20 0 BHADMO CCC[N@H+](Cc1ccccc1)C[C@H](F)CC ZINC000440691593 388067149 /nfs/dbraw/zinc/06/71/49/388067149.db2.gz IXTPOUGFHYELTO-CQSZACIVSA-N 1 1 223.335 3.647 20 0 BHADMO CC[C@H](F)C[N@@H+](C1CC1)C1CCC(C)CC1 ZINC000440692649 388067607 /nfs/dbraw/zinc/06/76/07/388067607.db2.gz LIIPJBCYBSZSOV-CPCZMJQVSA-N 1 1 227.367 3.778 20 0 BHADMO CC[C@@H](F)C[N@@H+](C1CC1)C1CCC(C)CC1 ZINC000440692650 388067262 /nfs/dbraw/zinc/06/72/62/388067262.db2.gz LIIPJBCYBSZSOV-OTTFEQOBSA-N 1 1 227.367 3.778 20 0 BHADMO CCC[N@@H+](C[C@@H](O)CC)[C@@H](CC)c1ccccc1 ZINC000440694419 388069877 /nfs/dbraw/zinc/06/98/77/388069877.db2.gz OOEZEJTVDSEBHF-HOTGVXAUSA-N 1 1 249.398 3.621 20 0 BHADMO CCC[N@@H+](C[C@@H](O)CC)[C@H](CC)c1ccccc1 ZINC000440694420 388067393 /nfs/dbraw/zinc/06/73/93/388067393.db2.gz OOEZEJTVDSEBHF-JKSUJKDBSA-N 1 1 249.398 3.621 20 0 BHADMO CCCC[N@@H+](C[C@@H](O)CC)[C@@H](C)c1ccccc1 ZINC000440695538 388068172 /nfs/dbraw/zinc/06/81/72/388068172.db2.gz UZZXFKUXAXFCDA-HOCLYGCPSA-N 1 1 249.398 3.621 20 0 BHADMO CCCC[N@@H+](C[C@@H](O)CC)[C@H](C)c1ccccc1 ZINC000440695539 388069498 /nfs/dbraw/zinc/06/94/98/388069498.db2.gz UZZXFKUXAXFCDA-ZBFHGGJFSA-N 1 1 249.398 3.621 20 0 BHADMO CC[C@@H](F)C[N@H+]1CCC[C@H]1c1cccc(C)c1 ZINC000440695627 388069766 /nfs/dbraw/zinc/06/97/66/388069766.db2.gz QZTUXOUQBYMQMB-CABCVRRESA-N 1 1 235.346 3.880 20 0 BHADMO CC[C@H](F)C[N@H+]1CCC[C@H]1c1cccc(C)c1 ZINC000440695629 388069169 /nfs/dbraw/zinc/06/91/69/388069169.db2.gz QZTUXOUQBYMQMB-GJZGRUSLSA-N 1 1 235.346 3.880 20 0 BHADMO CC[C@@H](F)C[N@H+]1CCC[C@@H]1c1cccc(C)c1 ZINC000440695631 388069451 /nfs/dbraw/zinc/06/94/51/388069451.db2.gz QZTUXOUQBYMQMB-HUUCEWRRSA-N 1 1 235.346 3.880 20 0 BHADMO CC[C@H](F)C[N@H+]1CCC[C@@H]1c1cccc(C)c1 ZINC000440695632 388069723 /nfs/dbraw/zinc/06/97/23/388069723.db2.gz QZTUXOUQBYMQMB-LSDHHAIUSA-N 1 1 235.346 3.880 20 0 BHADMO CC[C@@H](F)C[N@@H+](C)[C@@H](C)c1ccc(F)cc1 ZINC000440696148 388064624 /nfs/dbraw/zinc/06/46/24/388064624.db2.gz SBFHMWOGZUZAKK-CMPLNLGQSA-N 1 1 227.298 3.567 20 0 BHADMO CC[C@H](F)C[N@@H+](C)[C@@H](C)c1ccc(F)cc1 ZINC000440696150 388064726 /nfs/dbraw/zinc/06/47/26/388064726.db2.gz SBFHMWOGZUZAKK-JQWIXIFHSA-N 1 1 227.298 3.567 20 0 BHADMO CC[C@H](F)C[N@@H+](C)[C@H](C)c1ccc(F)cc1 ZINC000440696151 388065686 /nfs/dbraw/zinc/06/56/86/388065686.db2.gz SBFHMWOGZUZAKK-PWSUYJOCSA-N 1 1 227.298 3.567 20 0 BHADMO CC[C@@H](F)C[N@@H+](C)[C@H](C)c1ccc(F)cc1 ZINC000440696154 388065314 /nfs/dbraw/zinc/06/53/14/388065314.db2.gz SBFHMWOGZUZAKK-ZYHUDNBSSA-N 1 1 227.298 3.567 20 0 BHADMO CC[C@@H](F)C[N@H+]1CCC[C@H]1c1ccc(C)s1 ZINC000440696328 388069742 /nfs/dbraw/zinc/06/97/42/388069742.db2.gz XAAJJUMMSYSDRU-NEPJUHHUSA-N 1 1 241.375 3.942 20 0 BHADMO CC[C@H](F)C[N@H+]1CCC[C@@H]1c1ccc(C)s1 ZINC000440696329 388069711 /nfs/dbraw/zinc/06/97/11/388069711.db2.gz XAAJJUMMSYSDRU-NWDGAFQWSA-N 1 1 241.375 3.942 20 0 BHADMO CC[C@H](F)C[N@H+]1CCC[C@H]1c1ccc(C)s1 ZINC000440696330 388068999 /nfs/dbraw/zinc/06/89/99/388068999.db2.gz XAAJJUMMSYSDRU-RYUDHWBXSA-N 1 1 241.375 3.942 20 0 BHADMO CC[C@@H](F)C[N@H+]1CCC[C@@H]1c1ccc(C)s1 ZINC000440696331 388069466 /nfs/dbraw/zinc/06/94/66/388069466.db2.gz XAAJJUMMSYSDRU-VXGBXAGGSA-N 1 1 241.375 3.942 20 0 BHADMO CC[C@H](F)C[N@H+]1CCC[C@@H]1c1ccc(F)cc1 ZINC000440698342 388069401 /nfs/dbraw/zinc/06/94/01/388069401.db2.gz OOAJUAHNBALCCD-GXTWGEPZSA-N 1 1 239.309 3.711 20 0 BHADMO CC[C@H](F)C[N@H+]1CCC[C@H]1c1ccc(F)cc1 ZINC000440698343 388068843 /nfs/dbraw/zinc/06/88/43/388068843.db2.gz OOAJUAHNBALCCD-JSGCOSHPSA-N 1 1 239.309 3.711 20 0 BHADMO CC[C@@H](F)C[N@H+]1CCC[C@H]1c1ccc(F)cc1 ZINC000440698344 206080372 /nfs/dbraw/zinc/08/03/72/206080372.db2.gz OOAJUAHNBALCCD-OCCSQVGLSA-N 1 1 239.309 3.711 20 0 BHADMO CC[C@@H](F)C[N@H+]1CCC[C@@H]1c1ccc(F)cc1 ZINC000440698345 206079738 /nfs/dbraw/zinc/07/97/38/206079738.db2.gz OOAJUAHNBALCCD-TZMCWYRMSA-N 1 1 239.309 3.711 20 0 BHADMO CC[C@@H](F)C[N@@H+](CC(C)C)C1CCCC1 ZINC000440698950 388069075 /nfs/dbraw/zinc/06/90/75/388069075.db2.gz RDUOXKCDYAWOKY-GFCCVEGCSA-N 1 1 215.356 3.635 20 0 BHADMO CC[C@H](F)C[N@@H+](CC(C)C)C1CCCC1 ZINC000440698952 388069271 /nfs/dbraw/zinc/06/92/71/388069271.db2.gz RDUOXKCDYAWOKY-LBPRGKRZSA-N 1 1 215.356 3.635 20 0 BHADMO CC[C@@H](F)C[N@@H+](CC)Cc1ccc(Cl)s1 ZINC000440699969 206080359 /nfs/dbraw/zinc/08/03/59/206080359.db2.gz DYKZCPAASACAJF-SECBINFHSA-N 1 1 249.782 3.972 20 0 BHADMO CC[C@@H](F)C[N@H+](CC)Cc1ccc(Cl)s1 ZINC000440699969 206080354 /nfs/dbraw/zinc/08/03/54/206080354.db2.gz DYKZCPAASACAJF-SECBINFHSA-N 1 1 249.782 3.972 20 0 BHADMO CC[C@H](F)C[N@@H+](CC)Cc1ccc(Cl)s1 ZINC000440699970 388068568 /nfs/dbraw/zinc/06/85/68/388068568.db2.gz DYKZCPAASACAJF-VIFPVBQESA-N 1 1 249.782 3.972 20 0 BHADMO CC[C@H](F)C[N@H+](CC)Cc1ccc(Cl)s1 ZINC000440699970 388068565 /nfs/dbraw/zinc/06/85/65/388068565.db2.gz DYKZCPAASACAJF-VIFPVBQESA-N 1 1 249.782 3.972 20 0 BHADMO CC[C@@H](F)C[N@@H+](Cc1ccc(F)cc1)C(C)C ZINC000440700478 388069206 /nfs/dbraw/zinc/06/92/06/388069206.db2.gz GAMAMYASBBVPFX-CYBMUJFWSA-N 1 1 241.325 3.784 20 0 BHADMO CC[C@H](F)C[N@@H+](Cc1ccc(F)cc1)C(C)C ZINC000440700481 388069847 /nfs/dbraw/zinc/06/98/47/388069847.db2.gz GAMAMYASBBVPFX-ZDUSSCGKSA-N 1 1 241.325 3.784 20 0 BHADMO CC[C@@H](F)C[N@@H+](Cc1cccs1)C(C)C ZINC000440701508 388070523 /nfs/dbraw/zinc/07/05/23/388070523.db2.gz AJQVOINFCATVSU-LLVKDONJSA-N 1 1 229.364 3.707 20 0 BHADMO CC[C@H](F)C[N@@H+](Cc1cccs1)C(C)C ZINC000440701511 201505643 /nfs/dbraw/zinc/50/56/43/201505643.db2.gz AJQVOINFCATVSU-NSHDSACASA-N 1 1 229.364 3.707 20 0 BHADMO CCCCC[N@@H+](C[C@H](F)CC)C(C)C ZINC000440701764 388070560 /nfs/dbraw/zinc/07/05/60/388070560.db2.gz BMENUEIITRGNSW-GFCCVEGCSA-N 1 1 203.345 3.635 20 0 BHADMO CCCCC[N@@H+](C[C@@H](F)CC)C(C)C ZINC000440701765 388071620 /nfs/dbraw/zinc/07/16/20/388071620.db2.gz BMENUEIITRGNSW-LBPRGKRZSA-N 1 1 203.345 3.635 20 0 BHADMO CC[C@H](F)C[N@H+]1CCC[C@H]1c1ccccc1 ZINC000440701804 206080435 /nfs/dbraw/zinc/08/04/35/206080435.db2.gz BPADZELZEXICNF-KBPBESRZSA-N 1 1 221.319 3.572 20 0 BHADMO CC[C@@H](F)C[N@H+]1CCC[C@H]1c1ccccc1 ZINC000440701807 206080039 /nfs/dbraw/zinc/08/00/39/206080039.db2.gz BPADZELZEXICNF-KGLIPLIRSA-N 1 1 221.319 3.572 20 0 BHADMO CC[C@H](F)C[N@H+]1CCC[C@@H]1c1ccccc1 ZINC000440701810 206080394 /nfs/dbraw/zinc/08/03/94/206080394.db2.gz BPADZELZEXICNF-UONOGXRCSA-N 1 1 221.319 3.572 20 0 BHADMO CC[C@@H](F)C[N@H+]1CCC[C@@H]1c1ccccc1 ZINC000440701812 206079944 /nfs/dbraw/zinc/07/99/44/206079944.db2.gz BPADZELZEXICNF-ZIAGYGMSSA-N 1 1 221.319 3.572 20 0 BHADMO CC[C@@H](F)C[N@H+]1CCC[C@@H]1c1cccs1 ZINC000440702538 388070180 /nfs/dbraw/zinc/07/01/80/388070180.db2.gz ORXJLDAXRYTDNV-GHMZBOCLSA-N 1 1 227.348 3.633 20 0 BHADMO CC[C@@H](F)C[N@H+]1CCC[C@H]1c1cccs1 ZINC000440702539 388070997 /nfs/dbraw/zinc/07/09/97/388070997.db2.gz ORXJLDAXRYTDNV-MNOVXSKESA-N 1 1 227.348 3.633 20 0 BHADMO CC[C@H](F)C[N@H+]1CCC[C@H]1c1cccs1 ZINC000440702540 388070550 /nfs/dbraw/zinc/07/05/50/388070550.db2.gz ORXJLDAXRYTDNV-QWRGUYRKSA-N 1 1 227.348 3.633 20 0 BHADMO CC[C@H](F)C[N@H+]1CCC[C@@H]1c1cccs1 ZINC000440702541 388071200 /nfs/dbraw/zinc/07/12/00/388071200.db2.gz ORXJLDAXRYTDNV-WDEREUQCSA-N 1 1 227.348 3.633 20 0 BHADMO CC[C@@H](F)C[N@@H+](C)[C@H](C)c1ccccc1C ZINC000440702574 388071733 /nfs/dbraw/zinc/07/17/33/388071733.db2.gz OZYJHRGMUSZJHK-CHWSQXEVSA-N 1 1 223.335 3.736 20 0 BHADMO CC[C@H](F)C[N@@H+](C)[C@H](C)c1ccccc1C ZINC000440702575 388070332 /nfs/dbraw/zinc/07/03/32/388070332.db2.gz OZYJHRGMUSZJHK-OLZOCXBDSA-N 1 1 223.335 3.736 20 0 BHADMO CC[C@@H](F)C[N@@H+](C)[C@@H](C)c1ccccc1C ZINC000440702576 388071403 /nfs/dbraw/zinc/07/14/03/388071403.db2.gz OZYJHRGMUSZJHK-QWHCGFSZSA-N 1 1 223.335 3.736 20 0 BHADMO CC[C@H](F)C[N@@H+](C)[C@@H](C)c1ccccc1C ZINC000440702577 388071271 /nfs/dbraw/zinc/07/12/71/388071271.db2.gz OZYJHRGMUSZJHK-STQMWFEESA-N 1 1 223.335 3.736 20 0 BHADMO CC[C@@H](F)C[N@@H+](Cc1ccc(F)cc1)C1CC1 ZINC000440703373 388071523 /nfs/dbraw/zinc/07/15/23/388071523.db2.gz MNYDYUSWEAUGMN-GFCCVEGCSA-N 1 1 239.309 3.538 20 0 BHADMO CC[C@H](F)C[N@@H+](Cc1ccc(F)cc1)C1CC1 ZINC000440703374 388071556 /nfs/dbraw/zinc/07/15/56/388071556.db2.gz MNYDYUSWEAUGMN-LBPRGKRZSA-N 1 1 239.309 3.538 20 0 BHADMO CC[C@@H](F)C[N@H+]1CCC[C@H]1c1ccsc1 ZINC000440703393 386086771 /nfs/dbraw/zinc/08/67/71/386086771.db2.gz HJYFGHJNHSNOLC-NEPJUHHUSA-N 1 1 227.348 3.633 20 0 BHADMO CC[C@H](F)C[N@H+]1CCC[C@@H]1c1ccsc1 ZINC000440703394 386086710 /nfs/dbraw/zinc/08/67/10/386086710.db2.gz HJYFGHJNHSNOLC-NWDGAFQWSA-N 1 1 227.348 3.633 20 0 BHADMO CC[C@H](F)C[N@H+]1CCC[C@H]1c1ccsc1 ZINC000440703395 386087223 /nfs/dbraw/zinc/08/72/23/386087223.db2.gz HJYFGHJNHSNOLC-RYUDHWBXSA-N 1 1 227.348 3.633 20 0 BHADMO CC[C@@H](F)C[N@H+]1CCC[C@@H]1c1ccsc1 ZINC000440703396 386087240 /nfs/dbraw/zinc/08/72/40/386087240.db2.gz HJYFGHJNHSNOLC-VXGBXAGGSA-N 1 1 227.348 3.633 20 0 BHADMO CC[C@H](F)C[N@H+]1CCc2sccc2[C@H]1CC ZINC000440703453 386092080 /nfs/dbraw/zinc/09/20/80/386092080.db2.gz IFHNWIXCMLCWKW-CMPLNLGQSA-N 1 1 241.375 3.805 20 0 BHADMO CC[C@H](F)C[N@H+]1CCc2sccc2[C@@H]1CC ZINC000440703454 386090884 /nfs/dbraw/zinc/09/08/84/386090884.db2.gz IFHNWIXCMLCWKW-JQWIXIFHSA-N 1 1 241.375 3.805 20 0 BHADMO CC[C@@H](F)C[N@H+]1CCc2sccc2[C@@H]1CC ZINC000440703455 386091645 /nfs/dbraw/zinc/09/16/45/386091645.db2.gz IFHNWIXCMLCWKW-PWSUYJOCSA-N 1 1 241.375 3.805 20 0 BHADMO CC[C@@H](F)C[N@H+]1CCc2sccc2[C@H]1CC ZINC000440703456 386091431 /nfs/dbraw/zinc/09/14/31/386091431.db2.gz IFHNWIXCMLCWKW-ZYHUDNBSSA-N 1 1 241.375 3.805 20 0 BHADMO CC[C@@H](F)C[N@@H+](Cc1cccc(F)c1)C(C)C ZINC000440703481 386093081 /nfs/dbraw/zinc/09/30/81/386093081.db2.gz IKHVQBZPIQYLLI-CYBMUJFWSA-N 1 1 241.325 3.784 20 0 BHADMO CC[C@H](F)C[N@@H+](Cc1cccc(F)c1)C(C)C ZINC000440703482 386093149 /nfs/dbraw/zinc/09/31/49/386093149.db2.gz IKHVQBZPIQYLLI-ZDUSSCGKSA-N 1 1 241.325 3.784 20 0 BHADMO CC[C@@H](F)C[N@H+]1CCCC[C@H]1c1ccco1 ZINC000440704336 388071648 /nfs/dbraw/zinc/07/16/48/388071648.db2.gz VATUQKJVPUNYJA-NEPJUHHUSA-N 1 1 225.307 3.555 20 0 BHADMO CC[C@H](F)C[N@H+]1CCCC[C@@H]1c1ccco1 ZINC000440704337 388071342 /nfs/dbraw/zinc/07/13/42/388071342.db2.gz VATUQKJVPUNYJA-NWDGAFQWSA-N 1 1 225.307 3.555 20 0 BHADMO CC[C@H](F)C[N@H+]1CCCC[C@H]1c1ccco1 ZINC000440704338 388070763 /nfs/dbraw/zinc/07/07/63/388070763.db2.gz VATUQKJVPUNYJA-RYUDHWBXSA-N 1 1 225.307 3.555 20 0 BHADMO CC[C@@H](F)C[N@H+]1CCCC[C@@H]1c1ccco1 ZINC000440704339 388070447 /nfs/dbraw/zinc/07/04/47/388070447.db2.gz VATUQKJVPUNYJA-VXGBXAGGSA-N 1 1 225.307 3.555 20 0 BHADMO CC[C@@H](F)C[N@@H+](CC1CC1)C1CCCCC1 ZINC000440704391 388071179 /nfs/dbraw/zinc/07/11/79/388071179.db2.gz VOBIFRSDUVVUNF-CYBMUJFWSA-N 1 1 227.367 3.779 20 0 BHADMO CC[C@H](F)C[N@@H+](CC1CC1)C1CCCCC1 ZINC000440704392 388071503 /nfs/dbraw/zinc/07/15/03/388071503.db2.gz VOBIFRSDUVVUNF-ZDUSSCGKSA-N 1 1 227.367 3.779 20 0 BHADMO CC[C@H](F)C[N@@H+](CC)[C@@H](C)c1ccc(F)cc1 ZINC000440704435 388071665 /nfs/dbraw/zinc/07/16/65/388071665.db2.gz VZCXPDFJFOSJBC-AAEUAGOBSA-N 1 1 241.325 3.957 20 0 BHADMO CC[C@@H](F)C[N@@H+](CC)[C@H](C)c1ccc(F)cc1 ZINC000440704436 388071107 /nfs/dbraw/zinc/07/11/07/388071107.db2.gz VZCXPDFJFOSJBC-DGCLKSJQSA-N 1 1 241.325 3.957 20 0 BHADMO CC[C@@H](F)C[N@@H+](CC)[C@@H](C)c1ccc(F)cc1 ZINC000440704437 388071161 /nfs/dbraw/zinc/07/11/61/388071161.db2.gz VZCXPDFJFOSJBC-WCQYABFASA-N 1 1 241.325 3.957 20 0 BHADMO CC[C@H](F)C[N@@H+](CC)[C@H](C)c1ccc(F)cc1 ZINC000440704440 388071573 /nfs/dbraw/zinc/07/15/73/388071573.db2.gz VZCXPDFJFOSJBC-YPMHNXCESA-N 1 1 241.325 3.957 20 0 BHADMO CC[C@@H](F)C[N@@H+](C)[C@@H](C)c1ccc(F)c(F)c1 ZINC000440705398 387674473 /nfs/dbraw/zinc/67/44/73/387674473.db2.gz ZHFYRQVZMIJSMT-GXSJLCMTSA-N 1 1 245.288 3.706 20 0 BHADMO CC[C@H](F)C[N@@H+](C)[C@H](C)c1ccc(F)c(F)c1 ZINC000440705399 387674032 /nfs/dbraw/zinc/67/40/32/387674032.db2.gz ZHFYRQVZMIJSMT-KOLCDFICSA-N 1 1 245.288 3.706 20 0 BHADMO CC[C@@H](F)C[N@@H+](C)[C@H](C)c1ccc(F)c(F)c1 ZINC000440705400 387673799 /nfs/dbraw/zinc/67/37/99/387673799.db2.gz ZHFYRQVZMIJSMT-MWLCHTKSSA-N 1 1 245.288 3.706 20 0 BHADMO CC[C@H](F)C[N@@H+](C)[C@@H](C)c1ccc(F)c(F)c1 ZINC000440705402 387675196 /nfs/dbraw/zinc/67/51/96/387675196.db2.gz ZHFYRQVZMIJSMT-ONGXEEELSA-N 1 1 245.288 3.706 20 0 BHADMO CC[C@H](F)C[N@@H+](CC)Cc1ccccc1C ZINC000440705927 387675548 /nfs/dbraw/zinc/67/55/48/387675548.db2.gz QJNGWMCQIMABTB-AWEZNQCLSA-N 1 1 223.335 3.565 20 0 BHADMO CC[C@@H](F)C[N@@H+](CC)Cc1ccccc1C ZINC000440705928 387675947 /nfs/dbraw/zinc/67/59/47/387675947.db2.gz QJNGWMCQIMABTB-CQSZACIVSA-N 1 1 223.335 3.565 20 0 BHADMO CC[C@@H](F)C[N@@H+](C)[C@@H](C)c1sc(C)nc1C ZINC000440706645 387675660 /nfs/dbraw/zinc/67/56/60/387675660.db2.gz SRLRQWYORAGQFF-GXSJLCMTSA-N 1 1 244.379 3.501 20 0 BHADMO CC[C@@H](F)C[N@H+](C)[C@@H](C)c1sc(C)nc1C ZINC000440706645 387675656 /nfs/dbraw/zinc/67/56/56/387675656.db2.gz SRLRQWYORAGQFF-GXSJLCMTSA-N 1 1 244.379 3.501 20 0 BHADMO CC[C@H](F)C[N@@H+](C)[C@H](C)c1sc(C)nc1C ZINC000440706649 387674515 /nfs/dbraw/zinc/67/45/15/387674515.db2.gz SRLRQWYORAGQFF-KOLCDFICSA-N 1 1 244.379 3.501 20 0 BHADMO CC[C@H](F)C[N@H+](C)[C@H](C)c1sc(C)nc1C ZINC000440706649 387674510 /nfs/dbraw/zinc/67/45/10/387674510.db2.gz SRLRQWYORAGQFF-KOLCDFICSA-N 1 1 244.379 3.501 20 0 BHADMO CC[C@@H](F)C[N@@H+](C)[C@H](C)c1sc(C)nc1C ZINC000440706650 387674178 /nfs/dbraw/zinc/67/41/78/387674178.db2.gz SRLRQWYORAGQFF-MWLCHTKSSA-N 1 1 244.379 3.501 20 0 BHADMO CC[C@@H](F)C[N@H+](C)[C@H](C)c1sc(C)nc1C ZINC000440706650 387674174 /nfs/dbraw/zinc/67/41/74/387674174.db2.gz SRLRQWYORAGQFF-MWLCHTKSSA-N 1 1 244.379 3.501 20 0 BHADMO CC[C@H](F)C[N@@H+](C)[C@@H](C)c1sc(C)nc1C ZINC000440706651 387673979 /nfs/dbraw/zinc/67/39/79/387673979.db2.gz SRLRQWYORAGQFF-ONGXEEELSA-N 1 1 244.379 3.501 20 0 BHADMO CC[C@H](F)C[N@H+](C)[C@@H](C)c1sc(C)nc1C ZINC000440706651 387673975 /nfs/dbraw/zinc/67/39/75/387673975.db2.gz SRLRQWYORAGQFF-ONGXEEELSA-N 1 1 244.379 3.501 20 0 BHADMO CC[C@H](F)C[N@H+]1CC[C@H](c2ccccc2C)C1 ZINC000440706854 387674450 /nfs/dbraw/zinc/67/44/50/387674450.db2.gz STFOWISGMXHIEG-KBPBESRZSA-N 1 1 235.346 3.532 20 0 BHADMO CC[C@H](F)C[N@H+]1CC[C@@H](c2ccccc2C)C1 ZINC000440706856 387674685 /nfs/dbraw/zinc/67/46/85/387674685.db2.gz STFOWISGMXHIEG-KGLIPLIRSA-N 1 1 235.346 3.532 20 0 BHADMO CC[C@@H](F)C[N@H+]1CC[C@H](c2ccccc2C)C1 ZINC000440706857 387674245 /nfs/dbraw/zinc/67/42/45/387674245.db2.gz STFOWISGMXHIEG-UONOGXRCSA-N 1 1 235.346 3.532 20 0 BHADMO CC[C@@H](F)C[N@H+]1CC[C@@H](c2ccccc2C)C1 ZINC000440706859 201509466 /nfs/dbraw/zinc/50/94/66/201509466.db2.gz STFOWISGMXHIEG-ZIAGYGMSSA-N 1 1 235.346 3.532 20 0 BHADMO CC[C@H](F)C[N@@H+](Cc1ccccc1)C(C)C ZINC000440706939 387673898 /nfs/dbraw/zinc/67/38/98/387673898.db2.gz WAVNEDMDVXWSGM-AWEZNQCLSA-N 1 1 223.335 3.645 20 0 BHADMO CC[C@@H](F)C[N@@H+](Cc1ccccc1)C(C)C ZINC000440706940 387674021 /nfs/dbraw/zinc/67/40/21/387674021.db2.gz WAVNEDMDVXWSGM-CQSZACIVSA-N 1 1 223.335 3.645 20 0 BHADMO CC[C@H](F)C[N@H+]1CCC[C@@H]1c1cccc(F)c1 ZINC000440707098 387673920 /nfs/dbraw/zinc/67/39/20/387673920.db2.gz WTZFRZJXKRBRNG-GXTWGEPZSA-N 1 1 239.309 3.711 20 0 BHADMO CC[C@H](F)C[N@H+]1CCC[C@H]1c1cccc(F)c1 ZINC000440707099 387673946 /nfs/dbraw/zinc/67/39/46/387673946.db2.gz WTZFRZJXKRBRNG-JSGCOSHPSA-N 1 1 239.309 3.711 20 0 BHADMO CC[C@@H](F)C[N@H+]1CCC[C@H]1c1cccc(F)c1 ZINC000440707100 387675489 /nfs/dbraw/zinc/67/54/89/387675489.db2.gz WTZFRZJXKRBRNG-OCCSQVGLSA-N 1 1 239.309 3.711 20 0 BHADMO CC[C@@H](F)C[N@H+]1CCC[C@@H]1c1cccc(F)c1 ZINC000440707101 387675337 /nfs/dbraw/zinc/67/53/37/387675337.db2.gz WTZFRZJXKRBRNG-TZMCWYRMSA-N 1 1 239.309 3.711 20 0 BHADMO CC[C@@H](F)C[N@H+]1CCC[C@H]1c1ccc(C)cc1 ZINC000440709077 387676796 /nfs/dbraw/zinc/67/67/96/387676796.db2.gz HTBFVSTZLKRXGZ-CABCVRRESA-N 1 1 235.346 3.880 20 0 BHADMO CC[C@H](F)C[N@H+]1CCC[C@H]1c1ccc(C)cc1 ZINC000440709079 387677810 /nfs/dbraw/zinc/67/78/10/387677810.db2.gz HTBFVSTZLKRXGZ-GJZGRUSLSA-N 1 1 235.346 3.880 20 0 BHADMO CC[C@@H](F)C[N@H+]1CCC[C@@H]1c1ccc(C)cc1 ZINC000440709082 388067433 /nfs/dbraw/zinc/06/74/33/388067433.db2.gz HTBFVSTZLKRXGZ-HUUCEWRRSA-N 1 1 235.346 3.880 20 0 BHADMO CC[C@H](F)C[N@H+]1CCC[C@@H]1c1ccc(C)cc1 ZINC000440709084 388066474 /nfs/dbraw/zinc/06/64/74/388066474.db2.gz HTBFVSTZLKRXGZ-LSDHHAIUSA-N 1 1 235.346 3.880 20 0 BHADMO CC[C@@H](F)C[N@@H+](C)[C@@H](C)c1ccc(C)cc1 ZINC000440709415 387678206 /nfs/dbraw/zinc/67/82/06/387678206.db2.gz IUVUJJFMMQTCPQ-GXTWGEPZSA-N 1 1 223.335 3.736 20 0 BHADMO CC[C@H](F)C[N@@H+](C)[C@@H](C)c1ccc(C)cc1 ZINC000440709417 387677767 /nfs/dbraw/zinc/67/77/67/387677767.db2.gz IUVUJJFMMQTCPQ-JSGCOSHPSA-N 1 1 223.335 3.736 20 0 BHADMO CC[C@H](F)C[N@@H+](C)[C@H](C)c1ccc(C)cc1 ZINC000440709418 388065154 /nfs/dbraw/zinc/06/51/54/388065154.db2.gz IUVUJJFMMQTCPQ-OCCSQVGLSA-N 1 1 223.335 3.736 20 0 BHADMO CC[C@@H](F)C[N@@H+](C)[C@H](C)c1ccc(C)cc1 ZINC000440709420 388065072 /nfs/dbraw/zinc/06/50/72/388065072.db2.gz IUVUJJFMMQTCPQ-TZMCWYRMSA-N 1 1 223.335 3.736 20 0 BHADMO CC[C@@H](F)C[N@@H+](C)Cc1ccc(Cl)s1 ZINC000440709870 387677953 /nfs/dbraw/zinc/67/79/53/387677953.db2.gz DYURNPQCRMXROC-MRVPVSSYSA-N 1 1 235.755 3.581 20 0 BHADMO CC[C@@H](F)C[N@H+](C)Cc1ccc(Cl)s1 ZINC000440709870 387677947 /nfs/dbraw/zinc/67/79/47/387677947.db2.gz DYURNPQCRMXROC-MRVPVSSYSA-N 1 1 235.755 3.581 20 0 BHADMO CC[C@H](F)C[N@@H+](C)Cc1ccc(Cl)s1 ZINC000440709871 387678388 /nfs/dbraw/zinc/67/83/88/387678388.db2.gz DYURNPQCRMXROC-QMMMGPOBSA-N 1 1 235.755 3.581 20 0 BHADMO CC[C@H](F)C[N@H+](C)Cc1ccc(Cl)s1 ZINC000440709871 387678385 /nfs/dbraw/zinc/67/83/85/387678385.db2.gz DYURNPQCRMXROC-QMMMGPOBSA-N 1 1 235.755 3.581 20 0 BHADMO CCC[N@H+](Cc1ccc(F)cc1)C[C@H](F)CC ZINC000440709929 387676681 /nfs/dbraw/zinc/67/66/81/387676681.db2.gz DXYSFDGIZLGJBL-CYBMUJFWSA-N 1 1 241.325 3.786 20 0 BHADMO CCC[N@H+](Cc1ccc(F)cc1)C[C@@H](F)CC ZINC000440709930 387676886 /nfs/dbraw/zinc/67/68/86/387676886.db2.gz DXYSFDGIZLGJBL-ZDUSSCGKSA-N 1 1 241.325 3.786 20 0 BHADMO CC[C@@H](F)C[N@@H+](C)Cc1cccc(Cl)c1 ZINC000440711378 387677281 /nfs/dbraw/zinc/67/72/81/387677281.db2.gz JBMXIBIXPRRITD-GFCCVEGCSA-N 1 1 229.726 3.520 20 0 BHADMO CC[C@H](F)C[N@@H+](C)Cc1cccc(Cl)c1 ZINC000440711379 387678622 /nfs/dbraw/zinc/67/86/22/387678622.db2.gz JBMXIBIXPRRITD-LBPRGKRZSA-N 1 1 229.726 3.520 20 0 BHADMO CC[C@@H](F)C[N@@H+](C)Cc1ccc(Cl)cc1 ZINC000440712296 386104008 /nfs/dbraw/zinc/10/40/08/386104008.db2.gz LSAPJJPFHJBDMV-GFCCVEGCSA-N 1 1 229.726 3.520 20 0 BHADMO CC[C@H](F)C[N@@H+](C)Cc1ccc(Cl)cc1 ZINC000440712297 386103139 /nfs/dbraw/zinc/10/31/39/386103139.db2.gz LSAPJJPFHJBDMV-LBPRGKRZSA-N 1 1 229.726 3.520 20 0 BHADMO CC[C@H](F)C[N@@H+](C)CCCCc1ccccc1 ZINC000440715281 387681057 /nfs/dbraw/zinc/68/10/57/387681057.db2.gz WMOSYCGZVPSTHJ-HNNXBMFYSA-N 1 1 237.362 3.689 20 0 BHADMO CC[C@@H](F)C[N@@H+](C)CCCCc1ccccc1 ZINC000440715282 387681215 /nfs/dbraw/zinc/68/12/15/387681215.db2.gz WMOSYCGZVPSTHJ-OAHLLOKOSA-N 1 1 237.362 3.689 20 0 BHADMO CC[C@H](F)C[N@H+]1C[C@H](c2ccccc2)C[C@@H]1C ZINC000440716539 387681979 /nfs/dbraw/zinc/68/19/79/387681979.db2.gz VSORAVILRJGLQG-CFVMTHIKSA-N 1 1 235.346 3.613 20 0 BHADMO CC[C@H](F)C[N@H+]1C[C@@H](c2ccccc2)C[C@@H]1C ZINC000440716540 387681843 /nfs/dbraw/zinc/68/18/43/387681843.db2.gz VSORAVILRJGLQG-QEJZJMRPSA-N 1 1 235.346 3.613 20 0 BHADMO CC[C@H](F)C[N@H+]1C[C@@H](c2ccccc2)C[C@H]1C ZINC000440716541 387682116 /nfs/dbraw/zinc/68/21/16/387682116.db2.gz VSORAVILRJGLQG-SNPRPXQTSA-N 1 1 235.346 3.613 20 0 BHADMO CC[C@H](F)C[N@H+]1C[C@H](c2ccccc2)C[C@H]1C ZINC000440716542 387681325 /nfs/dbraw/zinc/68/13/25/387681325.db2.gz VSORAVILRJGLQG-YUELXQCFSA-N 1 1 235.346 3.613 20 0 BHADMO CC[C@H](F)C[N@@H+](Cc1ccccc1C)C1CC1 ZINC000440716727 387680474 /nfs/dbraw/zinc/68/04/74/387680474.db2.gz QYKRIWIVNHIINI-AWEZNQCLSA-N 1 1 235.346 3.708 20 0 BHADMO CC[C@@H](F)C[N@@H+](Cc1ccccc1C)C1CC1 ZINC000440716738 387681527 /nfs/dbraw/zinc/68/15/27/387681527.db2.gz QYKRIWIVNHIINI-CQSZACIVSA-N 1 1 235.346 3.708 20 0 BHADMO CC[C@@H](F)C[N@@H+](C)[C@H](C)c1ccccc1F ZINC000440717042 386111098 /nfs/dbraw/zinc/11/10/98/386111098.db2.gz UHCMGNYTIQFSDB-GHMZBOCLSA-N 1 1 227.298 3.567 20 0 BHADMO CC[C@@H](F)C[N@H+](C)[C@H](C)c1ccccc1F ZINC000440717042 386111092 /nfs/dbraw/zinc/11/10/92/386111092.db2.gz UHCMGNYTIQFSDB-GHMZBOCLSA-N 1 1 227.298 3.567 20 0 BHADMO CC[C@H](F)C[N@@H+](C)[C@H](C)c1ccccc1F ZINC000440717044 386111283 /nfs/dbraw/zinc/11/12/83/386111283.db2.gz UHCMGNYTIQFSDB-MNOVXSKESA-N 1 1 227.298 3.567 20 0 BHADMO CC[C@H](F)C[N@H+](C)[C@H](C)c1ccccc1F ZINC000440717044 386111275 /nfs/dbraw/zinc/11/12/75/386111275.db2.gz UHCMGNYTIQFSDB-MNOVXSKESA-N 1 1 227.298 3.567 20 0 BHADMO CC[C@H](F)C[N@@H+](C)[C@@H](C)c1ccccc1F ZINC000440717045 386111911 /nfs/dbraw/zinc/11/19/11/386111911.db2.gz UHCMGNYTIQFSDB-QWRGUYRKSA-N 1 1 227.298 3.567 20 0 BHADMO CC[C@H](F)C[N@H+](C)[C@@H](C)c1ccccc1F ZINC000440717045 386111906 /nfs/dbraw/zinc/11/19/06/386111906.db2.gz UHCMGNYTIQFSDB-QWRGUYRKSA-N 1 1 227.298 3.567 20 0 BHADMO CC[C@@H](F)C[N@@H+](C)[C@@H](C)c1ccccc1F ZINC000440717047 386110952 /nfs/dbraw/zinc/11/09/52/386110952.db2.gz UHCMGNYTIQFSDB-WDEREUQCSA-N 1 1 227.298 3.567 20 0 BHADMO CC[C@@H](F)C[N@H+](C)[C@@H](C)c1ccccc1F ZINC000440717047 386110946 /nfs/dbraw/zinc/11/09/46/386110946.db2.gz UHCMGNYTIQFSDB-WDEREUQCSA-N 1 1 227.298 3.567 20 0 BHADMO CC[C@@H](F)C[N@@H+](Cc1ccccc1F)C(C)C ZINC000440717788 387681822 /nfs/dbraw/zinc/68/18/22/387681822.db2.gz YFZNNTFVSREREN-CYBMUJFWSA-N 1 1 241.325 3.784 20 0 BHADMO CC[C@@H](F)C[N@H+](Cc1ccccc1F)C(C)C ZINC000440717788 387681818 /nfs/dbraw/zinc/68/18/18/387681818.db2.gz YFZNNTFVSREREN-CYBMUJFWSA-N 1 1 241.325 3.784 20 0 BHADMO CC[C@H](F)C[N@@H+](Cc1ccccc1F)C(C)C ZINC000440717790 387682416 /nfs/dbraw/zinc/68/24/16/387682416.db2.gz YFZNNTFVSREREN-ZDUSSCGKSA-N 1 1 241.325 3.784 20 0 BHADMO CC[C@H](F)C[N@H+](Cc1ccccc1F)C(C)C ZINC000440717790 387682411 /nfs/dbraw/zinc/68/24/11/387682411.db2.gz YFZNNTFVSREREN-ZDUSSCGKSA-N 1 1 241.325 3.784 20 0 BHADMO CC[C@H](F)C[N@H+]1CCC[C@@]2(CC=CCC2)C1 ZINC000440719091 387682041 /nfs/dbraw/zinc/68/20/41/387682041.db2.gz ZHUYRUBMVASIPD-KBPBESRZSA-N 1 1 225.351 3.557 20 0 BHADMO CC[C@@H](F)C[N@H+]1CCC[C@@]2(CC=CCC2)C1 ZINC000440719096 387679919 /nfs/dbraw/zinc/67/99/19/387679919.db2.gz ZHUYRUBMVASIPD-KGLIPLIRSA-N 1 1 225.351 3.557 20 0 BHADMO CC[C@H](F)C[N@H+]1CCC[C@]2(CC=CCC2)C1 ZINC000440719099 387680931 /nfs/dbraw/zinc/68/09/31/387680931.db2.gz ZHUYRUBMVASIPD-UONOGXRCSA-N 1 1 225.351 3.557 20 0 BHADMO CC[C@@H](F)C[N@H+]1CCC[C@]2(CC=CCC2)C1 ZINC000440719102 387680605 /nfs/dbraw/zinc/68/06/05/387680605.db2.gz ZHUYRUBMVASIPD-ZIAGYGMSSA-N 1 1 225.351 3.557 20 0 BHADMO CC[C@@H](F)C[N@@H+](Cc1ccco1)C1CCCC1 ZINC000440719485 387679956 /nfs/dbraw/zinc/67/99/56/387679956.db2.gz XYWAWHOCGDQUDI-GFCCVEGCSA-N 1 1 239.334 3.772 20 0 BHADMO CC[C@H](F)C[N@@H+](Cc1ccco1)C1CCCC1 ZINC000440719487 387683115 /nfs/dbraw/zinc/68/31/15/387683115.db2.gz XYWAWHOCGDQUDI-LBPRGKRZSA-N 1 1 239.334 3.772 20 0 BHADMO CC[C@@H](F)C[N@H+]1CCCC12CCCCC2 ZINC000440771363 387690501 /nfs/dbraw/zinc/69/05/01/387690501.db2.gz QSEAUFYXJWWWTL-GFCCVEGCSA-N 1 1 213.340 3.533 20 0 BHADMO CC[C@H](F)C[N@H+]1CCCC12CCCCC2 ZINC000440771364 387690727 /nfs/dbraw/zinc/69/07/27/387690727.db2.gz QSEAUFYXJWWWTL-LBPRGKRZSA-N 1 1 213.340 3.533 20 0 BHADMO CC[C@@H](F)C[N@@H+](C)C1CCC(C)(C)CC1 ZINC000440772929 201517352 /nfs/dbraw/zinc/51/73/52/201517352.db2.gz WHRHXTSDYKKLCI-LLVKDONJSA-N 1 1 215.356 3.635 20 0 BHADMO CC[C@H](F)C[N@@H+](C)C1CCC(C)(C)CC1 ZINC000440772931 387688213 /nfs/dbraw/zinc/68/82/13/387688213.db2.gz WHRHXTSDYKKLCI-NSHDSACASA-N 1 1 215.356 3.635 20 0 BHADMO CC[C@@H](F)C[N@H+]1Cc2ccccc2C(C)(C)C1 ZINC000440775773 386152109 /nfs/dbraw/zinc/15/21/09/386152109.db2.gz PJMKFWXYPQXCLD-CYBMUJFWSA-N 1 1 235.346 3.528 20 0 BHADMO CC[C@H](F)C[N@H+]1Cc2ccccc2C(C)(C)C1 ZINC000440776039 386146746 /nfs/dbraw/zinc/14/67/46/386146746.db2.gz PJMKFWXYPQXCLD-ZDUSSCGKSA-N 1 1 235.346 3.528 20 0 BHADMO CCC[C@H](C)[C@@H]1CCC[N@H+]1C[C@@H](F)CC ZINC000440776133 387693697 /nfs/dbraw/zinc/69/36/97/387693697.db2.gz QFUAZRMAHYAAOU-AVGNSLFASA-N 1 1 215.356 3.635 20 0 BHADMO CCC[C@H](C)[C@H]1CCC[N@H+]1C[C@@H](F)CC ZINC000440776134 387693412 /nfs/dbraw/zinc/69/34/12/387693412.db2.gz QFUAZRMAHYAAOU-RWMBFGLXSA-N 1 1 215.356 3.635 20 0 BHADMO CCC[C@H](C)[C@@H]1CCC[N@H+]1C[C@H](F)CC ZINC000440776135 387694790 /nfs/dbraw/zinc/69/47/90/387694790.db2.gz QFUAZRMAHYAAOU-XQQFMLRXSA-N 1 1 215.356 3.635 20 0 BHADMO CCC[C@H](C)[C@H]1CCC[N@H+]1C[C@H](F)CC ZINC000440776136 387693206 /nfs/dbraw/zinc/69/32/06/387693206.db2.gz QFUAZRMAHYAAOU-YNEHKIRRSA-N 1 1 215.356 3.635 20 0 BHADMO CC[C@H](F)C[N@@H+](C)C1CCC(CC)CC1 ZINC000440776499 387694335 /nfs/dbraw/zinc/69/43/35/387694335.db2.gz CKKPRKDUWHISQX-CPCZMJQVSA-N 1 1 215.356 3.635 20 0 BHADMO CC[C@@H](F)C[N@@H+](C)C1CCC(CC)CC1 ZINC000440776501 387694662 /nfs/dbraw/zinc/69/46/62/387694662.db2.gz CKKPRKDUWHISQX-OTTFEQOBSA-N 1 1 215.356 3.635 20 0 BHADMO CC[C@H](F)C[N@@H+](C1CC1)[C@H]1CCc2ccccc21 ZINC000440778194 387692651 /nfs/dbraw/zinc/69/26/51/387692651.db2.gz AQFZUEQKXJOKEV-BBRMVZONSA-N 1 1 247.357 3.886 20 0 BHADMO CC[C@@H](F)C[N@@H+](C1CC1)[C@H]1CCc2ccccc21 ZINC000440778195 201516839 /nfs/dbraw/zinc/51/68/39/201516839.db2.gz AQFZUEQKXJOKEV-CJNGLKHVSA-N 1 1 247.357 3.886 20 0 BHADMO CC[C@@H](F)C[N@@H+](C1CC1)[C@@H]1CCc2ccccc21 ZINC000440778196 387693583 /nfs/dbraw/zinc/69/35/83/387693583.db2.gz AQFZUEQKXJOKEV-CZUORRHYSA-N 1 1 247.357 3.886 20 0 BHADMO CC[C@H](F)C[N@@H+](C1CC1)[C@@H]1CCc2ccccc21 ZINC000440778197 387694313 /nfs/dbraw/zinc/69/43/13/387694313.db2.gz AQFZUEQKXJOKEV-XJKSGUPXSA-N 1 1 247.357 3.886 20 0 BHADMO CCc1ccc([C@@H]2CCC[N@@H+]2C[C@@H](F)CC)o1 ZINC000440779150 387697548 /nfs/dbraw/zinc/69/75/48/387697548.db2.gz DDXGRESQIGQPPK-AAEUAGOBSA-N 1 1 239.334 3.727 20 0 BHADMO CCc1ccc([C@H]2CCC[N@@H+]2C[C@H](F)CC)o1 ZINC000440779152 387697408 /nfs/dbraw/zinc/69/74/08/387697408.db2.gz DDXGRESQIGQPPK-DGCLKSJQSA-N 1 1 239.334 3.727 20 0 BHADMO CCc1ccc([C@H]2CCC[N@@H+]2C[C@@H](F)CC)o1 ZINC000440779153 387696792 /nfs/dbraw/zinc/69/67/92/387696792.db2.gz DDXGRESQIGQPPK-WCQYABFASA-N 1 1 239.334 3.727 20 0 BHADMO CCc1ccc([C@@H]2CCC[N@@H+]2C[C@H](F)CC)o1 ZINC000440779155 387696703 /nfs/dbraw/zinc/69/67/03/387696703.db2.gz DDXGRESQIGQPPK-YPMHNXCESA-N 1 1 239.334 3.727 20 0 BHADMO CC[C@@H](F)C[N@@H+](C)[C@@H](C)Cc1ccc(C)cc1 ZINC000440780034 387696638 /nfs/dbraw/zinc/69/66/38/387696638.db2.gz OYOBKYKIGQDLKG-DZGCQCFKSA-N 1 1 237.362 3.606 20 0 BHADMO CC[C@H](F)C[N@@H+](C)[C@H](C)Cc1ccc(C)cc1 ZINC000440780036 387696776 /nfs/dbraw/zinc/69/67/76/387696776.db2.gz OYOBKYKIGQDLKG-HIFRSBDPSA-N 1 1 237.362 3.606 20 0 BHADMO CC[C@@H](F)C[N@@H+](C)[C@H](C)Cc1ccc(C)cc1 ZINC000440780037 387697470 /nfs/dbraw/zinc/69/74/70/387697470.db2.gz OYOBKYKIGQDLKG-UKRRQHHQSA-N 1 1 237.362 3.606 20 0 BHADMO CC[C@H](F)C[N@@H+](C)[C@@H](C)Cc1ccc(C)cc1 ZINC000440780039 387695374 /nfs/dbraw/zinc/69/53/74/387695374.db2.gz OYOBKYKIGQDLKG-ZFWWWQNUSA-N 1 1 237.362 3.606 20 0 BHADMO CC[C@H](F)C[N@@H+](C)Cc1ccc(Cl)c(F)c1 ZINC000440782166 386156033 /nfs/dbraw/zinc/15/60/33/386156033.db2.gz DAJKSTBQLKJBFD-JTQLQIEISA-N 1 1 247.716 3.659 20 0 BHADMO CC[C@H](F)C[N@H+](C)Cc1ccc(Cl)c(F)c1 ZINC000440782166 386156026 /nfs/dbraw/zinc/15/60/26/386156026.db2.gz DAJKSTBQLKJBFD-JTQLQIEISA-N 1 1 247.716 3.659 20 0 BHADMO CC[C@@H](F)C[N@@H+](C)Cc1ccc(Cl)c(F)c1 ZINC000440782168 386156257 /nfs/dbraw/zinc/15/62/57/386156257.db2.gz DAJKSTBQLKJBFD-SNVBAGLBSA-N 1 1 247.716 3.659 20 0 BHADMO CC[C@@H](F)C[N@H+](C)Cc1ccc(Cl)c(F)c1 ZINC000440782168 386156254 /nfs/dbraw/zinc/15/62/54/386156254.db2.gz DAJKSTBQLKJBFD-SNVBAGLBSA-N 1 1 247.716 3.659 20 0 BHADMO CC[C@H](F)C[N@H+]1CC[C@@H](c2ccccc2)[C@@H]1C ZINC000440782198 386157564 /nfs/dbraw/zinc/15/75/64/386157564.db2.gz NHVPIQKYJDZILK-AEGPPILISA-N 1 1 235.346 3.613 20 0 BHADMO CC[C@H](F)C[N@H+]1CC[C@H](c2ccccc2)[C@@H]1C ZINC000440782199 386156175 /nfs/dbraw/zinc/15/61/75/386156175.db2.gz NHVPIQKYJDZILK-QEJZJMRPSA-N 1 1 235.346 3.613 20 0 BHADMO CC[C@H](F)C[N@H+]1CC[C@H](c2ccccc2)[C@H]1C ZINC000440782202 386156655 /nfs/dbraw/zinc/15/66/55/386156655.db2.gz NHVPIQKYJDZILK-SNPRPXQTSA-N 1 1 235.346 3.613 20 0 BHADMO CC[C@H](F)C[N@H+]1CC[C@@H](c2ccccc2)[C@H]1C ZINC000440782205 386157269 /nfs/dbraw/zinc/15/72/69/386157269.db2.gz NHVPIQKYJDZILK-VHDGCEQUSA-N 1 1 235.346 3.613 20 0 BHADMO CC[C@@H](F)C[N@@H+](C(C)C)C1CCCCC1 ZINC000440784018 387695472 /nfs/dbraw/zinc/69/54/72/387695472.db2.gz ZHQSMBIYWKUBSL-GFCCVEGCSA-N 1 1 215.356 3.778 20 0 BHADMO CC[C@H](F)C[N@@H+](C(C)C)C1CCCCC1 ZINC000440784019 387686422 /nfs/dbraw/zinc/68/64/22/387686422.db2.gz ZHQSMBIYWKUBSL-LBPRGKRZSA-N 1 1 215.356 3.778 20 0 BHADMO CC[C@H](F)C[N@@H+](CC)[C@@H](C)c1cccc(O)c1 ZINC000440784843 387697214 /nfs/dbraw/zinc/69/72/14/387697214.db2.gz JAYVZEBNQGGCBA-AAEUAGOBSA-N 1 1 239.334 3.523 20 0 BHADMO CC[C@@H](F)C[N@@H+](CC)[C@H](C)c1cccc(O)c1 ZINC000440784844 387697237 /nfs/dbraw/zinc/69/72/37/387697237.db2.gz JAYVZEBNQGGCBA-DGCLKSJQSA-N 1 1 239.334 3.523 20 0 BHADMO CC[C@@H](F)C[N@@H+](CC)[C@@H](C)c1cccc(O)c1 ZINC000440784845 387697123 /nfs/dbraw/zinc/69/71/23/387697123.db2.gz JAYVZEBNQGGCBA-WCQYABFASA-N 1 1 239.334 3.523 20 0 BHADMO CC[C@H](F)C[N@@H+](CC)[C@H](C)c1cccc(O)c1 ZINC000440784846 387695607 /nfs/dbraw/zinc/69/56/07/387695607.db2.gz JAYVZEBNQGGCBA-YPMHNXCESA-N 1 1 239.334 3.523 20 0 BHADMO CC[C@@H](F)C[N@@H+](C)[C@@H](CC)Cc1ccccc1 ZINC000440785930 387697008 /nfs/dbraw/zinc/69/70/08/387697008.db2.gz RJVIBNMTVWLUCR-CABCVRRESA-N 1 1 237.362 3.688 20 0 BHADMO CC[C@H](F)C[N@@H+](C)[C@@H](CC)Cc1ccccc1 ZINC000440785932 387697528 /nfs/dbraw/zinc/69/75/28/387697528.db2.gz RJVIBNMTVWLUCR-GJZGRUSLSA-N 1 1 237.362 3.688 20 0 BHADMO CC[C@@H](F)C[N@@H+](C)[C@H](CC)Cc1ccccc1 ZINC000440785933 387695655 /nfs/dbraw/zinc/69/56/55/387695655.db2.gz RJVIBNMTVWLUCR-HUUCEWRRSA-N 1 1 237.362 3.688 20 0 BHADMO CC[C@H](Cc1ccccc1)[N@H+](C)C[C@@H](F)CC ZINC000440785935 387696581 /nfs/dbraw/zinc/69/65/81/387696581.db2.gz RJVIBNMTVWLUCR-LSDHHAIUSA-N 1 1 237.362 3.688 20 0 BHADMO CC[C@@H](F)C[N@@H+]([C@H](C)c1ccco1)C1CC1 ZINC000440789623 387700594 /nfs/dbraw/zinc/70/05/94/387700594.db2.gz BKMAPPQAPMRNSL-GHMZBOCLSA-N 1 1 225.307 3.553 20 0 BHADMO CC[C@@H](F)C[N@H+]([C@H](C)c1ccco1)C1CC1 ZINC000440789623 387700590 /nfs/dbraw/zinc/70/05/90/387700590.db2.gz BKMAPPQAPMRNSL-GHMZBOCLSA-N 1 1 225.307 3.553 20 0 BHADMO CC[C@H](F)C[N@@H+]([C@H](C)c1ccco1)C1CC1 ZINC000440789624 387699115 /nfs/dbraw/zinc/69/91/15/387699115.db2.gz BKMAPPQAPMRNSL-MNOVXSKESA-N 1 1 225.307 3.553 20 0 BHADMO CC[C@H](F)C[N@H+]([C@H](C)c1ccco1)C1CC1 ZINC000440789624 387699111 /nfs/dbraw/zinc/69/91/11/387699111.db2.gz BKMAPPQAPMRNSL-MNOVXSKESA-N 1 1 225.307 3.553 20 0 BHADMO CC[C@H](F)C[N@@H+]([C@@H](C)c1ccco1)C1CC1 ZINC000440789625 387699341 /nfs/dbraw/zinc/69/93/41/387699341.db2.gz BKMAPPQAPMRNSL-QWRGUYRKSA-N 1 1 225.307 3.553 20 0 BHADMO CC[C@H](F)C[N@H+]([C@@H](C)c1ccco1)C1CC1 ZINC000440789625 387699335 /nfs/dbraw/zinc/69/93/35/387699335.db2.gz BKMAPPQAPMRNSL-QWRGUYRKSA-N 1 1 225.307 3.553 20 0 BHADMO CC[C@@H](F)C[N@@H+]([C@@H](C)c1ccco1)C1CC1 ZINC000440789626 387700718 /nfs/dbraw/zinc/70/07/18/387700718.db2.gz BKMAPPQAPMRNSL-WDEREUQCSA-N 1 1 225.307 3.553 20 0 BHADMO CC[C@@H](F)C[N@H+]([C@@H](C)c1ccco1)C1CC1 ZINC000440789626 387700714 /nfs/dbraw/zinc/70/07/14/387700714.db2.gz BKMAPPQAPMRNSL-WDEREUQCSA-N 1 1 225.307 3.553 20 0 BHADMO CC[C@@H](F)C[N@@H+](C)Cc1cc2ccccc2o1 ZINC000440792031 387698911 /nfs/dbraw/zinc/69/89/11/387698911.db2.gz KLWGRKKTVNTHJA-GFCCVEGCSA-N 1 1 235.302 3.613 20 0 BHADMO CC[C@H](F)C[N@@H+](C)Cc1cc2ccccc2o1 ZINC000440792032 387700468 /nfs/dbraw/zinc/70/04/68/387700468.db2.gz KLWGRKKTVNTHJA-LBPRGKRZSA-N 1 1 235.302 3.613 20 0 BHADMO CC[C@@H](F)C[N@H+]1CCCC[C@@H]1c1ccc(C)o1 ZINC000440794851 387702929 /nfs/dbraw/zinc/70/29/29/387702929.db2.gz CPYCCRJVNGDXOP-CHWSQXEVSA-N 1 1 239.334 3.863 20 0 BHADMO CC[C@@H](F)C[N@H+]1CCCC[C@H]1c1ccc(C)o1 ZINC000440794852 387701150 /nfs/dbraw/zinc/70/11/50/387701150.db2.gz CPYCCRJVNGDXOP-OLZOCXBDSA-N 1 1 239.334 3.863 20 0 BHADMO CC[C@H](F)C[N@H+]1CCCC[C@@H]1c1ccc(C)o1 ZINC000440794853 387702413 /nfs/dbraw/zinc/70/24/13/387702413.db2.gz CPYCCRJVNGDXOP-QWHCGFSZSA-N 1 1 239.334 3.863 20 0 BHADMO CC[C@H](F)C[N@H+]1CCCC[C@H]1c1ccc(C)o1 ZINC000440794854 387702392 /nfs/dbraw/zinc/70/23/92/387702392.db2.gz CPYCCRJVNGDXOP-STQMWFEESA-N 1 1 239.334 3.863 20 0 BHADMO CC[C@H](F)C[N@H+]1CC[C@@H](C)C[C@H]1c1ccco1 ZINC000440796901 387702184 /nfs/dbraw/zinc/70/21/84/387702184.db2.gz XRZHQUCAOFHVEX-AGIUHOORSA-N 1 1 239.334 3.801 20 0 BHADMO CC[C@H](F)C[N@H+]1CC[C@H](C)C[C@H]1c1ccco1 ZINC000440796902 387701551 /nfs/dbraw/zinc/70/15/51/387701551.db2.gz XRZHQUCAOFHVEX-AVGNSLFASA-N 1 1 239.334 3.801 20 0 BHADMO CC[C@H](F)C[N@H+]1CC[C@@H](C)C[C@@H]1c1ccco1 ZINC000440796903 387701566 /nfs/dbraw/zinc/70/15/66/387701566.db2.gz XRZHQUCAOFHVEX-FRRDWIJNSA-N 1 1 239.334 3.801 20 0 BHADMO CC[C@H](F)C[N@H+]1CC[C@H](C)C[C@@H]1c1ccco1 ZINC000440796904 387703741 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JORZEMYAOVTGSH-UHFFFAOYSA-N 1 1 209.333 3.538 20 0 BHADMO CC(C)[N@H+](Cc1cccc(F)c1)CC1CCC1 ZINC000441229941 387736974 /nfs/dbraw/zinc/73/69/74/387736974.db2.gz KRHYYAMWGBHMRG-UHFFFAOYSA-N 1 1 235.346 3.836 20 0 BHADMO Cc1ccc(C[N@H+](CC2CCC2)C(C)C)o1 ZINC000441230408 387737231 /nfs/dbraw/zinc/73/72/31/387737231.db2.gz QDBOUCIIWZYNTI-UHFFFAOYSA-N 1 1 221.344 3.599 20 0 BHADMO CCC(C)(C)CC[N@@H+](C)C1Cc2ccccc2C1 ZINC000441231258 201544335 /nfs/dbraw/zinc/54/43/35/201544335.db2.gz KQKAMTBDHYJPGZ-UHFFFAOYSA-N 1 1 245.410 3.912 20 0 BHADMO Fc1cccc(C[C@@H]2CCC[N@H+]2CC2CCC2)c1 ZINC000441231367 387739266 /nfs/dbraw/zinc/73/92/66/387739266.db2.gz WLFTWWFNQOJBQS-INIZCTEOSA-N 1 1 247.357 3.633 20 0 BHADMO Fc1cccc(C[C@H]2CCC[N@H+]2CC2CCC2)c1 ZINC000441231369 387738258 /nfs/dbraw/zinc/73/82/58/387738258.db2.gz WLFTWWFNQOJBQS-MRXNPFEDSA-N 1 1 247.357 3.633 20 0 BHADMO c1coc(C[N@H+](CC2CCC2)C2CCCC2)c1 ZINC000441232836 387737462 /nfs/dbraw/zinc/73/74/62/387737462.db2.gz OHTIHIJSUQRJKD-UHFFFAOYSA-N 1 1 233.355 3.824 20 0 BHADMO C[N@@H+](CCCCc1ccccc1)CC1CCC1 ZINC000441240347 201543494 /nfs/dbraw/zinc/54/34/94/201543494.db2.gz QQCZHAKQMIMHJA-UHFFFAOYSA-N 1 1 231.383 3.741 20 0 BHADMO Cc1ccccc1[C@@H]1CCC[N@H+]1CCC1CC1 ZINC000441241093 387741199 /nfs/dbraw/zinc/74/11/99/387741199.db2.gz YFKMPQDONVJEFX-INIZCTEOSA-N 1 1 229.367 3.932 20 0 BHADMO Cc1ccccc1[C@H]1CCC[N@H+]1CCC1CC1 ZINC000441241097 387742278 /nfs/dbraw/zinc/74/22/78/387742278.db2.gz YFKMPQDONVJEFX-MRXNPFEDSA-N 1 1 229.367 3.932 20 0 BHADMO c1csc([C@H]2CCC[N@@H+]2CC2CCC2)c1 ZINC000441241513 387740566 /nfs/dbraw/zinc/74/05/66/387740566.db2.gz SQCLUEBHTSNGEM-GFCCVEGCSA-N 1 1 221.369 3.685 20 0 BHADMO c1csc([C@@H]2CCC[N@@H+]2CC2CCC2)c1 ZINC000441241514 387739975 /nfs/dbraw/zinc/73/99/75/387739975.db2.gz SQCLUEBHTSNGEM-LBPRGKRZSA-N 1 1 221.369 3.685 20 0 BHADMO CCC(C)(C)CC[N@@H+](C)Cc1ccco1 ZINC000441241530 387741749 /nfs/dbraw/zinc/74/17/49/387741749.db2.gz DIFGPNGQGDOZQZ-UHFFFAOYSA-N 1 1 209.333 3.538 20 0 BHADMO CCC(C)(C)CC[N@@H+](C)Cc1cnc(C)s1 ZINC000441241971 387740610 /nfs/dbraw/zinc/74/06/10/387740610.db2.gz ZIPVFQDKNNFYOY-UHFFFAOYSA-N 1 1 240.416 3.710 20 0 BHADMO C[N@@H+](CCCCc1ccccc1)CCC1CC1 ZINC000441242523 387740345 /nfs/dbraw/zinc/74/03/45/387740345.db2.gz UXCNPTIUZJTUPQ-UHFFFAOYSA-N 1 1 231.383 3.741 20 0 BHADMO C[N@H+](CCc1ccccc1Cl)CCC1CC1 ZINC000441242891 387741367 /nfs/dbraw/zinc/74/13/67/387741367.db2.gz VWGCFNGJCJIFEG-UHFFFAOYSA-N 1 1 237.774 3.614 20 0 BHADMO CCC[N@@H+](CCC1CC1)Cc1ccccc1 ZINC000441243108 387741978 /nfs/dbraw/zinc/74/19/78/387741978.db2.gz HANXVGDXTACTKV-UHFFFAOYSA-N 1 1 217.356 3.699 20 0 BHADMO Fc1ccc(C[N@@H+](CC2CCC2)C2CC2)cc1 ZINC000441245041 387740927 /nfs/dbraw/zinc/74/09/27/387740927.db2.gz LMENQURYFJOSSW-UHFFFAOYSA-N 1 1 233.330 3.590 20 0 BHADMO CCC[N@@H+](CCC(C)(C)CC)CC1CC1 ZINC000441246147 387742605 /nfs/dbraw/zinc/74/26/05/387742605.db2.gz OJRKLGJDNKGQKU-UHFFFAOYSA-N 1 1 211.393 3.935 20 0 BHADMO Fc1ccc(C2=CC[N@@H+](CC3CCC3)CC2)cc1 ZINC000441248996 387741864 /nfs/dbraw/zinc/74/18/64/387741864.db2.gz XJVWOFZDRLORIH-UHFFFAOYSA-N 1 1 245.341 3.715 20 0 BHADMO C[N@@H+](CCC1CC1)[C@H]1CCc2ccc(F)cc21 ZINC000441252123 387742627 /nfs/dbraw/zinc/74/26/27/387742627.db2.gz FBWNGGOGNYJYEY-HNNXBMFYSA-N 1 1 233.330 3.545 20 0 BHADMO C[N@@H+](CCC1CC1)[C@@H]1CCc2ccc(F)cc21 ZINC000441252124 387742396 /nfs/dbraw/zinc/74/23/96/387742396.db2.gz FBWNGGOGNYJYEY-OAHLLOKOSA-N 1 1 233.330 3.545 20 0 BHADMO COc1cccc([C@@H]2CCC[N@H+]2CC2CCC2)c1 ZINC000441252712 387740880 /nfs/dbraw/zinc/74/08/80/387740880.db2.gz WOQGFNATIVVYJJ-INIZCTEOSA-N 1 1 245.366 3.632 20 0 BHADMO COc1cccc([C@H]2CCC[N@H+]2CC2CCC2)c1 ZINC000441252713 387742563 /nfs/dbraw/zinc/74/25/63/387742563.db2.gz WOQGFNATIVVYJJ-MRXNPFEDSA-N 1 1 245.366 3.632 20 0 BHADMO Fc1ccccc1C[N@@H+](CC1CCC1)C1CC1 ZINC000441254551 386447279 /nfs/dbraw/zinc/44/72/79/386447279.db2.gz MSBFAWBNWQHZRH-UHFFFAOYSA-N 1 1 233.330 3.590 20 0 BHADMO Fc1ccc([C@@H]2CCC[N@H+]2CC2CCC2)cc1 ZINC000441257766 387742236 /nfs/dbraw/zinc/74/22/36/387742236.db2.gz PGBFQODTPKOBQK-HNNXBMFYSA-N 1 1 233.330 3.763 20 0 BHADMO Fc1ccc([C@H]2CCC[N@H+]2CC2CCC2)cc1 ZINC000441257768 387742552 /nfs/dbraw/zinc/74/25/52/387742552.db2.gz PGBFQODTPKOBQK-OAHLLOKOSA-N 1 1 233.330 3.763 20 0 BHADMO Cc1ccc([C@@H]2CCC[N@H+]2CC2CCC2)cc1 ZINC000441260417 387742220 /nfs/dbraw/zinc/74/22/20/387742220.db2.gz SSRUWZACLPJQGV-INIZCTEOSA-N 1 1 229.367 3.932 20 0 BHADMO Cc1ccc([C@H]2CCC[N@H+]2CC2CCC2)cc1 ZINC000441260419 387742479 /nfs/dbraw/zinc/74/24/79/387742479.db2.gz SSRUWZACLPJQGV-MRXNPFEDSA-N 1 1 229.367 3.932 20 0 BHADMO CCC(C)(C)CC[N@H+]1CCc2sccc2C1 ZINC000441262503 387742114 /nfs/dbraw/zinc/74/21/14/387742114.db2.gz IPNFZFYZIIAAQY-UHFFFAOYSA-N 1 1 237.412 3.933 20 0 BHADMO CCC(C)(C)CC[N@H+]1CCn2cccc2[C@H]1C ZINC000441263896 387742508 /nfs/dbraw/zinc/74/25/08/387742508.db2.gz RFYZPNJFECCKDG-CYBMUJFWSA-N 1 1 234.387 3.691 20 0 BHADMO CCC(C)(C)CC[N@H+]1CCn2cccc2[C@@H]1C ZINC000441263897 387741604 /nfs/dbraw/zinc/74/16/04/387741604.db2.gz RFYZPNJFECCKDG-ZDUSSCGKSA-N 1 1 234.387 3.691 20 0 BHADMO Cc1cccc([C@@H](C)[N@@H+](C)CCC2CC2)c1 ZINC000441264488 387742093 /nfs/dbraw/zinc/74/20/93/387742093.db2.gz QRVGASGMCHYFTJ-CYBMUJFWSA-N 1 1 217.356 3.788 20 0 BHADMO Cc1cccc([C@H](C)[N@@H+](C)CCC2CC2)c1 ZINC000441264490 387741626 /nfs/dbraw/zinc/74/16/26/387741626.db2.gz QRVGASGMCHYFTJ-ZDUSSCGKSA-N 1 1 217.356 3.788 20 0 BHADMO Cc1ccc([C@@H]2CCC[N@H+]2CCC2CC2)cc1 ZINC000441265450 387740320 /nfs/dbraw/zinc/74/03/20/387740320.db2.gz ZBVUYSCPLDDBNJ-INIZCTEOSA-N 1 1 229.367 3.932 20 0 BHADMO Cc1ccc([C@H]2CCC[N@H+]2CCC2CC2)cc1 ZINC000441265451 387740047 /nfs/dbraw/zinc/74/00/47/387740047.db2.gz ZBVUYSCPLDDBNJ-MRXNPFEDSA-N 1 1 229.367 3.932 20 0 BHADMO CC(C)[N@H+](Cc1ccc(F)cc1)CC1CCC1 ZINC000441270635 387740662 /nfs/dbraw/zinc/74/06/62/387740662.db2.gz OXUDGFQCFDFRJL-UHFFFAOYSA-N 1 1 235.346 3.836 20 0 BHADMO CC[N@@H+](CCC1CC1)Cc1ccc(Cl)cc1 ZINC000441275110 201543182 /nfs/dbraw/zinc/54/31/82/201543182.db2.gz GNUIVOJDPNIVPO-UHFFFAOYSA-N 1 1 237.774 3.962 20 0 BHADMO CCC[N@H+](Cc1ccccc1N(C)C)CC(C)C ZINC000441275666 387742290 /nfs/dbraw/zinc/74/22/90/387742290.db2.gz IBJKJHGRDGJSKO-UHFFFAOYSA-N 1 1 248.414 3.621 20 0 BHADMO Cc1ccccc1C[N@@H+](CCC1CC1)C1CC1 ZINC000441277695 387740376 /nfs/dbraw/zinc/74/03/76/387740376.db2.gz NYEDTVSDJXMYTR-UHFFFAOYSA-N 1 1 229.367 3.760 20 0 BHADMO CC(C)[N@H+](Cc1ccccc1F)CC1CCC1 ZINC000441278066 387741069 /nfs/dbraw/zinc/74/10/69/387741069.db2.gz QMZJDCORPQPUKH-UHFFFAOYSA-N 1 1 235.346 3.836 20 0 BHADMO CC[N@H+](Cc1ccc(C)cc1)CC1CCC1 ZINC000441279087 387742314 /nfs/dbraw/zinc/74/23/14/387742314.db2.gz OLJUKJCPKFBMLW-UHFFFAOYSA-N 1 1 217.356 3.617 20 0 BHADMO CC[N@H+](Cc1ccc(Cl)cc1)CC1CCC1 ZINC000441279872 387742367 /nfs/dbraw/zinc/74/23/67/387742367.db2.gz RLBAGTNWCRLOCT-UHFFFAOYSA-N 1 1 237.774 3.962 20 0 BHADMO Cc1ccccc1C[N@@H+](CC1CCC1)C1CC1 ZINC000441280674 387742071 /nfs/dbraw/zinc/74/20/71/387742071.db2.gz SOJPSADJDOCWPK-UHFFFAOYSA-N 1 1 229.367 3.760 20 0 BHADMO CCC[N@@H+](CCC1CC1)Cc1ccc(F)cc1 ZINC000441280825 201544017 /nfs/dbraw/zinc/54/40/17/201544017.db2.gz FMUSRRFTSJCHGB-UHFFFAOYSA-N 1 1 235.346 3.838 20 0 BHADMO CC[N@@H+](CCC1CC1)Cc1ccc(C)cc1C ZINC000441280996 387740243 /nfs/dbraw/zinc/74/02/43/387740243.db2.gz VYSWXQJFCSBTMB-UHFFFAOYSA-N 1 1 231.383 3.925 20 0 BHADMO COc1ccc(C[N@@H+](CC2CCC2)C(C)C)cc1 ZINC000441281201 387745182 /nfs/dbraw/zinc/74/51/82/387745182.db2.gz RQOUEUBDWLHEIU-UHFFFAOYSA-N 1 1 247.382 3.706 20 0 BHADMO CC[N@H+](Cc1ccc(C)cc1C)CC1CCC1 ZINC000441281669 387745083 /nfs/dbraw/zinc/74/50/83/387745083.db2.gz WTKYCFMCLRUMGY-UHFFFAOYSA-N 1 1 231.383 3.925 20 0 BHADMO CC[N@@H+](CCC1CC1)Cc1ccc(C)cc1 ZINC000441283378 387744694 /nfs/dbraw/zinc/74/46/94/387744694.db2.gz IPXBALAREQNOTF-UHFFFAOYSA-N 1 1 217.356 3.617 20 0 BHADMO CC(C)[N@@H+](CCc1ccccc1)CC1CCC1 ZINC000441284565 201546420 /nfs/dbraw/zinc/54/64/20/201546420.db2.gz KMGYOAUYZATLGJ-UHFFFAOYSA-N 1 1 231.383 3.740 20 0 BHADMO CCC[N@H+](Cc1ccc(F)cc1)CC1CCC1 ZINC000441284630 387743194 /nfs/dbraw/zinc/74/31/94/387743194.db2.gz KGYQTUFTAXKKPD-UHFFFAOYSA-N 1 1 235.346 3.838 20 0 BHADMO CCC(C)(C)CC[N@@H+](C)Cc1csc(C)n1 ZINC000441286897 386457318 /nfs/dbraw/zinc/45/73/18/386457318.db2.gz PILSMQXODGUWKM-UHFFFAOYSA-N 1 1 240.416 3.710 20 0 BHADMO COc1cccc(C[N@@H+](CC2CCC2)C(C)C)c1 ZINC000441287174 386459548 /nfs/dbraw/zinc/45/95/48/386459548.db2.gz POCQCEACOGSYGJ-UHFFFAOYSA-N 1 1 247.382 3.706 20 0 BHADMO COc1ccccc1C[N@@H+](CC1CCC1)C(C)C ZINC000441289053 387743432 /nfs/dbraw/zinc/74/34/32/387743432.db2.gz RVEKLCMVYKLWEJ-UHFFFAOYSA-N 1 1 247.382 3.706 20 0 BHADMO CCC(C)(C)CC[N@@H+](CCCO)CC(C)(C)C ZINC000441315243 387743765 /nfs/dbraw/zinc/74/37/65/387743765.db2.gz OASFXBQPBPJFQC-UHFFFAOYSA-N 1 1 243.435 3.543 20 0 BHADMO c1ccc(C[C@@H]2CCC[N@H+](CC3CCC3)C2)cc1 ZINC000441315786 387743457 /nfs/dbraw/zinc/74/34/57/387743457.db2.gz PRMVKLMEGVXEGI-KRWDZBQOSA-N 1 1 243.394 3.741 20 0 BHADMO c1ccc(C[C@H]2CCC[N@H+](CC3CCC3)C2)cc1 ZINC000441315787 387745117 /nfs/dbraw/zinc/74/51/17/387745117.db2.gz PRMVKLMEGVXEGI-QGZVFWFLSA-N 1 1 243.394 3.741 20 0 BHADMO c1ccc(C[C@@H]2CCC[N@H+](CCC3CC3)C2)cc1 ZINC000441316967 387745431 /nfs/dbraw/zinc/74/54/31/387745431.db2.gz VMQOICARKNONQL-KRWDZBQOSA-N 1 1 243.394 3.741 20 0 BHADMO c1ccc(C[C@H]2CCC[N@H+](CCC3CC3)C2)cc1 ZINC000441316968 387743626 /nfs/dbraw/zinc/74/36/26/387743626.db2.gz VMQOICARKNONQL-QGZVFWFLSA-N 1 1 243.394 3.741 20 0 BHADMO C[N@@H+](CCCc1ccc(Cl)cc1)C1CCC1 ZINC000441322034 398210217 /nfs/dbraw/zinc/21/02/17/398210217.db2.gz ICFLVDRSZZKYPE-UHFFFAOYSA-N 1 1 237.774 3.757 20 0 BHADMO CCC(C)(C)CC[N@@H+](C)Cc1scnc1C ZINC000441323701 386466199 /nfs/dbraw/zinc/46/61/99/386466199.db2.gz LGSCBSKBEAAQLQ-UHFFFAOYSA-N 1 1 240.416 3.710 20 0 BHADMO CCC[N@@H+](C)CC(C)(C)c1ccc(C)cc1 ZINC000441325110 387748394 /nfs/dbraw/zinc/74/83/94/387748394.db2.gz PKIIICVHKMNKAO-UHFFFAOYSA-N 1 1 219.372 3.614 20 0 BHADMO C[N@@H+](Cc1ccc(C(C)(C)C)cc1)C1CCC1 ZINC000441330725 387746857 /nfs/dbraw/zinc/74/68/57/387746857.db2.gz MJBIQXQCAJPKKN-UHFFFAOYSA-N 1 1 231.383 3.968 20 0 BHADMO CC[C@@H](Cc1ccc(C)cc1)[N@@H+](C)CC(C)C ZINC000441332981 387747228 /nfs/dbraw/zinc/74/72/28/387747228.db2.gz RMLITNIEWGMUTP-INIZCTEOSA-N 1 1 233.399 3.904 20 0 BHADMO CC[C@H](Cc1ccc(C)cc1)[N@@H+](C)CC(C)C ZINC000441332982 387747814 /nfs/dbraw/zinc/74/78/14/387747814.db2.gz RMLITNIEWGMUTP-MRXNPFEDSA-N 1 1 233.399 3.904 20 0 BHADMO CCC[N@H+]1C[C@H](C)C[C@@H]1c1cccc(F)c1 ZINC000441338923 387748109 /nfs/dbraw/zinc/74/81/09/387748109.db2.gz LZHOEKQYVYWZPP-BXUZGUMPSA-N 1 1 221.319 3.619 20 0 BHADMO CCC[N@H+]1C[C@@H](C)C[C@H]1c1cccc(F)c1 ZINC000441338924 387746383 /nfs/dbraw/zinc/74/63/83/387746383.db2.gz LZHOEKQYVYWZPP-FZMZJTMJSA-N 1 1 221.319 3.619 20 0 BHADMO CCC[N@H+]1C[C@H](C)C[C@H]1c1cccc(F)c1 ZINC000441338925 387746069 /nfs/dbraw/zinc/74/60/69/387746069.db2.gz LZHOEKQYVYWZPP-RISCZKNCSA-N 1 1 221.319 3.619 20 0 BHADMO CCC[N@H+]1C[C@@H](C)C[C@@H]1c1cccc(F)c1 ZINC000441338926 387748313 /nfs/dbraw/zinc/74/83/13/387748313.db2.gz LZHOEKQYVYWZPP-SMDDNHRTSA-N 1 1 221.319 3.619 20 0 BHADMO CCCC[C@H](CC)C[N@H+]1CC[C@H](OC)C[C@H]1C ZINC000441342515 387747143 /nfs/dbraw/zinc/74/71/43/387747143.db2.gz SUGKESRMWONTJW-ILXRZTDVSA-N 1 1 241.419 3.702 20 0 BHADMO CCCC[C@H](CC)C[N@H+]1CC[C@H](OC)C[C@@H]1C ZINC000441342516 387748159 /nfs/dbraw/zinc/74/81/59/387748159.db2.gz SUGKESRMWONTJW-KKUMJFAQSA-N 1 1 241.419 3.702 20 0 BHADMO CCCC[C@H](CC)C[N@H+]1CC[C@@H](OC)C[C@H]1C ZINC000441342517 387748268 /nfs/dbraw/zinc/74/82/68/387748268.db2.gz SUGKESRMWONTJW-QLFBSQMISA-N 1 1 241.419 3.702 20 0 BHADMO CCCC[C@H](CC)C[N@H+]1CC[C@@H](OC)C[C@@H]1C ZINC000441342518 387747319 /nfs/dbraw/zinc/74/73/19/387747319.db2.gz SUGKESRMWONTJW-SOUVJXGZSA-N 1 1 241.419 3.702 20 0 BHADMO CC[N@@H+](C)[C@H]1CCC[C@@H]1c1ccc(C)cc1 ZINC000441344332 387746671 /nfs/dbraw/zinc/74/66/71/387746671.db2.gz DVBFZEQVVBBCBG-CABCVRRESA-N 1 1 217.356 3.583 20 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Cc1ccc(C(C)(C)C[N@H+](C)CC(C)C)cc1 ZINC000441361514 387750571 /nfs/dbraw/zinc/75/05/71/387750571.db2.gz UBJUVPFRHZOTTK-UHFFFAOYSA-N 1 1 233.399 3.860 20 0 BHADMO C[N@@H+](CCc1ccc2ccccc2c1)C1CCC1 ZINC000441369186 387754439 /nfs/dbraw/zinc/75/44/39/387754439.db2.gz CVMYWSMRIBHIBG-UHFFFAOYSA-N 1 1 239.362 3.867 20 0 BHADMO CC(C)COc1ccccc1C[N@@H+](C)C1CCC1 ZINC000441373456 387752989 /nfs/dbraw/zinc/75/29/89/387752989.db2.gz RZRFDKBSNYMDSN-UHFFFAOYSA-N 1 1 247.382 3.706 20 0 BHADMO CCC[N@@H+](C)[C@H]1CCC[C@@H]1c1ccc(C)cc1 ZINC000441374579 387754262 /nfs/dbraw/zinc/75/42/62/387754262.db2.gz WEQLFQPMHXJPEW-CVEARBPZSA-N 1 1 231.383 3.973 20 0 BHADMO CCC[N@@H+](C)[C@H]1CCC[C@H]1c1ccc(C)cc1 ZINC000441374580 387753875 /nfs/dbraw/zinc/75/38/75/387753875.db2.gz WEQLFQPMHXJPEW-HOTGVXAUSA-N 1 1 231.383 3.973 20 0 BHADMO CCC[N@@H+](C)[C@@H]1CCC[C@@H]1c1ccc(C)cc1 ZINC000441374581 387752748 /nfs/dbraw/zinc/75/27/48/387752748.db2.gz WEQLFQPMHXJPEW-HZPDHXFCSA-N 1 1 231.383 3.973 20 0 BHADMO CCC[N@@H+](C)[C@@H]1CCC[C@H]1c1ccc(C)cc1 ZINC000441374582 387753818 /nfs/dbraw/zinc/75/38/18/387753818.db2.gz WEQLFQPMHXJPEW-JKSUJKDBSA-N 1 1 231.383 3.973 20 0 BHADMO Cc1cccc(C)c1OCCC[N@H+](C)C1CCC1 ZINC000441375486 386488230 /nfs/dbraw/zinc/48/82/30/386488230.db2.gz JARWLXLORYTSQI-UHFFFAOYSA-N 1 1 247.382 3.557 20 0 BHADMO CCCC[N@@H+](CCOC)CCC(C)(C)CC ZINC000441376598 387755187 /nfs/dbraw/zinc/75/51/87/387755187.db2.gz KPJIAHBCAYPWOQ-UHFFFAOYSA-N 1 1 229.408 3.561 20 0 BHADMO Cc1ccc(C[C@@H]2CCC[N@H+]2CC2CCC2)cc1 ZINC000441377806 386499282 /nfs/dbraw/zinc/49/92/82/386499282.db2.gz BHACGAJFGDFRIT-KRWDZBQOSA-N 1 1 243.394 3.802 20 0 BHADMO Cc1ccc(C[C@H]2CCC[N@H+]2CC2CCC2)cc1 ZINC000441377810 386498618 /nfs/dbraw/zinc/49/86/18/386498618.db2.gz BHACGAJFGDFRIT-QGZVFWFLSA-N 1 1 243.394 3.802 20 0 BHADMO C1=CC[C@]2(CC1)CCC[N@H+](CC1CCC1)C2 ZINC000441378707 387753529 /nfs/dbraw/zinc/75/35/29/387753529.db2.gz OFBORCJYSFGJTK-HNNXBMFYSA-N 1 1 219.372 3.609 20 0 BHADMO C1=CC[C@@]2(CC1)CCC[N@H+](CC1CCC1)C2 ZINC000441378708 387753011 /nfs/dbraw/zinc/75/30/11/387753011.db2.gz OFBORCJYSFGJTK-OAHLLOKOSA-N 1 1 219.372 3.609 20 0 BHADMO c1coc([C@@H]2CCCCC[N@@H+]2CC2CCC2)c1 ZINC000441380390 387753690 /nfs/dbraw/zinc/75/36/90/387753690.db2.gz FWVATZPGLSZLEO-AWEZNQCLSA-N 1 1 233.355 3.997 20 0 BHADMO c1coc([C@H]2CCCCC[N@@H+]2CC2CCC2)c1 ZINC000441380391 387752763 /nfs/dbraw/zinc/75/27/63/387752763.db2.gz FWVATZPGLSZLEO-CQSZACIVSA-N 1 1 233.355 3.997 20 0 BHADMO Cc1ccccc1C[C@@H]1CCC[N@H+]1CCC1CC1 ZINC000441380794 387752844 /nfs/dbraw/zinc/75/28/44/387752844.db2.gz HKIGXERCGUVXLB-KRWDZBQOSA-N 1 1 243.394 3.802 20 0 BHADMO Cc1ccccc1C[C@H]1CCC[N@H+]1CCC1CC1 ZINC000441380797 387753649 /nfs/dbraw/zinc/75/36/49/387753649.db2.gz HKIGXERCGUVXLB-QGZVFWFLSA-N 1 1 243.394 3.802 20 0 BHADMO C[C@]1(c2ccccc2)CCC[N@@H+](CC2CCC2)C1 ZINC000441384069 386504760 /nfs/dbraw/zinc/50/47/60/386504760.db2.gz MKPUCJMMOWBHKL-KRWDZBQOSA-N 1 1 243.394 3.840 20 0 BHADMO C[C@@]1(c2ccccc2)CCC[N@@H+](CC2CCC2)C1 ZINC000441384070 386502990 /nfs/dbraw/zinc/50/29/90/386502990.db2.gz MKPUCJMMOWBHKL-QGZVFWFLSA-N 1 1 243.394 3.840 20 0 BHADMO C(C[N@H+]1CCCC2(CCCCC2)C1)C1CC1 ZINC000441385457 387752795 /nfs/dbraw/zinc/75/27/95/387752795.db2.gz ZWTLLDUZVGOQFU-UHFFFAOYSA-N 1 1 221.388 3.833 20 0 BHADMO CCC(C)(C)CC[N@@H+](C)C1CCC(OC)CC1 ZINC000441387211 387753962 /nfs/dbraw/zinc/75/39/62/387753962.db2.gz RBRZKIBKNYYWPR-UHFFFAOYSA-N 1 1 241.419 3.702 20 0 BHADMO CCC(C)(C)CC[N@H+]1CCS[C@@H](C)[C@H]1C ZINC000441389515 387757888 /nfs/dbraw/zinc/75/78/88/387757888.db2.gz VIGSEXPRIRFPRP-NEPJUHHUSA-N 1 1 229.433 3.639 20 0 BHADMO CCC(C)(C)CC[N@H+]1CCS[C@H](C)[C@@H]1C ZINC000441389516 387758352 /nfs/dbraw/zinc/75/83/52/387758352.db2.gz VIGSEXPRIRFPRP-NWDGAFQWSA-N 1 1 229.433 3.639 20 0 BHADMO CCC(C)(C)CC[N@H+]1CCS[C@@H](C)[C@@H]1C ZINC000441389518 387756929 /nfs/dbraw/zinc/75/69/29/387756929.db2.gz VIGSEXPRIRFPRP-RYUDHWBXSA-N 1 1 229.433 3.639 20 0 BHADMO CCC(C)(C)CC[N@H+]1CCS[C@H](C)[C@H]1C ZINC000441389519 387756637 /nfs/dbraw/zinc/75/66/37/387756637.db2.gz VIGSEXPRIRFPRP-VXGBXAGGSA-N 1 1 229.433 3.639 20 0 BHADMO Cc1ccc(C[C@@H]2CCC[N@H+]2CCC2CC2)cc1 ZINC000441389897 387756335 /nfs/dbraw/zinc/75/63/35/387756335.db2.gz XRMWJNAPYFKZKV-KRWDZBQOSA-N 1 1 243.394 3.802 20 0 BHADMO Cc1ccc(C[C@H]2CCC[N@H+]2CCC2CC2)cc1 ZINC000441389898 387756208 /nfs/dbraw/zinc/75/62/08/387756208.db2.gz XRMWJNAPYFKZKV-QGZVFWFLSA-N 1 1 243.394 3.802 20 0 BHADMO Cc1ccccc1C[C@@H]1CCC[N@H+]1CC1CCC1 ZINC000441390165 387756812 /nfs/dbraw/zinc/75/68/12/387756812.db2.gz YPVHSRJXNPQENA-KRWDZBQOSA-N 1 1 243.394 3.802 20 0 BHADMO Cc1ccccc1C[C@H]1CCC[N@H+]1CC1CCC1 ZINC000441390166 387756019 /nfs/dbraw/zinc/75/60/19/387756019.db2.gz YPVHSRJXNPQENA-QGZVFWFLSA-N 1 1 243.394 3.802 20 0 BHADMO CCC[N@@H+](CCc1cccc(F)c1)CC1CCC1 ZINC000441392268 387757367 /nfs/dbraw/zinc/75/73/67/387757367.db2.gz BRUSFWAVMJPLHT-UHFFFAOYSA-N 1 1 249.373 3.880 20 0 BHADMO CCOC[C@H]1CCC[N@@H+](CCC(C)(C)CC)C1 ZINC000441392484 387757385 /nfs/dbraw/zinc/75/73/85/387757385.db2.gz CDZCWWMNIQFFCG-AWEZNQCLSA-N 1 1 241.419 3.561 20 0 BHADMO CCOC[C@@H]1CCC[N@@H+](CCC(C)(C)CC)C1 ZINC000441392486 387758108 /nfs/dbraw/zinc/75/81/08/387758108.db2.gz CDZCWWMNIQFFCG-CQSZACIVSA-N 1 1 241.419 3.561 20 0 BHADMO C[C@@H]1C[C@H](c2ccc(F)cc2)C[N@H+]1CC1CCC1 ZINC000441393833 387757760 /nfs/dbraw/zinc/75/77/60/387757760.db2.gz NGFKUDVPNBJYFI-DOMZBBRYSA-N 1 1 247.357 3.804 20 0 BHADMO C[C@@H]1C[C@@H](c2ccc(F)cc2)C[N@H+]1CC1CCC1 ZINC000441393835 387758055 /nfs/dbraw/zinc/75/80/55/387758055.db2.gz NGFKUDVPNBJYFI-IUODEOHRSA-N 1 1 247.357 3.804 20 0 BHADMO C[C@H]1C[C@@H](c2ccc(F)cc2)C[N@H+]1CC1CCC1 ZINC000441393836 387757463 /nfs/dbraw/zinc/75/74/63/387757463.db2.gz NGFKUDVPNBJYFI-SWLSCSKDSA-N 1 1 247.357 3.804 20 0 BHADMO C[C@H]1C[C@H](c2ccc(F)cc2)C[N@H+]1CC1CCC1 ZINC000441393838 387756565 /nfs/dbraw/zinc/75/65/65/387756565.db2.gz NGFKUDVPNBJYFI-WFASDCNBSA-N 1 1 247.357 3.804 20 0 BHADMO Cc1ccc([C@H]2CCC[N@H+]2CC2CCC2)s1 ZINC000441394685 387755872 /nfs/dbraw/zinc/75/58/72/387755872.db2.gz PNXDHQKHQNREST-CYBMUJFWSA-N 1 1 235.396 3.994 20 0 BHADMO Cc1ccc([C@@H]2CCC[N@H+]2CC2CCC2)s1 ZINC000441394687 387756525 /nfs/dbraw/zinc/75/65/25/387756525.db2.gz PNXDHQKHQNREST-ZDUSSCGKSA-N 1 1 235.396 3.994 20 0 BHADMO Fc1ccc(C[N@@H+](CC2CC2)CC2CCC2)cc1 ZINC000441394754 387755916 /nfs/dbraw/zinc/75/59/16/387755916.db2.gz LVRIEZHQECAUQZ-UHFFFAOYSA-N 1 1 247.357 3.838 20 0 BHADMO C[C@H]1C[C@H](c2ccccc2)C[N@H+]1CC1CCC1 ZINC000441394930 387758323 /nfs/dbraw/zinc/75/83/23/387758323.db2.gz PZPJARFVKRPQFQ-BBRMVZONSA-N 1 1 229.367 3.665 20 0 BHADMO C[C@@H]1C[C@H](c2ccccc2)C[N@H+]1CC1CCC1 ZINC000441394931 387757485 /nfs/dbraw/zinc/75/74/85/387757485.db2.gz PZPJARFVKRPQFQ-CJNGLKHVSA-N 1 1 229.367 3.665 20 0 BHADMO C[C@@H]1C[C@@H](c2ccccc2)C[N@H+]1CC1CCC1 ZINC000441394932 387757055 /nfs/dbraw/zinc/75/70/55/387757055.db2.gz PZPJARFVKRPQFQ-CZUORRHYSA-N 1 1 229.367 3.665 20 0 BHADMO C[C@H]1C[C@@H](c2ccccc2)C[N@H+]1CC1CCC1 ZINC000441394933 387756598 /nfs/dbraw/zinc/75/65/98/387756598.db2.gz PZPJARFVKRPQFQ-XJKSGUPXSA-N 1 1 229.367 3.665 20 0 BHADMO C[C@]1(c2ccccc2)CCC[N@@H+](CCC2CC2)C1 ZINC000441395523 387755898 /nfs/dbraw/zinc/75/58/98/387755898.db2.gz RQJSAFYYRFABLI-KRWDZBQOSA-N 1 1 243.394 3.840 20 0 BHADMO C[C@@]1(c2ccccc2)CCC[N@@H+](CCC2CC2)C1 ZINC000441395524 387757177 /nfs/dbraw/zinc/75/71/77/387757177.db2.gz RQJSAFYYRFABLI-QGZVFWFLSA-N 1 1 243.394 3.840 20 0 BHADMO Cc1ccccc1[C@@H]1C[C@@H](C)[N@H+](CC2CCC2)C1 ZINC000441397348 387758345 /nfs/dbraw/zinc/75/83/45/387758345.db2.gz WFYRQWUDDXMOOM-GDBMZVCRSA-N 1 1 243.394 3.973 20 0 BHADMO Cc1ccccc1[C@@H]1C[C@H](C)[N@H+](CC2CCC2)C1 ZINC000441397351 387758077 /nfs/dbraw/zinc/75/80/77/387758077.db2.gz WFYRQWUDDXMOOM-GOEBONIOSA-N 1 1 243.394 3.973 20 0 BHADMO Cc1ccccc1[C@H]1C[C@H](C)[N@H+](CC2CCC2)C1 ZINC000441397352 387756960 /nfs/dbraw/zinc/75/69/60/387756960.db2.gz WFYRQWUDDXMOOM-HOCLYGCPSA-N 1 1 243.394 3.973 20 0 BHADMO Cc1ccccc1[C@H]1C[C@@H](C)[N@H+](CC2CCC2)C1 ZINC000441397354 387758142 /nfs/dbraw/zinc/75/81/42/387758142.db2.gz WFYRQWUDDXMOOM-ZBFHGGJFSA-N 1 1 243.394 3.973 20 0 BHADMO Fc1cccc(CC[N@@H+](CC2CCC2)C2CC2)c1 ZINC000441397789 387755883 /nfs/dbraw/zinc/75/58/83/387755883.db2.gz GJKDRDHJCWSEDG-UHFFFAOYSA-N 1 1 247.357 3.633 20 0 BHADMO Cc1ccccc1[C@@H]1C[C@@H](C)[N@H+](CCC2CC2)C1 ZINC000441398502 387756775 /nfs/dbraw/zinc/75/67/75/387756775.db2.gz SQSJYZRNBNQHSZ-GDBMZVCRSA-N 1 1 243.394 3.973 20 0 BHADMO Cc1ccccc1[C@@H]1C[C@H](C)[N@H+](CCC2CC2)C1 ZINC000441398504 387758206 /nfs/dbraw/zinc/75/82/06/387758206.db2.gz SQSJYZRNBNQHSZ-GOEBONIOSA-N 1 1 243.394 3.973 20 0 BHADMO Cc1ccccc1[C@H]1C[C@H](C)[N@H+](CCC2CC2)C1 ZINC000441398506 201552220 /nfs/dbraw/zinc/55/22/20/201552220.db2.gz SQSJYZRNBNQHSZ-HOCLYGCPSA-N 1 1 243.394 3.973 20 0 BHADMO Cc1ccccc1[C@H]1C[C@@H](C)[N@H+](CCC2CC2)C1 ZINC000441398509 387756125 /nfs/dbraw/zinc/75/61/25/387756125.db2.gz SQSJYZRNBNQHSZ-ZBFHGGJFSA-N 1 1 243.394 3.973 20 0 BHADMO CCC[N@H+](CCc1cccc(F)c1)CCC1CC1 ZINC000441399488 387758254 /nfs/dbraw/zinc/75/82/54/387758254.db2.gz XOMVCWYABZWZNA-UHFFFAOYSA-N 1 1 249.373 3.880 20 0 BHADMO CC(C)[C@H]1CCC[N@@H+](CCC2CC2)CC1 ZINC000441400243 387758176 /nfs/dbraw/zinc/75/81/76/387758176.db2.gz ZQCGJTAQTYEJEY-AWEZNQCLSA-N 1 1 209.377 3.545 20 0 BHADMO CC(C)[C@@H]1CCC[N@@H+](CCC2CC2)CC1 ZINC000441400245 387757853 /nfs/dbraw/zinc/75/78/53/387757853.db2.gz ZQCGJTAQTYEJEY-CQSZACIVSA-N 1 1 209.377 3.545 20 0 BHADMO CC(C)[C@H]1CCC[N@@H+](CC2CCC2)CC1 ZINC000441400279 387757316 /nfs/dbraw/zinc/75/73/16/387757316.db2.gz ZURIEVODANMACP-AWEZNQCLSA-N 1 1 209.377 3.545 20 0 BHADMO CC(C)[C@@H]1CCC[N@@H+](CC2CCC2)CC1 ZINC000441400282 387757862 /nfs/dbraw/zinc/75/78/62/387757862.db2.gz ZURIEVODANMACP-CQSZACIVSA-N 1 1 209.377 3.545 20 0 BHADMO Clc1ccc([C@H]2CC[N@@H+](CC3CCC3)C2)cc1 ZINC000441400304 387757573 /nfs/dbraw/zinc/75/75/73/387757573.db2.gz DHQCOSAUFIPQON-AWEZNQCLSA-N 1 1 249.785 3.929 20 0 BHADMO Clc1ccc([C@@H]2CC[N@@H+](CC3CCC3)C2)cc1 ZINC000441400305 387758416 /nfs/dbraw/zinc/75/84/16/387758416.db2.gz DHQCOSAUFIPQON-CQSZACIVSA-N 1 1 249.785 3.929 20 0 BHADMO Fc1ccc(C[N@@H+](CCC2CC2)CC2CC2)cc1 ZINC000441403480 387756473 /nfs/dbraw/zinc/75/64/73/387756473.db2.gz QKFPJCCSEJQEGA-UHFFFAOYSA-N 1 1 247.357 3.838 20 0 BHADMO C(C1CCC1)[N@H+]1CCCC2(CCCCC2)C1 ZINC000441403605 387757805 /nfs/dbraw/zinc/75/78/05/387757805.db2.gz LCOLDOJADBHNIA-UHFFFAOYSA-N 1 1 221.388 3.833 20 0 BHADMO Fc1ccc(CC[N@@H+](CC2CCC2)C2CC2)cc1 ZINC000441408360 387756347 /nfs/dbraw/zinc/75/63/47/387756347.db2.gz WSSSCGVTAZYKOT-UHFFFAOYSA-N 1 1 247.357 3.633 20 0 BHADMO Cc1cccc(C[N@H+]2CCC[C@H]3CCC[C@@H]32)c1 ZINC000441431098 387761199 /nfs/dbraw/zinc/76/11/99/387761199.db2.gz BKQYNTZQOCDNNB-CVEARBPZSA-N 1 1 229.367 3.760 20 0 BHADMO Cc1cccc(C[N@H+]2CCC[C@@H]3CCC[C@@H]32)c1 ZINC000441431100 387760028 /nfs/dbraw/zinc/76/00/28/387760028.db2.gz BKQYNTZQOCDNNB-HOTGVXAUSA-N 1 1 229.367 3.760 20 0 BHADMO Cc1cccc(C[N@H+]2CCC[C@H]3CCC[C@H]32)c1 ZINC000441431103 387760095 /nfs/dbraw/zinc/76/00/95/387760095.db2.gz BKQYNTZQOCDNNB-HZPDHXFCSA-N 1 1 229.367 3.760 20 0 BHADMO Cc1cccc(C[N@H+]2CCC[C@@H]3CCC[C@H]32)c1 ZINC000441431106 387758993 /nfs/dbraw/zinc/75/89/93/387758993.db2.gz BKQYNTZQOCDNNB-JKSUJKDBSA-N 1 1 229.367 3.760 20 0 BHADMO c1ccc(CCC[N@H+]2CCC[C@@H]3CCC[C@H]32)cc1 ZINC000441433096 387760887 /nfs/dbraw/zinc/76/08/87/387760887.db2.gz FWGFPDUPJFURMB-DLBZAZTESA-N 1 1 243.394 3.884 20 0 BHADMO c1ccc(CCC[N@H+]2CCC[C@H]3CCC[C@H]32)cc1 ZINC000441433098 387759159 /nfs/dbraw/zinc/75/91/59/387759159.db2.gz FWGFPDUPJFURMB-IAGOWNOFSA-N 1 1 243.394 3.884 20 0 BHADMO c1ccc(CCC[N@H+]2CCC[C@@H]3CCC[C@@H]32)cc1 ZINC000441433100 387761138 /nfs/dbraw/zinc/76/11/38/387761138.db2.gz FWGFPDUPJFURMB-IRXDYDNUSA-N 1 1 243.394 3.884 20 0 BHADMO c1ccc(CCC[N@H+]2CCC[C@H]3CCC[C@@H]32)cc1 ZINC000441433101 387759091 /nfs/dbraw/zinc/75/90/91/387759091.db2.gz FWGFPDUPJFURMB-SJORKVTESA-N 1 1 243.394 3.884 20 0 BHADMO Cc1cccc([C@H](C)[N@@H+]2C[C@@H]3[C@H](C2)C3(C)C)c1 ZINC000441433917 387759752 /nfs/dbraw/zinc/75/97/52/387759752.db2.gz ABHMUXFZLIDOPR-AEGPPILISA-N 1 1 229.367 3.644 20 0 BHADMO Cc1cccc([C@@H](C)[N@@H+]2C[C@@H]3[C@H](C2)C3(C)C)c1 ZINC000441433922 387760542 /nfs/dbraw/zinc/76/05/42/387760542.db2.gz ABHMUXFZLIDOPR-YUELXQCFSA-N 1 1 229.367 3.644 20 0 BHADMO CCC(C)(C)CC[N@@H+](C[C@@H](C)OC)C(C)C ZINC000441434367 387759407 /nfs/dbraw/zinc/75/94/07/387759407.db2.gz JOANNUAKGYIBRS-CYBMUJFWSA-N 1 1 229.408 3.558 20 0 BHADMO CCC(C)(C)CC[N@@H+](C[C@H](C)OC)C(C)C ZINC000441434368 387761190 /nfs/dbraw/zinc/76/11/90/387761190.db2.gz JOANNUAKGYIBRS-ZDUSSCGKSA-N 1 1 229.408 3.558 20 0 BHADMO C[C@@H]1C[N@@H+](CC2CCC2)CC[C@@H]1c1ccccc1 ZINC000441434420 387760372 /nfs/dbraw/zinc/76/03/72/387760372.db2.gz KERKXOSEQHUUCD-PBHICJAKSA-N 1 1 243.394 3.912 20 0 BHADMO C[C@@H]1C[N@@H+](CC2CCC2)CC[C@H]1c1ccccc1 ZINC000441434621 387760468 /nfs/dbraw/zinc/76/04/68/387760468.db2.gz KERKXOSEQHUUCD-RHSMWYFYSA-N 1 1 243.394 3.912 20 0 BHADMO C[C@H]1C[N@@H+](CC2CCC2)CC[C@H]1c1ccccc1 ZINC000441434622 387758931 /nfs/dbraw/zinc/75/89/31/387758931.db2.gz KERKXOSEQHUUCD-WMLDXEAASA-N 1 1 243.394 3.912 20 0 BHADMO C[C@H]1C[N@@H+](CC2CCC2)CC[C@@H]1c1ccccc1 ZINC000441434623 201551944 /nfs/dbraw/zinc/55/19/44/201551944.db2.gz KERKXOSEQHUUCD-YOEHRIQHSA-N 1 1 243.394 3.912 20 0 BHADMO CC(C)(C)CC[N@H+]1CCC[C@H]2CCC[C@H]21 ZINC000441434741 201552089 /nfs/dbraw/zinc/55/20/89/201552089.db2.gz KSYNFMBCJNVZNL-CHWSQXEVSA-N 1 1 209.377 3.687 20 0 BHADMO CC(C)(C)CC[N@H+]1CCC[C@H]2CCC[C@@H]21 ZINC000441434743 387760347 /nfs/dbraw/zinc/76/03/47/387760347.db2.gz KSYNFMBCJNVZNL-OLZOCXBDSA-N 1 1 209.377 3.687 20 0 BHADMO CC(C)(C)CC[N@H+]1CCC[C@@H]2CCC[C@H]21 ZINC000441434744 387761079 /nfs/dbraw/zinc/76/10/79/387761079.db2.gz KSYNFMBCJNVZNL-QWHCGFSZSA-N 1 1 209.377 3.687 20 0 BHADMO CC(C)(C)CC[N@H+]1CCC[C@@H]2CCC[C@@H]21 ZINC000441434746 387759545 /nfs/dbraw/zinc/75/95/45/387759545.db2.gz KSYNFMBCJNVZNL-STQMWFEESA-N 1 1 209.377 3.687 20 0 BHADMO C[C@@H]1C[N@@H+](CCC2CC2)CC[C@@H]1c1ccccc1 ZINC000441437726 387759771 /nfs/dbraw/zinc/75/97/71/387759771.db2.gz RGRZVXPIXDBPRS-PBHICJAKSA-N 1 1 243.394 3.912 20 0 BHADMO C[C@@H]1C[N@@H+](CCC2CC2)CC[C@H]1c1ccccc1 ZINC000441437728 387760772 /nfs/dbraw/zinc/76/07/72/387760772.db2.gz RGRZVXPIXDBPRS-RHSMWYFYSA-N 1 1 243.394 3.912 20 0 BHADMO C[C@H]1C[N@@H+](CCC2CC2)CC[C@H]1c1ccccc1 ZINC000441437729 387758986 /nfs/dbraw/zinc/75/89/86/387758986.db2.gz RGRZVXPIXDBPRS-WMLDXEAASA-N 1 1 243.394 3.912 20 0 BHADMO C[C@H]1C[N@@H+](CCC2CC2)CC[C@@H]1c1ccccc1 ZINC000441437731 201551637 /nfs/dbraw/zinc/55/16/37/201551637.db2.gz RGRZVXPIXDBPRS-YOEHRIQHSA-N 1 1 243.394 3.912 20 0 BHADMO Cc1ccc(C[N@H+]2CCC[C@H]3CCC[C@@H]32)cc1 ZINC000441450160 387759211 /nfs/dbraw/zinc/75/92/11/387759211.db2.gz PJTVJKGIEVAQDI-CVEARBPZSA-N 1 1 229.367 3.760 20 0 BHADMO Cc1ccc(C[N@H+]2CCC[C@@H]3CCC[C@@H]32)cc1 ZINC000441450161 387759133 /nfs/dbraw/zinc/75/91/33/387759133.db2.gz PJTVJKGIEVAQDI-HOTGVXAUSA-N 1 1 229.367 3.760 20 0 BHADMO Cc1ccc(C[N@H+]2CCC[C@H]3CCC[C@H]32)cc1 ZINC000441450162 387760393 /nfs/dbraw/zinc/76/03/93/387760393.db2.gz PJTVJKGIEVAQDI-HZPDHXFCSA-N 1 1 229.367 3.760 20 0 BHADMO Cc1ccc(C[N@H+]2CCC[C@@H]3CCC[C@H]32)cc1 ZINC000441450163 387759798 /nfs/dbraw/zinc/75/97/98/387759798.db2.gz PJTVJKGIEVAQDI-JKSUJKDBSA-N 1 1 229.367 3.760 20 0 BHADMO C(C[N@H+]1CCC[C@H]2CCC[C@@H]21)C1CCCC1 ZINC000441451130 201553809 /nfs/dbraw/zinc/55/38/09/201553809.db2.gz MPNCVMMNULEFOM-CABCVRRESA-N 1 1 221.388 3.831 20 0 BHADMO C(C[N@H+]1CCC[C@@H]2CCC[C@@H]21)C1CCCC1 ZINC000441451133 387761619 /nfs/dbraw/zinc/76/16/19/387761619.db2.gz MPNCVMMNULEFOM-GJZGRUSLSA-N 1 1 221.388 3.831 20 0 BHADMO C(C[N@H+]1CCC[C@H]2CCC[C@H]21)C1CCCC1 ZINC000441451136 387761758 /nfs/dbraw/zinc/76/17/58/387761758.db2.gz MPNCVMMNULEFOM-HUUCEWRRSA-N 1 1 221.388 3.831 20 0 BHADMO C(C[N@H+]1CCC[C@@H]2CCC[C@H]21)C1CCCC1 ZINC000441451139 387762021 /nfs/dbraw/zinc/76/20/21/387762021.db2.gz MPNCVMMNULEFOM-LSDHHAIUSA-N 1 1 221.388 3.831 20 0 BHADMO C1=C[C@@H]([N@@H+](C[C@H]2CCCO2)C2CCCC2)CCC1 ZINC000441456485 387761958 /nfs/dbraw/zinc/76/19/58/387761958.db2.gz IUNBYAJPEJCWFO-GDBMZVCRSA-N 1 1 249.398 3.519 20 0 BHADMO C1=C[C@H]([N@@H+](C[C@H]2CCCO2)C2CCCC2)CCC1 ZINC000441456486 387762759 /nfs/dbraw/zinc/76/27/59/387762759.db2.gz IUNBYAJPEJCWFO-GOEBONIOSA-N 1 1 249.398 3.519 20 0 BHADMO C1=C[C@H]([N@@H+](C[C@@H]2CCCO2)C2CCCC2)CCC1 ZINC000441456487 387762106 /nfs/dbraw/zinc/76/21/06/387762106.db2.gz IUNBYAJPEJCWFO-HOCLYGCPSA-N 1 1 249.398 3.519 20 0 BHADMO C1=C[C@@H]([N@@H+](C[C@@H]2CCCO2)C2CCCC2)CCC1 ZINC000441456488 387762658 /nfs/dbraw/zinc/76/26/58/387762658.db2.gz IUNBYAJPEJCWFO-ZBFHGGJFSA-N 1 1 249.398 3.519 20 0 BHADMO C[C@@H]1C[C@H]2CCCC[C@H]2[N@H+]1CC1CCCC1 ZINC000441457581 387761631 /nfs/dbraw/zinc/76/16/31/387761631.db2.gz ODZCTTIPMBAGJC-BPLDGKMQSA-N 1 1 221.388 3.830 20 0 BHADMO C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@H+]1CC1CCCC1 ZINC000441457582 387761902 /nfs/dbraw/zinc/76/19/02/387761902.db2.gz ODZCTTIPMBAGJC-SNPRPXQTSA-N 1 1 221.388 3.830 20 0 BHADMO C[C@@H]1C[C@@H]2CCCC[C@H]2[N@H+]1CC1CCCC1 ZINC000441457583 387763333 /nfs/dbraw/zinc/76/33/33/387763333.db2.gz ODZCTTIPMBAGJC-VHDGCEQUSA-N 1 1 221.388 3.830 20 0 BHADMO C[C@@H]1C[C@H]2CCCC[C@@H]2[N@H+]1CC1CCCC1 ZINC000441457584 387762171 /nfs/dbraw/zinc/76/21/71/387762171.db2.gz ODZCTTIPMBAGJC-YUELXQCFSA-N 1 1 221.388 3.830 20 0 BHADMO C[C@@H]1C[C@H]2CCCC[C@H]2[N@H+]1Cc1ccccc1 ZINC000441458420 387763255 /nfs/dbraw/zinc/76/32/55/387763255.db2.gz SBVRHTSYDZOWQG-FVQBIDKESA-N 1 1 229.367 3.840 20 0 BHADMO C[C@@H]1C[C@@H]2CCCC[C@H]2[N@H+]1Cc1ccccc1 ZINC000441458421 387762126 /nfs/dbraw/zinc/76/21/26/387762126.db2.gz SBVRHTSYDZOWQG-VNQPRFMTSA-N 1 1 229.367 3.840 20 0 BHADMO CCCCC[N@H+]1[C@H](C)C[C@@H]2CCCC[C@H]21 ZINC000441462939 387762062 /nfs/dbraw/zinc/76/20/62/387762062.db2.gz JAJPKOKIXXJOMM-HZSPNIEDSA-N 1 1 209.377 3.830 20 0 BHADMO CCCCC[N@H+]1[C@H](C)C[C@H]2CCCC[C@@H]21 ZINC000441462941 387763202 /nfs/dbraw/zinc/76/32/02/387763202.db2.gz JAJPKOKIXXJOMM-MCIONIFRSA-N 1 1 209.377 3.830 20 0 BHADMO CCCCC[N@H+]1[C@H](C)C[C@H]2CCCC[C@H]21 ZINC000441462943 387762670 /nfs/dbraw/zinc/76/26/70/387762670.db2.gz JAJPKOKIXXJOMM-MGPQQGTHSA-N 1 1 209.377 3.830 20 0 BHADMO CCCCC[N@H+]1[C@H](C)C[C@@H]2CCCC[C@@H]21 ZINC000441462946 201553824 /nfs/dbraw/zinc/55/38/24/201553824.db2.gz JAJPKOKIXXJOMM-RDBSUJKOSA-N 1 1 209.377 3.830 20 0 BHADMO CC[C@H](C)[C@H]1CCCC[N@H+]1CCC1CC1 ZINC000441463147 387762148 /nfs/dbraw/zinc/76/21/48/387762148.db2.gz DSFVDOQRFRFWOO-GXTWGEPZSA-N 1 1 209.377 3.687 20 0 BHADMO CC[C@H](C)[C@@H]1CCCC[N@H+]1CCC1CC1 ZINC000441463148 201554791 /nfs/dbraw/zinc/55/47/91/201554791.db2.gz DSFVDOQRFRFWOO-JSGCOSHPSA-N 1 1 209.377 3.687 20 0 BHADMO CC[C@@H](C)[C@@H]1CCCC[N@H+]1CCC1CC1 ZINC000441463150 387762879 /nfs/dbraw/zinc/76/28/79/387762879.db2.gz DSFVDOQRFRFWOO-OCCSQVGLSA-N 1 1 209.377 3.687 20 0 BHADMO CC[C@@H](C)[C@H]1CCCC[N@H+]1CCC1CC1 ZINC000441463151 387763434 /nfs/dbraw/zinc/76/34/34/387763434.db2.gz DSFVDOQRFRFWOO-TZMCWYRMSA-N 1 1 209.377 3.687 20 0 BHADMO C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@H+]1[C@@H]1C=CCCC1 ZINC000441463396 387762194 /nfs/dbraw/zinc/76/21/94/387762194.db2.gz FIRPOJJHBLZMCY-BARDWOONSA-N 1 1 219.372 3.748 20 0 BHADMO C[C@@H]1C[C@@H]2CCCC[C@H]2[N@H+]1[C@H]1C=CCCC1 ZINC000441463397 387761841 /nfs/dbraw/zinc/76/18/41/387761841.db2.gz FIRPOJJHBLZMCY-CBBWQLFWSA-N 1 1 219.372 3.748 20 0 BHADMO C[C@@H]1C[C@@H]2CCCC[C@H]2[N@H+]1[C@@H]1C=CCCC1 ZINC000441463398 387762623 /nfs/dbraw/zinc/76/26/23/387762623.db2.gz FIRPOJJHBLZMCY-LXTVHRRPSA-N 1 1 219.372 3.748 20 0 BHADMO C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@H+]1[C@H]1C=CCCC1 ZINC000441463399 387761702 /nfs/dbraw/zinc/76/17/02/387761702.db2.gz FIRPOJJHBLZMCY-QPSCCSFWSA-N 1 1 219.372 3.748 20 0 BHADMO C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@H+]1Cc1ccc(F)cc1 ZINC000441469040 201553355 /nfs/dbraw/zinc/55/33/55/201553355.db2.gz RRGAUHVNUYOBIA-INWMFGNUSA-N 1 1 247.357 3.979 20 0 BHADMO C[C@@H]1C[C@@H]2CCCC[C@H]2[N@H+]1Cc1ccc(F)cc1 ZINC000441469042 387763244 /nfs/dbraw/zinc/76/32/44/387763244.db2.gz RRGAUHVNUYOBIA-IVMMDQJWSA-N 1 1 247.357 3.979 20 0 BHADMO C[C@@H]1C[C@H]2CCCC[C@H]2[N@H+]1Cc1ccc(F)cc1 ZINC000441469045 387763063 /nfs/dbraw/zinc/76/30/63/387763063.db2.gz RRGAUHVNUYOBIA-XNRPHZJLSA-N 1 1 247.357 3.979 20 0 BHADMO C[C@@H]1C[C@H]2CCCC[C@@H]2[N@H+]1Cc1ccc(F)cc1 ZINC000441469048 387763122 /nfs/dbraw/zinc/76/31/22/387763122.db2.gz RRGAUHVNUYOBIA-XPKDYRNWSA-N 1 1 247.357 3.979 20 0 BHADMO c1ccc(C[C@@H]2CCCC[N@@H+]2CCC2CC2)cc1 ZINC000441474761 387762769 /nfs/dbraw/zinc/76/27/69/387762769.db2.gz MEOAGRXZDXLMRG-KRWDZBQOSA-N 1 1 243.394 3.884 20 0 BHADMO c1ccc(C[C@H]2CCCC[N@@H+]2CCC2CC2)cc1 ZINC000441474762 387762593 /nfs/dbraw/zinc/76/25/93/387762593.db2.gz MEOAGRXZDXLMRG-QGZVFWFLSA-N 1 1 243.394 3.884 20 0 BHADMO CC[C@H](C)[C@H]1CCCC[N@H+]1CC1CCC1 ZINC000441480772 387765085 /nfs/dbraw/zinc/76/50/85/387765085.db2.gz VGEJQKCKWVXQGG-GXTWGEPZSA-N 1 1 209.377 3.687 20 0 BHADMO CC[C@H](C)[C@@H]1CCCC[N@H+]1CC1CCC1 ZINC000441480773 387763862 /nfs/dbraw/zinc/76/38/62/387763862.db2.gz VGEJQKCKWVXQGG-JSGCOSHPSA-N 1 1 209.377 3.687 20 0 BHADMO CC[C@@H](C)[C@@H]1CCCC[N@H+]1CC1CCC1 ZINC000441480774 387764721 /nfs/dbraw/zinc/76/47/21/387764721.db2.gz VGEJQKCKWVXQGG-OCCSQVGLSA-N 1 1 209.377 3.687 20 0 BHADMO CC[C@@H](C)[C@H]1CCCC[N@H+]1CC1CCC1 ZINC000441480775 387764889 /nfs/dbraw/zinc/76/48/89/387764889.db2.gz VGEJQKCKWVXQGG-TZMCWYRMSA-N 1 1 209.377 3.687 20 0 BHADMO CC[C@@H](C)[C@H](C)[N@@H+](CC1CCC1)C1CC1 ZINC000441487215 387764443 /nfs/dbraw/zinc/76/44/43/387764443.db2.gz GCGUDHMTNTXJMD-NEPJUHHUSA-N 1 1 209.377 3.686 20 0 BHADMO CC[C@H](C)[C@@H](C)[N@@H+](CC1CCC1)C1CC1 ZINC000441487217 387764808 /nfs/dbraw/zinc/76/48/08/387764808.db2.gz GCGUDHMTNTXJMD-NWDGAFQWSA-N 1 1 209.377 3.686 20 0 BHADMO CC[C@H](C)[C@H](C)[N@@H+](CC1CCC1)C1CC1 ZINC000441487218 387764421 /nfs/dbraw/zinc/76/44/21/387764421.db2.gz GCGUDHMTNTXJMD-RYUDHWBXSA-N 1 1 209.377 3.686 20 0 BHADMO CC[C@@H](C)[C@@H](C)[N@@H+](CC1CCC1)C1CC1 ZINC000441487220 387764683 /nfs/dbraw/zinc/76/46/83/387764683.db2.gz GCGUDHMTNTXJMD-VXGBXAGGSA-N 1 1 209.377 3.686 20 0 BHADMO COc1ccccc1[C@@H]1CCC[N@H+]1CC1CCC1 ZINC000441490342 387764257 /nfs/dbraw/zinc/76/42/57/387764257.db2.gz QISPDSURHUUUDU-HNNXBMFYSA-N 1 1 245.366 3.632 20 0 BHADMO COc1ccccc1[C@H]1CCC[N@H+]1CC1CCC1 ZINC000441490343 206080626 /nfs/dbraw/zinc/08/06/26/206080626.db2.gz QISPDSURHUUUDU-OAHLLOKOSA-N 1 1 245.366 3.632 20 0 BHADMO C(C1CC1)[N@@H+](CC1CCC1)C1CCCCC1 ZINC000441497372 387764475 /nfs/dbraw/zinc/76/44/75/387764475.db2.gz GGXYTGQOJXMLPP-UHFFFAOYSA-N 1 1 221.388 3.831 20 0 BHADMO c1ccc(C[C@@H]2CCCC[N@@H+]2CC2CCC2)cc1 ZINC000441506172 387765552 /nfs/dbraw/zinc/76/55/52/387765552.db2.gz JUEVGDNMAGMAKC-KRWDZBQOSA-N 1 1 243.394 3.884 20 0 BHADMO c1ccc(C[C@H]2CCCC[N@@H+]2CC2CCC2)cc1 ZINC000441506175 387764245 /nfs/dbraw/zinc/76/42/45/387764245.db2.gz JUEVGDNMAGMAKC-QGZVFWFLSA-N 1 1 243.394 3.884 20 0 BHADMO C(C[N@@H+](CC1CC1)C1CCCCC1)C1CC1 ZINC000441507549 201556042 /nfs/dbraw/zinc/55/60/42/201556042.db2.gz WFHIQGFGPIDMSM-UHFFFAOYSA-N 1 1 221.388 3.831 20 0 BHADMO CC(C)C[N@@H+](CC1CCC1)C1CCCC1 ZINC000441527158 387766624 /nfs/dbraw/zinc/76/66/24/387766624.db2.gz VWOCPCYJAGDWEI-UHFFFAOYSA-N 1 1 209.377 3.687 20 0 BHADMO Cc1ccccc1[C@H]1CC[N@@H+](CC2CCC2)C1 ZINC000441531487 387767076 /nfs/dbraw/zinc/76/70/76/387767076.db2.gz UKLOEGXEZFLXLZ-HNNXBMFYSA-N 1 1 229.367 3.584 20 0 BHADMO Cc1ccccc1[C@@H]1CC[N@@H+](CC2CCC2)C1 ZINC000441531495 387767053 /nfs/dbraw/zinc/76/70/53/387767053.db2.gz UKLOEGXEZFLXLZ-OAHLLOKOSA-N 1 1 229.367 3.584 20 0 BHADMO CC(C)(C)C[C@H]1CCC[N@H+]1CCC1CC1 ZINC000441539502 387770100 /nfs/dbraw/zinc/77/01/00/387770100.db2.gz BDGHCGCHHKXQKU-CYBMUJFWSA-N 1 1 209.377 3.687 20 0 BHADMO CC(C)(C)C[C@@H]1CCC[N@H+]1CCC1CC1 ZINC000441539503 387770001 /nfs/dbraw/zinc/77/00/01/387770001.db2.gz BDGHCGCHHKXQKU-ZDUSSCGKSA-N 1 1 209.377 3.687 20 0 BHADMO CC(C)C[N@@H+](CCC1CC1)Cc1ccccc1 ZINC000441541002 387769133 /nfs/dbraw/zinc/76/91/33/387769133.db2.gz DAVMXRHPOZDPDD-UHFFFAOYSA-N 1 1 231.383 3.945 20 0 BHADMO CC(C)(C)C[C@H]1CCC[N@H+]1CC1CCC1 ZINC000441542924 387768859 /nfs/dbraw/zinc/76/88/59/387768859.db2.gz MVMQRMNEYPHLLZ-CYBMUJFWSA-N 1 1 209.377 3.687 20 0 BHADMO CC(C)(C)C[C@@H]1CCC[N@H+]1CC1CCC1 ZINC000441542925 387769823 /nfs/dbraw/zinc/76/98/23/387769823.db2.gz MVMQRMNEYPHLLZ-ZDUSSCGKSA-N 1 1 209.377 3.687 20 0 BHADMO CCCCC[N@@H+](CC1(C)COC1)[C@@H](C)CCC ZINC000441544557 387768965 /nfs/dbraw/zinc/76/89/65/387768965.db2.gz UAYQPNVHBYPDBT-AWEZNQCLSA-N 1 1 241.419 3.704 20 0 BHADMO CCCCC[N@@H+](CC1(C)COC1)[C@H](C)CCC ZINC000441544558 387769495 /nfs/dbraw/zinc/76/94/95/387769495.db2.gz UAYQPNVHBYPDBT-CQSZACIVSA-N 1 1 241.419 3.704 20 0 BHADMO C[N@@H+](CCC1CCCCC1)CC1CCC1 ZINC000441545003 387769226 /nfs/dbraw/zinc/76/92/26/387769226.db2.gz KQMRMVCUEFUHHQ-UHFFFAOYSA-N 1 1 209.377 3.689 20 0 BHADMO CCC[N@@H+](CCC(C)(C)CC)CC(F)F ZINC000441546363 387769855 /nfs/dbraw/zinc/76/98/55/387769855.db2.gz UVRUNYDHNGVBBR-UHFFFAOYSA-N 1 1 221.335 3.790 20 0 BHADMO CCC[N@H+](CCC(C)(C)CC)CC(F)F ZINC000441546363 387769852 /nfs/dbraw/zinc/76/98/52/387769852.db2.gz UVRUNYDHNGVBBR-UHFFFAOYSA-N 1 1 221.335 3.790 20 0 BHADMO CCC(C)(C)CC[N@@H+](C)C(C1CC1)C1CC1 ZINC000441547719 387769504 /nfs/dbraw/zinc/76/95/04/387769504.db2.gz QWSFZMNRJNWNRG-UHFFFAOYSA-N 1 1 223.404 3.933 20 0 BHADMO C[N@@H+](CCC1CC1)CCC1CCCCC1 ZINC000441553983 387769610 /nfs/dbraw/zinc/76/96/10/387769610.db2.gz VMKXAENWDDXICO-UHFFFAOYSA-N 1 1 209.377 3.689 20 0 BHADMO CCC(C)(C)[C@H]1CCC[N@H+]1CCCSC ZINC000441632540 201559581 /nfs/dbraw/zinc/55/95/81/201559581.db2.gz HKKNPZFHEUTKEG-GFCCVEGCSA-N 1 1 229.433 3.640 20 0 BHADMO CCC(C)(C)[C@@H]1CCC[N@H+]1CCCSC ZINC000441632541 387774210 /nfs/dbraw/zinc/77/42/10/387774210.db2.gz HKKNPZFHEUTKEG-LBPRGKRZSA-N 1 1 229.433 3.640 20 0 BHADMO CCC(C)(C)[C@@H]1CCC[N@H+]1Cc1cccc(C)n1 ZINC000441644328 387773835 /nfs/dbraw/zinc/77/38/35/387773835.db2.gz KMNFKVXGPXUSCB-HNNXBMFYSA-N 1 1 246.398 3.791 20 0 BHADMO CCC(C)(C)[C@H]1CCC[N@H+]1Cc1cccc(C)n1 ZINC000441644329 387773953 /nfs/dbraw/zinc/77/39/53/387773953.db2.gz KMNFKVXGPXUSCB-OAHLLOKOSA-N 1 1 246.398 3.791 20 0 BHADMO CCC(C)(C)[C@@H]1CCC[N@H+]1CCCOC(C)C ZINC000441657495 397933190 /nfs/dbraw/zinc/93/31/90/397933190.db2.gz BAOQSTGPUAVAJM-AWEZNQCLSA-N 1 1 241.419 3.702 20 0 BHADMO CCC(C)(C)[C@H]1CCC[N@H+]1CCCOC(C)C ZINC000441657796 397933108 /nfs/dbraw/zinc/93/31/08/397933108.db2.gz BAOQSTGPUAVAJM-CQSZACIVSA-N 1 1 241.419 3.702 20 0 BHADMO CC[C@@]1(C)CCC[N@@H+](CCOCCC(C)C)C1 ZINC000441821416 387780103 /nfs/dbraw/zinc/78/01/03/387780103.db2.gz YYRFSKRPUZJNIE-HNNXBMFYSA-N 1 1 241.419 3.561 20 0 BHADMO CC[C@]1(C)CCC[N@@H+](CCOCCC(C)C)C1 ZINC000441821419 387779369 /nfs/dbraw/zinc/77/93/69/387779369.db2.gz YYRFSKRPUZJNIE-OAHLLOKOSA-N 1 1 241.419 3.561 20 0 BHADMO CC[C@@]1(C)CCC[N@@H+](Cc2cccc(OC)c2)C1 ZINC000441829958 387779173 /nfs/dbraw/zinc/77/91/73/387779173.db2.gz XNOVNDXJQAWWLJ-INIZCTEOSA-N 1 1 247.382 3.707 20 0 BHADMO CC[C@]1(C)CCC[N@@H+](Cc2cccc(OC)c2)C1 ZINC000441829959 387779067 /nfs/dbraw/zinc/77/90/67/387779067.db2.gz XNOVNDXJQAWWLJ-MRXNPFEDSA-N 1 1 247.382 3.707 20 0 BHADMO CCC[C@@H]1[C@H](C)CCC[N@H+]1Cc1cncc(C)c1 ZINC000442668023 201583556 /nfs/dbraw/zinc/58/35/56/201583556.db2.gz BBXBHXXQFNWQSA-GDBMZVCRSA-N 1 1 246.398 3.791 20 0 BHADMO CCC[C@@H]1[C@@H](C)CCC[N@H+]1Cc1cncc(C)c1 ZINC000442668024 387818989 /nfs/dbraw/zinc/81/89/89/387818989.db2.gz BBXBHXXQFNWQSA-GOEBONIOSA-N 1 1 246.398 3.791 20 0 BHADMO CCC[C@H]1[C@@H](C)CCC[N@H+]1Cc1cncc(C)c1 ZINC000442668025 386416982 /nfs/dbraw/zinc/41/69/82/386416982.db2.gz BBXBHXXQFNWQSA-HOCLYGCPSA-N 1 1 246.398 3.791 20 0 BHADMO CCC[C@H]1[C@H](C)CCC[N@H+]1Cc1cncc(C)c1 ZINC000442668026 386415168 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387821837 /nfs/dbraw/zinc/82/18/37/387821837.db2.gz LIEXGPRHEJRCOH-MRXNPFEDSA-N 1 1 246.398 3.792 20 0 BHADMO Cc1cncc(C[N@H+](CC(C)C)CC(C)(C)C)c1 ZINC000442676583 387821780 /nfs/dbraw/zinc/82/17/80/387821780.db2.gz LPGXLBMQTXWJSH-UHFFFAOYSA-N 1 1 248.414 3.894 20 0 BHADMO Cc1cncc(C[N@@H+]2CC=C(C(C)(C)C)CC2)c1 ZINC000442683733 387824101 /nfs/dbraw/zinc/82/41/01/387824101.db2.gz SROZVUOIUUZHMV-UHFFFAOYSA-N 1 1 244.382 3.568 20 0 BHADMO Cc1cncc(C[N@@H+](C)CCC2CCCCC2)c1 ZINC000442688387 387823140 /nfs/dbraw/zinc/82/31/40/387823140.db2.gz PDSDZSCMOFTMIB-UHFFFAOYSA-N 1 1 246.398 3.792 20 0 BHADMO Cc1cncc(C[N@H+](C)C2CCC(C)(C)CC2)c1 ZINC000442692163 387823997 /nfs/dbraw/zinc/82/39/97/387823997.db2.gz NBZHGKVRHHDVNX-UHFFFAOYSA-N 1 1 246.398 3.791 20 0 BHADMO Cc1cncc(C[N@H+]2CCC[C@H]2CC(C)(C)C)c1 ZINC000442694359 387824020 /nfs/dbraw/zinc/82/40/20/387824020.db2.gz RPZJSJITTJWZMK-HNNXBMFYSA-N 1 1 246.398 3.791 20 0 BHADMO Cc1cncc(C[N@H+]2CCC[C@@H]2CC(C)(C)C)c1 ZINC000442694360 387823626 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ZINC000442893745 193001126 /nfs/dbraw/zinc/00/11/26/193001126.db2.gz XYMGJNQYMPIAAQ-GOEBONIOSA-N 1 1 247.382 3.557 20 0 BHADMO CC[C@@]1(C)C[N@H+]([C@@H](C)c2cccc(C)c2)CCO1 ZINC000442893748 193000881 /nfs/dbraw/zinc/00/08/81/193000881.db2.gz XYMGJNQYMPIAAQ-HOCLYGCPSA-N 1 1 247.382 3.557 20 0 BHADMO CC[C@@]1(C)C[N@H+]([C@H](C)c2cccc(C)c2)CCO1 ZINC000442893749 193001142 /nfs/dbraw/zinc/00/11/42/193001142.db2.gz XYMGJNQYMPIAAQ-ZBFHGGJFSA-N 1 1 247.382 3.557 20 0 BHADMO CC[C@]1(C)C[N@H+]([C@H](C)c2ccccc2C)CCO1 ZINC000442893829 193001516 /nfs/dbraw/zinc/00/15/16/193001516.db2.gz YEHFQGHGJIZPBY-GDBMZVCRSA-N 1 1 247.382 3.557 20 0 BHADMO CC[C@]1(C)C[N@H+]([C@@H](C)c2ccccc2C)CCO1 ZINC000442893832 193001258 /nfs/dbraw/zinc/00/12/58/193001258.db2.gz YEHFQGHGJIZPBY-GOEBONIOSA-N 1 1 247.382 3.557 20 0 BHADMO CC[C@@]1(C)C[N@H+]([C@@H](C)c2ccccc2C)CCO1 ZINC000442893834 193001644 /nfs/dbraw/zinc/00/16/44/193001644.db2.gz YEHFQGHGJIZPBY-HOCLYGCPSA-N 1 1 247.382 3.557 20 0 BHADMO 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243.341 3.708 20 0 BHADMO CC1=CCC[C@@H](C)[C@H]1C[N@H+](CC(F)F)C1CC1 ZINC000443639264 193027857 /nfs/dbraw/zinc/02/78/57/193027857.db2.gz KFYPTAXTASVXJG-YPMHNXCESA-N 1 1 243.341 3.708 20 0 BHADMO CC(C)CSCCC[N@H+]1CCCC[C@H]1C ZINC000443675691 193027585 /nfs/dbraw/zinc/02/75/85/193027585.db2.gz RYKRTMYHFACHHP-CYBMUJFWSA-N 1 1 229.433 3.640 20 0 BHADMO CC(C)CSCCC[N@H+]1CCCC[C@@H]1C ZINC000443675692 193027827 /nfs/dbraw/zinc/02/78/27/193027827.db2.gz RYKRTMYHFACHHP-ZDUSSCGKSA-N 1 1 229.433 3.640 20 0 BHADMO CC1=CCC[C@@H](C)[C@@H]1C[N@@H+](C)Cc1ccccn1 ZINC000443855192 193031015 /nfs/dbraw/zinc/03/10/15/193031015.db2.gz PQCZNUXRQNRHFC-GDBMZVCRSA-N 1 1 244.382 3.506 20 0 BHADMO CC1=CCC[C@H](C)[C@@H]1C[N@@H+](C)Cc1ccccn1 ZINC000443855193 193030712 /nfs/dbraw/zinc/03/07/12/193030712.db2.gz PQCZNUXRQNRHFC-GOEBONIOSA-N 1 1 244.382 3.506 20 0 BHADMO CC1=CCC[C@H](C)[C@H]1C[N@@H+](C)Cc1ccccn1 ZINC000443855194 193030408 /nfs/dbraw/zinc/03/04/08/193030408.db2.gz PQCZNUXRQNRHFC-HOCLYGCPSA-N 1 1 244.382 3.506 20 0 BHADMO CC1=CCC[C@@H](C)[C@H]1C[N@@H+](C)Cc1ccccn1 ZINC000443855195 193030645 /nfs/dbraw/zinc/03/06/45/193030645.db2.gz PQCZNUXRQNRHFC-ZBFHGGJFSA-N 1 1 244.382 3.506 20 0 BHADMO CC[N@@H+](CC(F)F)C[C@H]1C(C)=CCC[C@H]1C ZINC000443862253 191109938 /nfs/dbraw/zinc/10/99/38/191109938.db2.gz YRIXGXKQBOJEEI-NEPJUHHUSA-N 1 1 231.330 3.566 20 0 BHADMO CC[N@H+](CC(F)F)C[C@H]1C(C)=CCC[C@H]1C ZINC000443862253 191109936 /nfs/dbraw/zinc/10/99/36/191109936.db2.gz YRIXGXKQBOJEEI-NEPJUHHUSA-N 1 1 231.330 3.566 20 0 BHADMO CC[N@@H+](CC(F)F)C[C@@H]1C(C)=CCC[C@@H]1C ZINC000443862259 191110060 /nfs/dbraw/zinc/11/00/60/191110060.db2.gz YRIXGXKQBOJEEI-NWDGAFQWSA-N 1 1 231.330 3.566 20 0 BHADMO CC[N@H+](CC(F)F)C[C@@H]1C(C)=CCC[C@@H]1C ZINC000443862259 191110057 /nfs/dbraw/zinc/11/00/57/191110057.db2.gz YRIXGXKQBOJEEI-NWDGAFQWSA-N 1 1 231.330 3.566 20 0 BHADMO CC[N@@H+](CC(F)F)C[C@H]1C(C)=CCC[C@@H]1C ZINC000443862260 191110275 /nfs/dbraw/zinc/11/02/75/191110275.db2.gz YRIXGXKQBOJEEI-RYUDHWBXSA-N 1 1 231.330 3.566 20 0 BHADMO CC[N@H+](CC(F)F)C[C@H]1C(C)=CCC[C@@H]1C ZINC000443862260 191110273 /nfs/dbraw/zinc/11/02/73/191110273.db2.gz YRIXGXKQBOJEEI-RYUDHWBXSA-N 1 1 231.330 3.566 20 0 BHADMO CC[N@@H+](CC(F)F)C[C@@H]1C(C)=CCC[C@H]1C ZINC000443862262 191110260 /nfs/dbraw/zinc/11/02/60/191110260.db2.gz YRIXGXKQBOJEEI-VXGBXAGGSA-N 1 1 231.330 3.566 20 0 BHADMO CC[N@H+](CC(F)F)C[C@@H]1C(C)=CCC[C@H]1C ZINC000443862262 191110258 /nfs/dbraw/zinc/11/02/58/191110258.db2.gz YRIXGXKQBOJEEI-VXGBXAGGSA-N 1 1 231.330 3.566 20 0 BHADMO Cc1ccc(CNc2[nH+]cccc2C)cc1Cl ZINC000443959252 193032353 /nfs/dbraw/zinc/03/23/53/193032353.db2.gz MIUUGARLTLJJPW-UHFFFAOYSA-N 1 1 246.741 3.964 20 0 BHADMO Cc1cc[nH+]c(NCc2ccc(C)c(Cl)c2)c1 ZINC000443964844 193031936 /nfs/dbraw/zinc/03/19/36/193031936.db2.gz JJXXGBYQALWSCE-UHFFFAOYSA-N 1 1 246.741 3.964 20 0 BHADMO Cc1ccc(NCc2ccc(C)c(Cl)c2)[nH+]c1 ZINC000443973649 387879293 /nfs/dbraw/zinc/87/92/93/387879293.db2.gz PNAHGGBSUAAYJJ-UHFFFAOYSA-N 1 1 246.741 3.964 20 0 BHADMO Cc1cccc(NCc2ccc(C)c(Cl)c2)[nH+]1 ZINC000443973914 387879078 /nfs/dbraw/zinc/87/90/78/387879078.db2.gz QSARDWSCTDVVST-UHFFFAOYSA-N 1 1 246.741 3.964 20 0 BHADMO Cc1occc1C[N@@H+](C)CCC1CCCCC1 ZINC000444022614 193033337 /nfs/dbraw/zinc/03/33/37/193033337.db2.gz LOIPQWBXAQGXBL-UHFFFAOYSA-N 1 1 235.371 3.990 20 0 BHADMO Cc1ccc(SCC[N@H+](C)C2CCC2)cc1C ZINC000444217243 193042939 /nfs/dbraw/zinc/04/29/39/193042939.db2.gz WHYYURUVIPKHMT-UHFFFAOYSA-N 1 1 249.423 3.880 20 0 BHADMO Cc1cccc([C@H](C)[N@H+](C)CCCOC(C)C)c1 ZINC000444231505 193041978 /nfs/dbraw/zinc/04/19/78/193041978.db2.gz FYWHJRPNNLEJCA-HNNXBMFYSA-N 1 1 249.398 3.803 20 0 BHADMO Cc1cccc([C@@H](C)[N@H+](C)CCCOC(C)C)c1 ZINC000444231506 193042358 /nfs/dbraw/zinc/04/23/58/193042358.db2.gz FYWHJRPNNLEJCA-OAHLLOKOSA-N 1 1 249.398 3.803 20 0 BHADMO CCc1ccccc1CC[N@@H+](C)Cc1ccco1 ZINC000444591335 193051863 /nfs/dbraw/zinc/05/18/63/193051863.db2.gz NRUVPIWLXRKTSJ-UHFFFAOYSA-N 1 1 243.350 3.517 20 0 BHADMO CCc1ccccc1CC[N@H+](CC)C(C)C ZINC000444593496 193052430 /nfs/dbraw/zinc/05/24/30/193052430.db2.gz KOQPDAWMZVFZRF-UHFFFAOYSA-N 1 1 219.372 3.522 20 0 BHADMO CCc1ccccc1CC[N@@H+](C)Cc1ccoc1 ZINC000444598221 193051991 /nfs/dbraw/zinc/05/19/91/193051991.db2.gz RFMQPIGMZNTYLW-UHFFFAOYSA-N 1 1 243.350 3.517 20 0 BHADMO CCc1ccccc1CC[N@H+](C)[C@H](C)CC ZINC000444659464 387901709 /nfs/dbraw/zinc/90/17/09/387901709.db2.gz PSSZCGNWCCREPC-CYBMUJFWSA-N 1 1 219.372 3.522 20 0 BHADMO CCc1ccccc1CC[N@H+](C)[C@@H](C)CC ZINC000444659469 387894255 /nfs/dbraw/zinc/89/42/55/387894255.db2.gz PSSZCGNWCCREPC-ZDUSSCGKSA-N 1 1 219.372 3.522 20 0 BHADMO CC[C@@H]1CCCC[C@H]1[N@@H+](C)CCCSC ZINC000444661790 387902551 /nfs/dbraw/zinc/90/25/51/387902551.db2.gz BBDRCFXMUHYJHM-CHWSQXEVSA-N 1 1 229.433 3.640 20 0 BHADMO CC[C@@H]1CCCC[C@@H]1[N@@H+](C)CCCSC ZINC000444661804 387903697 /nfs/dbraw/zinc/90/36/97/387903697.db2.gz BBDRCFXMUHYJHM-OLZOCXBDSA-N 1 1 229.433 3.640 20 0 BHADMO CC[C@H]1CCCC[C@H]1[N@@H+](C)CCCSC ZINC000444661805 387902754 /nfs/dbraw/zinc/90/27/54/387902754.db2.gz BBDRCFXMUHYJHM-QWHCGFSZSA-N 1 1 229.433 3.640 20 0 BHADMO CC[C@H]1CCCC[C@@H]1[N@@H+](C)CCCSC ZINC000444661806 387903309 /nfs/dbraw/zinc/90/33/09/387903309.db2.gz BBDRCFXMUHYJHM-STQMWFEESA-N 1 1 229.433 3.640 20 0 BHADMO CC[N@@H+](Cc1ncccc1C)[C@@H]1CCCC[C@H]1C ZINC000444662361 387902775 /nfs/dbraw/zinc/90/27/75/387902775.db2.gz JDUCKZDPKXXCCG-GDBMZVCRSA-N 1 1 246.398 3.791 20 0 BHADMO CC[N@@H+](Cc1ncccc1C)[C@@H]1CCCC[C@@H]1C ZINC000444662362 387903194 /nfs/dbraw/zinc/90/31/94/387903194.db2.gz JDUCKZDPKXXCCG-GOEBONIOSA-N 1 1 246.398 3.791 20 0 BHADMO CC[N@@H+](Cc1ncccc1C)[C@H]1CCCC[C@@H]1C ZINC000444662363 387904073 /nfs/dbraw/zinc/90/40/73/387904073.db2.gz JDUCKZDPKXXCCG-HOCLYGCPSA-N 1 1 246.398 3.791 20 0 BHADMO CC[N@@H+](Cc1ncccc1C)[C@H]1CCCC[C@H]1C ZINC000444662364 387903689 /nfs/dbraw/zinc/90/36/89/387903689.db2.gz JDUCKZDPKXXCCG-ZBFHGGJFSA-N 1 1 246.398 3.791 20 0 BHADMO CC[C@@H]1CCCC[C@@H]1[N@@H+](C)CCCOC(C)C ZINC000444662600 387903949 /nfs/dbraw/zinc/90/39/49/387903949.db2.gz NCKMTVKDVKRWFI-CABCVRRESA-N 1 1 241.419 3.702 20 0 BHADMO CC[C@H]1CCCC[C@@H]1[N@@H+](C)CCCOC(C)C ZINC000444662601 387903906 /nfs/dbraw/zinc/90/39/06/387903906.db2.gz NCKMTVKDVKRWFI-GJZGRUSLSA-N 1 1 241.419 3.702 20 0 BHADMO CC[C@@H]1CCCC[C@H]1[N@@H+](C)CCCOC(C)C ZINC000444662602 387903160 /nfs/dbraw/zinc/90/31/60/387903160.db2.gz NCKMTVKDVKRWFI-HUUCEWRRSA-N 1 1 241.419 3.702 20 0 BHADMO CC[C@H]1CCCC[C@H]1[N@@H+](C)CCCOC(C)C ZINC000444662603 387903754 /nfs/dbraw/zinc/90/37/54/387903754.db2.gz NCKMTVKDVKRWFI-LSDHHAIUSA-N 1 1 241.419 3.702 20 0 BHADMO C[C@H]1CCCC[C@@H]1[N@@H+](C)Cc1ncc(C2CC2)o1 ZINC000444663075 387902949 /nfs/dbraw/zinc/90/29/49/387902949.db2.gz OEWPLYXASPOXHQ-AAEUAGOBSA-N 1 1 248.370 3.563 20 0 BHADMO C[C@@H]1CCCC[C@H]1[N@@H+](C)Cc1ncc(C2CC2)o1 ZINC000444663077 387903055 /nfs/dbraw/zinc/90/30/55/387903055.db2.gz OEWPLYXASPOXHQ-DGCLKSJQSA-N 1 1 248.370 3.563 20 0 BHADMO C[C@H]1CCCC[C@H]1[N@@H+](C)Cc1ncc(C2CC2)o1 ZINC000444663078 387903226 /nfs/dbraw/zinc/90/32/26/387903226.db2.gz OEWPLYXASPOXHQ-WCQYABFASA-N 1 1 248.370 3.563 20 0 BHADMO C[C@@H]1CCCC[C@@H]1[N@@H+](C)Cc1ncc(C2CC2)o1 ZINC000444663079 387903632 /nfs/dbraw/zinc/90/36/32/387903632.db2.gz OEWPLYXASPOXHQ-YPMHNXCESA-N 1 1 248.370 3.563 20 0 BHADMO CC[N@@H+](CCCOC(C)C)[C@H]1CCCC[C@H]1C ZINC000444663321 387903282 /nfs/dbraw/zinc/90/32/82/387903282.db2.gz OHUAZIJMUFBSPH-CABCVRRESA-N 1 1 241.419 3.702 20 0 BHADMO CC[N@@H+](CCCOC(C)C)[C@H]1CCCC[C@@H]1C ZINC000444663322 387903939 /nfs/dbraw/zinc/90/39/39/387903939.db2.gz OHUAZIJMUFBSPH-GJZGRUSLSA-N 1 1 241.419 3.702 20 0 BHADMO CC[N@@H+](CCCOC(C)C)[C@@H]1CCCC[C@H]1C ZINC000444663323 387902277 /nfs/dbraw/zinc/90/22/77/387902277.db2.gz OHUAZIJMUFBSPH-HUUCEWRRSA-N 1 1 241.419 3.702 20 0 BHADMO CC[N@@H+](CCCOC(C)C)[C@@H]1CCCC[C@@H]1C ZINC000444663325 201615567 /nfs/dbraw/zinc/61/55/67/201615567.db2.gz OHUAZIJMUFBSPH-LSDHHAIUSA-N 1 1 241.419 3.702 20 0 BHADMO C[C@@H]1CCCC[C@H]1[N@@H+](C)CCCc1ccncc1 ZINC000444663433 387903770 /nfs/dbraw/zinc/90/37/70/387903770.db2.gz LFUFLJHVHKTCTC-GDBMZVCRSA-N 1 1 246.398 3.525 20 0 BHADMO C[C@H]1CCCC[C@H]1[N@@H+](C)CCCc1ccncc1 ZINC000444663435 387902870 /nfs/dbraw/zinc/90/28/70/387902870.db2.gz LFUFLJHVHKTCTC-GOEBONIOSA-N 1 1 246.398 3.525 20 0 BHADMO C[C@H]1CCCC[C@@H]1[N@@H+](C)CCCc1ccncc1 ZINC000444663436 387902170 /nfs/dbraw/zinc/90/21/70/387902170.db2.gz LFUFLJHVHKTCTC-HOCLYGCPSA-N 1 1 246.398 3.525 20 0 BHADMO C[C@@H]1CCCC[C@@H]1[N@@H+](C)CCCc1ccncc1 ZINC000444663438 387903087 /nfs/dbraw/zinc/90/30/87/387903087.db2.gz LFUFLJHVHKTCTC-ZBFHGGJFSA-N 1 1 246.398 3.525 20 0 BHADMO CC[N@@H+](CCCSC)[C@@H]1CCCC[C@H]1C ZINC000444663749 387902561 /nfs/dbraw/zinc/90/25/61/387902561.db2.gz PDXDCYCAQJJBKZ-CHWSQXEVSA-N 1 1 229.433 3.640 20 0 BHADMO CC[N@@H+](CCCSC)[C@H]1CCCC[C@H]1C ZINC000444663750 387903430 /nfs/dbraw/zinc/90/34/30/387903430.db2.gz PDXDCYCAQJJBKZ-OLZOCXBDSA-N 1 1 229.433 3.640 20 0 BHADMO CC[N@@H+](CCCSC)[C@@H]1CCCC[C@@H]1C ZINC000444663751 387902212 /nfs/dbraw/zinc/90/22/12/387902212.db2.gz PDXDCYCAQJJBKZ-QWHCGFSZSA-N 1 1 229.433 3.640 20 0 BHADMO CC[N@@H+](CCCSC)[C@H]1CCCC[C@@H]1C ZINC000444663754 387902887 /nfs/dbraw/zinc/90/28/87/387902887.db2.gz PDXDCYCAQJJBKZ-STQMWFEESA-N 1 1 229.433 3.640 20 0 BHADMO CC[N@@H+](Cc1cnccc1C)[C@@H]1CCCC[C@H]1C ZINC000444664574 387902855 /nfs/dbraw/zinc/90/28/55/387902855.db2.gz RHDCHHCZFAGKIZ-GDBMZVCRSA-N 1 1 246.398 3.791 20 0 BHADMO CC[N@@H+](Cc1cnccc1C)[C@@H]1CCCC[C@@H]1C ZINC000444664575 387903932 /nfs/dbraw/zinc/90/39/32/387903932.db2.gz RHDCHHCZFAGKIZ-GOEBONIOSA-N 1 1 246.398 3.791 20 0 BHADMO CC[N@@H+](Cc1cnccc1C)[C@H]1CCCC[C@@H]1C ZINC000444664576 387904360 /nfs/dbraw/zinc/90/43/60/387904360.db2.gz RHDCHHCZFAGKIZ-HOCLYGCPSA-N 1 1 246.398 3.791 20 0 BHADMO CC[N@@H+](Cc1cnccc1C)[C@H]1CCCC[C@H]1C ZINC000444664577 387903992 /nfs/dbraw/zinc/90/39/92/387903992.db2.gz RHDCHHCZFAGKIZ-ZBFHGGJFSA-N 1 1 246.398 3.791 20 0 BHADMO FC(F)(F)CC[N@H+]1CCCC2(CCCC2)C1 ZINC000444684679 387909078 /nfs/dbraw/zinc/90/90/78/387909078.db2.gz LAORVLSNZODPAX-UHFFFAOYSA-N 1 1 235.293 3.595 20 0 BHADMO C[N@@H+](CC1(c2ccccc2)CC1)[C@H]1C=CCCC1 ZINC000444686114 387909129 /nfs/dbraw/zinc/90/91/29/387909129.db2.gz RFBAYLAJKJSQHR-INIZCTEOSA-N 1 1 241.378 3.759 20 0 BHADMO C[N@@H+](CC1(c2ccccc2)CC1)[C@@H]1C=CCCC1 ZINC000444686115 387908748 /nfs/dbraw/zinc/90/87/48/387908748.db2.gz RFBAYLAJKJSQHR-MRXNPFEDSA-N 1 1 241.378 3.759 20 0 BHADMO FC(F)(F)C[C@H]1CC[N@@H+](CC2CCCCC2)C1 ZINC000444689167 387910162 /nfs/dbraw/zinc/91/01/62/387910162.db2.gz FJZQTGQZDDCYRW-GFCCVEGCSA-N 1 1 249.320 3.841 20 0 BHADMO FC(F)(F)C[C@@H]1CC[N@@H+](CC2CCCCC2)C1 ZINC000444689170 387910864 /nfs/dbraw/zinc/91/08/64/387910864.db2.gz FJZQTGQZDDCYRW-LBPRGKRZSA-N 1 1 249.320 3.841 20 0 BHADMO COCCCCC[N@@H+](C)Cc1cc(C)cc(C)c1 ZINC000444692304 387910695 /nfs/dbraw/zinc/91/06/95/387910695.db2.gz FAOTVGNKDVDPQT-UHFFFAOYSA-N 1 1 249.398 3.552 20 0 BHADMO C[N@@H+](Cc1cc(F)cc(F)c1)[C@H]1C=CCCC1 ZINC000444694597 387910246 /nfs/dbraw/zinc/91/02/46/387910246.db2.gz BDUVYZNSZVHBFE-AWEZNQCLSA-N 1 1 237.293 3.505 20 0 BHADMO C[N@@H+](Cc1cc(F)cc(F)c1)[C@@H]1C=CCCC1 ZINC000444694609 387910794 /nfs/dbraw/zinc/91/07/94/387910794.db2.gz BDUVYZNSZVHBFE-CQSZACIVSA-N 1 1 237.293 3.505 20 0 BHADMO COC(C)(C)CC[N@@H+](C)Cc1cc(C)cc(C)c1 ZINC000444695515 387911280 /nfs/dbraw/zinc/91/12/80/387911280.db2.gz FHXLFOIECJMUOZ-UHFFFAOYSA-N 1 1 249.398 3.550 20 0 BHADMO CC(C)CCC[N@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000444698625 387912850 /nfs/dbraw/zinc/91/28/50/387912850.db2.gz CTCKZBZVCJKNLE-LLVKDONJSA-N 1 1 237.309 3.697 20 0 BHADMO CC(C)CCC[N@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000444698626 387912873 /nfs/dbraw/zinc/91/28/73/387912873.db2.gz CTCKZBZVCJKNLE-NSHDSACASA-N 1 1 237.309 3.697 20 0 BHADMO CCCCC[N@@H+](C)Cc1cc(F)cc(F)c1 ZINC000444702042 387912513 /nfs/dbraw/zinc/91/25/13/387912513.db2.gz HOXNNPQDABKXQI-UHFFFAOYSA-N 1 1 227.298 3.587 20 0 BHADMO FC(F)(F)C[C@H]1CC[N@@H+](CCC2CCCC2)C1 ZINC000444708724 387915367 /nfs/dbraw/zinc/91/53/67/387915367.db2.gz OZTYPTZSXIEEMQ-GFCCVEGCSA-N 1 1 249.320 3.841 20 0 BHADMO FC(F)(F)C[C@@H]1CC[N@@H+](CCC2CCCC2)C1 ZINC000444708726 387914931 /nfs/dbraw/zinc/91/49/31/387914931.db2.gz OZTYPTZSXIEEMQ-LBPRGKRZSA-N 1 1 249.320 3.841 20 0 BHADMO CC/C=C\CC[N@@H+](C)Cc1cc(F)cc(F)c1 ZINC000444710332 387915103 /nfs/dbraw/zinc/91/51/03/387915103.db2.gz VAKINYSEVPXLPA-PLNGDYQASA-N 1 1 239.309 3.753 20 0 BHADMO CC/C=C/CC[N@@H+](C)Cc1cc(F)cc(F)c1 ZINC000444710419 387915166 /nfs/dbraw/zinc/91/51/66/387915166.db2.gz VAKINYSEVPXLPA-SNAWJCMRSA-N 1 1 239.309 3.753 20 0 BHADMO CC/C=C\CC[N@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000444715729 711786044 /nfs/dbraw/zinc/78/60/44/711786044.db2.gz HSPWAZJXWHTPON-BYCRGOAPSA-N 1 1 235.293 3.617 20 0 BHADMO CC/C=C\CC[N@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000444715730 711786049 /nfs/dbraw/zinc/78/60/49/711786049.db2.gz HSPWAZJXWHTPON-DLRQAJBASA-N 1 1 235.293 3.617 20 0 BHADMO CC/C=C/CC[N@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000444715731 387907811 /nfs/dbraw/zinc/90/78/11/387907811.db2.gz HSPWAZJXWHTPON-PGLGOXFNSA-N 1 1 235.293 3.617 20 0 BHADMO CC/C=C/CC[N@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000444715732 387907674 /nfs/dbraw/zinc/90/76/74/387907674.db2.gz HSPWAZJXWHTPON-UFFNRZRYSA-N 1 1 235.293 3.617 20 0 BHADMO Cc1ccc(F)c(C[N@H+](C)[C@H]2C=CCCC2)c1 ZINC000444737946 387920065 /nfs/dbraw/zinc/92/00/65/387920065.db2.gz CCIZOCJRPVJVOL-AWEZNQCLSA-N 1 1 233.330 3.675 20 0 BHADMO Cc1ccc(F)c(C[N@H+](C)[C@@H]2C=CCCC2)c1 ZINC000444737949 387920616 /nfs/dbraw/zinc/92/06/16/387920616.db2.gz CCIZOCJRPVJVOL-CQSZACIVSA-N 1 1 233.330 3.675 20 0 BHADMO Cc1cc(C[N@H+](C)[C@H]2C=CCCC2)ccc1F ZINC000444743530 387919883 /nfs/dbraw/zinc/91/98/83/387919883.db2.gz ZODWLRCZTXJJCB-AWEZNQCLSA-N 1 1 233.330 3.675 20 0 BHADMO Cc1cc(C[N@H+](C)[C@@H]2C=CCCC2)ccc1F ZINC000444743532 387918507 /nfs/dbraw/zinc/91/85/07/387918507.db2.gz ZODWLRCZTXJJCB-CQSZACIVSA-N 1 1 233.330 3.675 20 0 BHADMO CC(C)[C@H]1CCC[N@H+]([C@@H](C)c2ccccn2)C1 ZINC000444750748 387920333 /nfs/dbraw/zinc/92/03/33/387920333.db2.gz JAGMTVBBRIIZIW-KBPBESRZSA-N 1 1 232.371 3.511 20 0 BHADMO CC(C)[C@H]1CCC[N@H+]([C@H](C)c2ccccn2)C1 ZINC000444750749 387919753 /nfs/dbraw/zinc/91/97/53/387919753.db2.gz JAGMTVBBRIIZIW-KGLIPLIRSA-N 1 1 232.371 3.511 20 0 BHADMO CC(C)[C@@H]1CCC[N@H+]([C@@H](C)c2ccccn2)C1 ZINC000444750750 387920408 /nfs/dbraw/zinc/92/04/08/387920408.db2.gz JAGMTVBBRIIZIW-UONOGXRCSA-N 1 1 232.371 3.511 20 0 BHADMO CC(C)[C@@H]1CCC[N@H+]([C@H](C)c2ccccn2)C1 ZINC000444750751 387919079 /nfs/dbraw/zinc/91/90/79/387919079.db2.gz JAGMTVBBRIIZIW-ZIAGYGMSSA-N 1 1 232.371 3.511 20 0 BHADMO CC(C)[C@@H]1CCC[N@H+]([C@@H](C)c2cccnc2)C1 ZINC000444750760 387919992 /nfs/dbraw/zinc/91/99/92/387919992.db2.gz JGDPZGXUNMRHKT-DZGCQCFKSA-N 1 1 232.371 3.511 20 0 BHADMO CC(C)[C@H]1CCC[N@H+]([C@H](C)c2cccnc2)C1 ZINC000444750761 387922102 /nfs/dbraw/zinc/92/21/02/387922102.db2.gz JGDPZGXUNMRHKT-HIFRSBDPSA-N 1 1 232.371 3.511 20 0 BHADMO CC(C)[C@@H]1CCC[N@H+]([C@H](C)c2cccnc2)C1 ZINC000444750762 387922486 /nfs/dbraw/zinc/92/24/86/387922486.db2.gz JGDPZGXUNMRHKT-UKRRQHHQSA-N 1 1 232.371 3.511 20 0 BHADMO CC(C)[C@H]1CCC[N@H+]([C@@H](C)c2cccnc2)C1 ZINC000444750763 387921931 /nfs/dbraw/zinc/92/19/31/387921931.db2.gz JGDPZGXUNMRHKT-ZFWWWQNUSA-N 1 1 232.371 3.511 20 0 BHADMO CC(C)[N@@H+](CC1CCC1)[C@H]1C=CCCC1 ZINC000444762528 387924723 /nfs/dbraw/zinc/92/47/23/387924723.db2.gz ABDIFDJLERUAGG-AWEZNQCLSA-N 1 1 207.361 3.606 20 0 BHADMO CC(C)[N@@H+](CC1CCC1)[C@@H]1C=CCCC1 ZINC000444762529 387923917 /nfs/dbraw/zinc/92/39/17/387923917.db2.gz ABDIFDJLERUAGG-CQSZACIVSA-N 1 1 207.361 3.606 20 0 BHADMO CC(C)[N@@H+](CC1CCC1)CC1CCCC1 ZINC000444766746 201631189 /nfs/dbraw/zinc/63/11/89/201631189.db2.gz OZRKTOFHKPSIBF-UHFFFAOYSA-N 1 1 209.377 3.687 20 0 BHADMO CC(C)[N@H+](Cc1ncc(C2CC2)o1)CC1CCC1 ZINC000444767154 387924337 /nfs/dbraw/zinc/92/43/37/387924337.db2.gz QYRNBFJOVBPBRP-UHFFFAOYSA-N 1 1 248.370 3.563 20 0 BHADMO CC(C)[N@@H+](CCCc1ccncc1)CC1CCC1 ZINC000444769139 387923992 /nfs/dbraw/zinc/92/39/92/387923992.db2.gz HORFIZXUHCPVOH-UHFFFAOYSA-N 1 1 246.398 3.525 20 0 BHADMO Cc1ccc(C[N@H+](CC2CCC2)C(C)C)c(C)n1 ZINC000444770808 387927758 /nfs/dbraw/zinc/92/77/58/387927758.db2.gz FYMCYVFHCUBMPM-UHFFFAOYSA-N 1 1 246.398 3.709 20 0 BHADMO Cc1ccc(C[N@@H+]2CCC[C@H](C(C)C)C2)c(C)n1 ZINC000444771792 387926412 /nfs/dbraw/zinc/92/64/12/387926412.db2.gz KMSLSXMUVWFOGW-HNNXBMFYSA-N 1 1 246.398 3.566 20 0 BHADMO Cc1ccc(C[N@@H+]2CCC[C@@H](C(C)C)C2)c(C)n1 ZINC000444771793 387928363 /nfs/dbraw/zinc/92/83/63/387928363.db2.gz KMSLSXMUVWFOGW-OAHLLOKOSA-N 1 1 246.398 3.566 20 0 BHADMO c1ccc(CCC[N@H+]2CCCC23CCC3)cc1 ZINC000444773121 387927174 /nfs/dbraw/zinc/92/71/74/387927174.db2.gz CGBOVCNKWBTQDR-UHFFFAOYSA-N 1 1 229.367 3.638 20 0 BHADMO Cc1ccccc1C[N@H+]1CCCC12CCC2 ZINC000444774052 387927584 /nfs/dbraw/zinc/92/75/84/387927584.db2.gz HHZGXHFURWBXHU-UHFFFAOYSA-N 1 1 215.340 3.514 20 0 BHADMO c1cc(C[N@H+]2CCCC23CCC3)cc2c1CCC2 ZINC000444775918 201635485 /nfs/dbraw/zinc/63/54/85/201635485.db2.gz BCUMDSXGYKBNNK-UHFFFAOYSA-N 1 1 241.378 3.694 20 0 BHADMO Cc1ccccc1[C@@H](CC(F)(F)F)[NH2+]CCF ZINC000444775992 387927881 /nfs/dbraw/zinc/92/78/81/387927881.db2.gz BTDFFKOTAAZNQC-LLVKDONJSA-N 1 1 249.251 3.548 20 0 BHADMO Cc1ccccc1[C@H](CC(F)(F)F)[NH2+]CCF ZINC000444775993 387927278 /nfs/dbraw/zinc/92/72/78/387927278.db2.gz BTDFFKOTAAZNQC-NSHDSACASA-N 1 1 249.251 3.548 20 0 BHADMO Clc1ccccc1C[N@H+]1CCCC12CCC2 ZINC000444776373 387930086 /nfs/dbraw/zinc/93/00/86/387930086.db2.gz CIXRWKDXFWYRPV-UHFFFAOYSA-N 1 1 235.758 3.859 20 0 BHADMO Clc1ccc(C[N@H+]2CCCC23CCC3)s1 ZINC000444777198 387930449 /nfs/dbraw/zinc/93/04/49/387930449.db2.gz FELZJMLJUVHJGO-UHFFFAOYSA-N 1 1 241.787 3.920 20 0 BHADMO CCc1ccccc1C[N@H+]1CCCC12CCC2 ZINC000444777337 387928969 /nfs/dbraw/zinc/92/89/69/387928969.db2.gz RXAQTPCGXOMSNY-UHFFFAOYSA-N 1 1 229.367 3.768 20 0 BHADMO CC(C)(C)OCCCC[N@H+]1CCCC12CCC2 ZINC000444777520 387930802 /nfs/dbraw/zinc/93/08/02/387930802.db2.gz FXGOGBYAUAYHRW-UHFFFAOYSA-N 1 1 239.403 3.600 20 0 BHADMO c1c2ccccc2oc1C[N@H+]1CCCC12CCC2 ZINC000444777862 387930780 /nfs/dbraw/zinc/93/07/80/387930780.db2.gz HDNICGZDUIZYND-UHFFFAOYSA-N 1 1 241.334 3.951 20 0 BHADMO C(=C/c1ccccc1)\C[N@H+]1CCCC12CCC2 ZINC000444778395 387930644 /nfs/dbraw/zinc/93/06/44/387930644.db2.gz IKBRUWRTCNTCMO-RUDMXATFSA-N 1 1 227.351 3.718 20 0 BHADMO C(=C\c1ccccc1)\C[N@H+]1CCCC12CCC2 ZINC000444778397 387930008 /nfs/dbraw/zinc/93/00/08/387930008.db2.gz IKBRUWRTCNTCMO-WTKPLQERSA-N 1 1 227.351 3.718 20 0 BHADMO CC(C)CSCCC[N@H+]1CCCC12CCC2 ZINC000444778431 387928900 /nfs/dbraw/zinc/92/89/00/387928900.db2.gz IMSKJTAULGIBGO-UHFFFAOYSA-N 1 1 241.444 3.784 20 0 BHADMO CCOc1ccc(C[N@H+]2CCCC23CCC3)cc1 ZINC000444778563 387930231 /nfs/dbraw/zinc/93/02/31/387930231.db2.gz JETVSPUTIWFZCV-UHFFFAOYSA-N 1 1 245.366 3.604 20 0 BHADMO CSc1ccc(C[N@H+]2CCCC23CCC3)cc1 ZINC000444780025 387930921 /nfs/dbraw/zinc/93/09/21/387930921.db2.gz MGOKIWNGUSIERP-UHFFFAOYSA-N 1 1 247.407 3.927 20 0 BHADMO COc1ccc(C)cc1C[N@H+]1CCCC12CCC2 ZINC000444780483 387930019 /nfs/dbraw/zinc/93/00/19/387930019.db2.gz MUVBNEDJVLDZHL-UHFFFAOYSA-N 1 1 245.366 3.522 20 0 BHADMO C(C[N@H+]1CCCC12CCC2)C1CCCC1 ZINC000444781430 387930766 /nfs/dbraw/zinc/93/07/66/387930766.db2.gz ASGUVLPNYCIGIL-UHFFFAOYSA-N 1 1 207.361 3.585 20 0 BHADMO Cc1cc(C)cc(C[N@H+]2CCCC23CCC3)c1 ZINC000444782102 387929476 /nfs/dbraw/zinc/92/94/76/387929476.db2.gz HSRXFTDJVPZXBE-UHFFFAOYSA-N 1 1 229.367 3.822 20 0 BHADMO Cc1cccc(C[N@H+]2CCCC23CCC3)c1 ZINC000444782521 387929449 /nfs/dbraw/zinc/92/94/49/387929449.db2.gz JAHBKTIELQFSRG-UHFFFAOYSA-N 1 1 215.340 3.514 20 0 BHADMO Cc1ccc(C[N@H+]2CCCC23CCC3)cc1 ZINC000444782747 387929905 /nfs/dbraw/zinc/92/99/05/387929905.db2.gz JEZVPFNBDYXRAG-UHFFFAOYSA-N 1 1 215.340 3.514 20 0 BHADMO Clc1cccc(C[N@H+]2CCCC23CCC3)c1 ZINC000444783134 201637862 /nfs/dbraw/zinc/63/78/62/201637862.db2.gz JXMNDXZWCASVHM-UHFFFAOYSA-N 1 1 235.758 3.859 20 0 BHADMO Fc1cccc(CCC[N@H+]2CCCC23CCC3)c1 ZINC000444783539 387929264 /nfs/dbraw/zinc/92/92/64/387929264.db2.gz KXWLSULSLZHXNX-UHFFFAOYSA-N 1 1 247.357 3.777 20 0 BHADMO C[C@@H](C[N@H+]1CCCC12CCC2)c1ccccc1 ZINC000444783587 384304089 /nfs/dbraw/zinc/30/40/89/384304089.db2.gz LFPRJDPKZXTGGL-AWEZNQCLSA-N 1 1 229.367 3.809 20 0 BHADMO C[C@H](C[N@H+]1CCCC12CCC2)c1ccccc1 ZINC000444783588 384304389 /nfs/dbraw/zinc/30/43/89/384304389.db2.gz LFPRJDPKZXTGGL-CQSZACIVSA-N 1 1 229.367 3.809 20 0 BHADMO Cc1ccc(CC[N@H+]2CCCC23CCC3)cc1 ZINC000444783804 387929325 /nfs/dbraw/zinc/92/93/25/387929325.db2.gz LUCPLQTTYMYYHI-UHFFFAOYSA-N 1 1 229.367 3.556 20 0 BHADMO Cc1ccc(C[N@H+]2CCCC23CCC3)cc1C ZINC000444783968 387930564 /nfs/dbraw/zinc/93/05/64/387930564.db2.gz MFDNAUMVWAVSGJ-UHFFFAOYSA-N 1 1 229.367 3.822 20 0 BHADMO C(C1CCCCC1)[N@H+]1CCCC12CCC2 ZINC000444784101 387929188 /nfs/dbraw/zinc/92/91/88/387929188.db2.gz USLXYJWIVHACAS-UHFFFAOYSA-N 1 1 207.361 3.585 20 0 BHADMO Cc1ccc(F)cc1C[N@H+]1CCCC12CCC2 ZINC000444786965 201636283 /nfs/dbraw/zinc/63/62/83/201636283.db2.gz PIPRMTZGYBMQJV-UHFFFAOYSA-N 1 1 233.330 3.653 20 0 BHADMO Cc1cc(C[N@H+]2CCCC23CCC3)c(C)s1 ZINC000444787137 387933074 /nfs/dbraw/zinc/93/30/74/387933074.db2.gz WZMCEICOMDLBBM-UHFFFAOYSA-N 1 1 235.396 3.883 20 0 BHADMO Cc1cccc(C)c1C[N@H+]1CCCC12CCC2 ZINC000444787373 387931949 /nfs/dbraw/zinc/93/19/49/387931949.db2.gz XIUCSODIXMGLRA-UHFFFAOYSA-N 1 1 229.367 3.822 20 0 BHADMO c1ccc(SCC[N@H+]2CCCC23CCC3)cc1 ZINC000444788328 387933130 /nfs/dbraw/zinc/93/31/30/387933130.db2.gz UJBCDHRJYGOJMC-UHFFFAOYSA-N 1 1 247.407 3.797 20 0 BHADMO CSc1ccccc1C[N@H+]1CCCC12CCC2 ZINC000444788425 387932159 /nfs/dbraw/zinc/93/21/59/387932159.db2.gz VIDDJBBHCVIZSI-UHFFFAOYSA-N 1 1 247.407 3.927 20 0 BHADMO c1cc(CCC[N@H+]2CCCC23CCC3)cs1 ZINC000444789103 387931523 /nfs/dbraw/zinc/93/15/23/387931523.db2.gz ZKKCTJDJFNXAHH-UHFFFAOYSA-N 1 1 235.396 3.699 20 0 BHADMO Cc1ccc(C)c(C[N@H+]2CCCC23CCC3)c1 ZINC000444789858 387932624 /nfs/dbraw/zinc/93/26/24/387932624.db2.gz GGLHIKUIJMSIOF-UHFFFAOYSA-N 1 1 229.367 3.822 20 0 BHADMO CC[N@H+]1CCCC[C@@H]1c1cccc(Cl)c1 ZINC000444797183 388585678 /nfs/dbraw/zinc/58/56/78/388585678.db2.gz XJTURCCVEIEDCQ-CYBMUJFWSA-N 1 1 223.747 3.887 20 0 BHADMO CC[N@H+]1CCCC[C@H]1c1cccc(Cl)c1 ZINC000444797184 388585661 /nfs/dbraw/zinc/58/56/61/388585661.db2.gz XJTURCCVEIEDCQ-ZDUSSCGKSA-N 1 1 223.747 3.887 20 0 BHADMO C[C@H](C1CC1)[N@@H+](C)CCc1ccc(Cl)cc1 ZINC000445204905 385162175 /nfs/dbraw/zinc/16/21/75/385162175.db2.gz CMQZMXJOLFNICJ-LLVKDONJSA-N 1 1 237.774 3.613 20 0 BHADMO C[C@@H](C1CC1)[N@@H+](C)CCc1ccc(Cl)cc1 ZINC000445204909 385161939 /nfs/dbraw/zinc/16/19/39/385161939.db2.gz CMQZMXJOLFNICJ-NSHDSACASA-N 1 1 237.774 3.613 20 0 BHADMO Cc1ccccc1C[C@H](C)[N@H+](C)CC(C)C ZINC000445223389 384593283 /nfs/dbraw/zinc/59/32/83/384593283.db2.gz UOQCYMGVMWENPF-AWEZNQCLSA-N 1 1 219.372 3.514 20 0 BHADMO Cc1ccccc1C[C@@H](C)[N@H+](C)CC(C)C ZINC000445223390 384593860 /nfs/dbraw/zinc/59/38/60/384593860.db2.gz UOQCYMGVMWENPF-CQSZACIVSA-N 1 1 219.372 3.514 20 0 BHADMO CCC1(CC)CC[N@H+]([C@H](C)c2cccnc2)C1 ZINC000445256001 385718511 /nfs/dbraw/zinc/71/85/11/385718511.db2.gz AYPYLRZRPMRTKU-CYBMUJFWSA-N 1 1 232.371 3.655 20 0 BHADMO CCC1(CC)CC[N@H+]([C@@H](C)c2cccnc2)C1 ZINC000445256015 385719950 /nfs/dbraw/zinc/71/99/50/385719950.db2.gz AYPYLRZRPMRTKU-ZDUSSCGKSA-N 1 1 232.371 3.655 20 0 BHADMO CSCC[N@@H+](C)[C@H](C)c1ccc2c(c1)CCC2 ZINC000445304144 387654421 /nfs/dbraw/zinc/65/44/21/387654421.db2.gz YCQJMMLKLOGNPE-GFCCVEGCSA-N 1 1 249.423 3.531 20 0 BHADMO CSCC[N@@H+](C)[C@@H](C)c1ccc2c(c1)CCC2 ZINC000445304155 387653937 /nfs/dbraw/zinc/65/39/37/387653937.db2.gz YCQJMMLKLOGNPE-LBPRGKRZSA-N 1 1 249.423 3.531 20 0 BHADMO CC[C@@H]1CCCC[C@H]1[N@@H+](C)Cc1cccc(C)n1 ZINC000445351366 387982819 /nfs/dbraw/zinc/98/28/19/387982819.db2.gz TYKYNEQGCFTHMX-GDBMZVCRSA-N 1 1 246.398 3.791 20 0 BHADMO CC[C@H]1CCCC[C@H]1[N@@H+](C)Cc1cccc(C)n1 ZINC000445351367 387981918 /nfs/dbraw/zinc/98/19/18/387981918.db2.gz TYKYNEQGCFTHMX-GOEBONIOSA-N 1 1 246.398 3.791 20 0 BHADMO CC[C@H]1CCCC[C@@H]1[N@@H+](C)Cc1cccc(C)n1 ZINC000445351368 387982426 /nfs/dbraw/zinc/98/24/26/387982426.db2.gz TYKYNEQGCFTHMX-HOCLYGCPSA-N 1 1 246.398 3.791 20 0 BHADMO CC[C@@H]1CCCC[C@@H]1[N@@H+](C)Cc1cccc(C)n1 ZINC000445351369 387982388 /nfs/dbraw/zinc/98/23/88/387982388.db2.gz TYKYNEQGCFTHMX-ZBFHGGJFSA-N 1 1 246.398 3.791 20 0 BHADMO C[C@H](c1ccc2c(c1)CCC2)[N@H+]1CCC=C(F)C1 ZINC000445424467 387392567 /nfs/dbraw/zinc/39/25/67/387392567.db2.gz VATGSEFJPOCHCR-GFCCVEGCSA-N 1 1 245.341 3.795 20 0 BHADMO C[C@H](c1ccc2c(c1)CCC2)[N@@H+]1CCC=C(F)C1 ZINC000445424467 387392562 /nfs/dbraw/zinc/39/25/62/387392562.db2.gz VATGSEFJPOCHCR-GFCCVEGCSA-N 1 1 245.341 3.795 20 0 BHADMO C[C@@H](c1ccc2c(c1)CCC2)[N@H+]1CCC=C(F)C1 ZINC000445424468 387391729 /nfs/dbraw/zinc/39/17/29/387391729.db2.gz VATGSEFJPOCHCR-LBPRGKRZSA-N 1 1 245.341 3.795 20 0 BHADMO C[C@@H](c1ccc2c(c1)CCC2)[N@@H+]1CCC=C(F)C1 ZINC000445424468 387391721 /nfs/dbraw/zinc/39/17/21/387391721.db2.gz VATGSEFJPOCHCR-LBPRGKRZSA-N 1 1 245.341 3.795 20 0 BHADMO CC[C@H]1CC[N@H+]([C@H](C)c2ccc(F)cc2)C1 ZINC000445426222 387401451 /nfs/dbraw/zinc/40/14/51/387401451.db2.gz IQGLLYMNMKVPBA-NEPJUHHUSA-N 1 1 221.319 3.619 20 0 BHADMO CC[C@@H]1CC[N@H+]([C@@H](C)c2ccc(F)cc2)C1 ZINC000445426226 387401113 /nfs/dbraw/zinc/40/11/13/387401113.db2.gz IQGLLYMNMKVPBA-NWDGAFQWSA-N 1 1 221.319 3.619 20 0 BHADMO CC[C@H]1CC[N@H+]([C@@H](C)c2ccc(F)cc2)C1 ZINC000445426227 387400765 /nfs/dbraw/zinc/40/07/65/387400765.db2.gz IQGLLYMNMKVPBA-RYUDHWBXSA-N 1 1 221.319 3.619 20 0 BHADMO CC[C@@H]1CC[N@H+]([C@H](C)c2ccc(F)cc2)C1 ZINC000445426228 387401342 /nfs/dbraw/zinc/40/13/42/387401342.db2.gz IQGLLYMNMKVPBA-VXGBXAGGSA-N 1 1 221.319 3.619 20 0 BHADMO CC[C@H]1CC[N@H+]([C@H](C)c2cccc(F)c2)C1 ZINC000445427185 387415538 /nfs/dbraw/zinc/41/55/38/387415538.db2.gz NVPIZYIRCMELIB-NEPJUHHUSA-N 1 1 221.319 3.619 20 0 BHADMO CC[C@@H]1CC[N@H+]([C@@H](C)c2cccc(F)c2)C1 ZINC000445427186 387416040 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ZINC000445427791 387431718 /nfs/dbraw/zinc/43/17/18/387431718.db2.gz RWMKUMYHAZNBRX-WDEREUQCSA-N 1 1 239.309 3.758 20 0 BHADMO CC[C@H]1CC[N@H+]([C@H](C)c2ccccc2F)C1 ZINC000445428649 387435411 /nfs/dbraw/zinc/43/54/11/387435411.db2.gz XIYZMZJEAWXYHP-NEPJUHHUSA-N 1 1 221.319 3.619 20 0 BHADMO CC[C@@H]1CC[N@H+]([C@@H](C)c2ccccc2F)C1 ZINC000445428650 387433592 /nfs/dbraw/zinc/43/35/92/387433592.db2.gz XIYZMZJEAWXYHP-NWDGAFQWSA-N 1 1 221.319 3.619 20 0 BHADMO CC[C@H]1CC[N@H+]([C@@H](C)c2ccccc2F)C1 ZINC000445428651 387433431 /nfs/dbraw/zinc/43/34/31/387433431.db2.gz XIYZMZJEAWXYHP-RYUDHWBXSA-N 1 1 221.319 3.619 20 0 BHADMO CC[C@@H]1CC[N@H+]([C@H](C)c2ccccc2F)C1 ZINC000445428652 387433707 /nfs/dbraw/zinc/43/37/07/387433707.db2.gz XIYZMZJEAWXYHP-VXGBXAGGSA-N 1 1 221.319 3.619 20 0 BHADMO CC[C@H]1CC[N@H+]([C@@H](C)c2cccc(C)c2)C1 ZINC000445432907 200876168 /nfs/dbraw/zinc/87/61/68/200876168.db2.gz ZNVUMNPTDQNLTO-KBPBESRZSA-N 1 1 217.356 3.788 20 0 BHADMO CC[C@H]1CC[N@H+]([C@H](C)c2cccc(C)c2)C1 ZINC000445432908 387875970 /nfs/dbraw/zinc/87/59/70/387875970.db2.gz ZNVUMNPTDQNLTO-KGLIPLIRSA-N 1 1 217.356 3.788 20 0 BHADMO CC[C@@H]1CC[N@H+]([C@@H](C)c2cccc(C)c2)C1 ZINC000445432909 387876004 /nfs/dbraw/zinc/87/60/04/387876004.db2.gz ZNVUMNPTDQNLTO-UONOGXRCSA-N 1 1 217.356 3.788 20 0 BHADMO CC[C@@H]1CC[N@H+]([C@H](C)c2cccc(C)c2)C1 ZINC000445432910 200875923 /nfs/dbraw/zinc/87/59/23/200875923.db2.gz ZNVUMNPTDQNLTO-ZIAGYGMSSA-N 1 1 217.356 3.788 20 0 BHADMO CC[C@@H]1CC[N@H+]([C@H](C)c2ccc(F)c(F)c2)C1 ZINC000445434141 387942169 /nfs/dbraw/zinc/94/21/69/387942169.db2.gz OSDJQFSMQZTNLB-GHMZBOCLSA-N 1 1 239.309 3.758 20 0 BHADMO CC[C@H]1CC[N@H+]([C@H](C)c2ccc(F)c(F)c2)C1 ZINC000445434142 387942875 /nfs/dbraw/zinc/94/28/75/387942875.db2.gz OSDJQFSMQZTNLB-MNOVXSKESA-N 1 1 239.309 3.758 20 0 BHADMO CC[C@H]1CC[N@H+]([C@@H](C)c2ccc(F)c(F)c2)C1 ZINC000445434143 387942604 /nfs/dbraw/zinc/94/26/04/387942604.db2.gz OSDJQFSMQZTNLB-QWRGUYRKSA-N 1 1 239.309 3.758 20 0 BHADMO CC[C@@H]1CC[N@H+]([C@@H](C)c2ccc(F)c(F)c2)C1 ZINC000445434144 387941013 /nfs/dbraw/zinc/94/10/13/387941013.db2.gz OSDJQFSMQZTNLB-WDEREUQCSA-N 1 1 239.309 3.758 20 0 BHADMO CC[C@H](c1ccccc1)[N@H+]1CC[C@H](CC)C1 ZINC000445434310 387941078 /nfs/dbraw/zinc/94/10/78/387941078.db2.gz RZTRNLDSEUGJNL-DZGCQCFKSA-N 1 1 217.356 3.870 20 0 BHADMO CC[C@@H](c1ccccc1)[N@H+]1CC[C@@H](CC)C1 ZINC000445434311 387941364 /nfs/dbraw/zinc/94/13/64/387941364.db2.gz RZTRNLDSEUGJNL-HIFRSBDPSA-N 1 1 217.356 3.870 20 0 BHADMO CC[C@H](c1ccccc1)[N@H+]1CC[C@@H](CC)C1 ZINC000445434312 387943180 /nfs/dbraw/zinc/94/31/80/387943180.db2.gz RZTRNLDSEUGJNL-UKRRQHHQSA-N 1 1 217.356 3.870 20 0 BHADMO CC[C@@H](c1ccccc1)[N@H+]1CC[C@H](CC)C1 ZINC000445434313 387942577 /nfs/dbraw/zinc/94/25/77/387942577.db2.gz RZTRNLDSEUGJNL-ZFWWWQNUSA-N 1 1 217.356 3.870 20 0 BHADMO CC[C@@H]1CC[N@H+]([C@H]2CCc3ccc(F)cc32)C1 ZINC000445435115 387952176 /nfs/dbraw/zinc/95/21/76/387952176.db2.gz FNGXEABUFLRQCU-ABAIWWIYSA-N 1 1 233.330 3.545 20 0 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239.309 3.758 20 0 BHADMO CC[C@@H]1CC[N@H+]([C@@H](C)c2ccc(F)cc2F)C1 ZINC000445437229 387987127 /nfs/dbraw/zinc/98/71/27/387987127.db2.gz ZLNISFXYZXAWPB-WDEREUQCSA-N 1 1 239.309 3.758 20 0 BHADMO Cc1ccccc1C[C@H](C)[N@@H+](C)CCC1CC1 ZINC000445438691 388003643 /nfs/dbraw/zinc/00/36/43/388003643.db2.gz JWGVELCLMKIGPG-AWEZNQCLSA-N 1 1 231.383 3.658 20 0 BHADMO Cc1ccccc1C[C@@H](C)[N@@H+](C)CCC1CC1 ZINC000445438692 388004329 /nfs/dbraw/zinc/00/43/29/388004329.db2.gz JWGVELCLMKIGPG-CQSZACIVSA-N 1 1 231.383 3.658 20 0 BHADMO C[C@@H](c1ccc2c(c1)CCC2)[N@H+]1CC[C@@](C)(F)C1 ZINC000445453306 387527623 /nfs/dbraw/zinc/52/76/23/387527623.db2.gz HRIAZCGHAKZDNB-BLLLJJGKSA-N 1 1 247.357 3.670 20 0 BHADMO C[C@@H](c1ccc2c(c1)CCC2)[N@H+]1CC[C@](C)(F)C1 ZINC000445453307 387528324 /nfs/dbraw/zinc/52/83/24/387528324.db2.gz HRIAZCGHAKZDNB-LRDDRELGSA-N 1 1 247.357 3.670 20 0 BHADMO C[C@H](c1ccc2c(c1)CCC2)[N@H+]1CC[C@@](C)(F)C1 ZINC000445453308 387527169 /nfs/dbraw/zinc/52/71/69/387527169.db2.gz HRIAZCGHAKZDNB-MLGOLLRUSA-N 1 1 247.357 3.670 20 0 BHADMO C[C@H](c1ccc2c(c1)CCC2)[N@H+]1CC[C@](C)(F)C1 ZINC000445453309 387527897 /nfs/dbraw/zinc/52/78/97/387527897.db2.gz HRIAZCGHAKZDNB-WBMJQRKESA-N 1 1 247.357 3.670 20 0 BHADMO CC(C)C[C@@H](C)[N@H+]1CCc2cc(F)ccc2C1 ZINC000445459095 387534727 /nfs/dbraw/zinc/53/47/27/387534727.db2.gz XOCVLHOEOZWISN-GFCCVEGCSA-N 1 1 235.346 3.618 20 0 BHADMO CC(C)C[C@H](C)[N@H+]1CCc2cc(F)ccc2C1 ZINC000445459096 206045863 /nfs/dbraw/zinc/04/58/63/206045863.db2.gz XOCVLHOEOZWISN-LBPRGKRZSA-N 1 1 235.346 3.618 20 0 BHADMO CC(C)C[C@H](C)[N@@H+]1CC=C(C(F)(F)F)CC1 ZINC000445466181 384903876 /nfs/dbraw/zinc/90/38/76/384903876.db2.gz ZQIVIMKKJRPWHM-JTQLQIEISA-N 1 1 235.293 3.615 20 0 BHADMO CC(C)C[C@@H](C)[N@@H+]1CC=C(C(F)(F)F)CC1 ZINC000445466182 384901568 /nfs/dbraw/zinc/90/15/68/384901568.db2.gz ZQIVIMKKJRPWHM-SNVBAGLBSA-N 1 1 235.293 3.615 20 0 BHADMO CC[C@@H]1CCCC[C@H]1[N@@H+](C)CCc1ccccn1 ZINC000445574882 387950183 /nfs/dbraw/zinc/95/01/83/387950183.db2.gz OSRQNZFAYINJKB-GDBMZVCRSA-N 1 1 246.398 3.525 20 0 BHADMO CC[C@H]1CCCC[C@H]1[N@@H+](C)CCc1ccccn1 ZINC000445574883 387950212 /nfs/dbraw/zinc/95/02/12/387950212.db2.gz OSRQNZFAYINJKB-GOEBONIOSA-N 1 1 246.398 3.525 20 0 BHADMO CC[C@H]1CCCC[C@@H]1[N@@H+](C)CCc1ccccn1 ZINC000445574884 387949796 /nfs/dbraw/zinc/94/97/96/387949796.db2.gz OSRQNZFAYINJKB-HOCLYGCPSA-N 1 1 246.398 3.525 20 0 BHADMO CC[C@@H]1CCCC[C@@H]1[N@@H+](C)CCc1ccccn1 ZINC000445574886 387950408 /nfs/dbraw/zinc/95/04/08/387950408.db2.gz OSRQNZFAYINJKB-ZBFHGGJFSA-N 1 1 246.398 3.525 20 0 BHADMO CC(C)C[C@H](C)[N@@H+](C)C[C@@H](C)c1nccs1 ZINC000445585611 201645277 /nfs/dbraw/zinc/64/52/77/201645277.db2.gz YOQCUSLJSAKDNO-NEPJUHHUSA-N 1 1 240.416 3.613 20 0 BHADMO CC(C)C[C@@H](C)[N@@H+](C)C[C@H](C)c1nccs1 ZINC000445585618 387950384 /nfs/dbraw/zinc/95/03/84/387950384.db2.gz YOQCUSLJSAKDNO-NWDGAFQWSA-N 1 1 240.416 3.613 20 0 BHADMO CC(C)C[C@H](C)[N@@H+](C)C[C@H](C)c1nccs1 ZINC000445585620 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PHKOSYDXLZGOHI-UHFFFAOYSA-N 1 1 241.737 3.711 20 0 BHADMO CC1=CC[N@@H+](Cc2cc(F)ccc2Cl)CC1 ZINC000445814023 387970645 /nfs/dbraw/zinc/97/06/45/387970645.db2.gz QDMWYBFAGSNWRI-UHFFFAOYSA-N 1 1 239.721 3.631 20 0 BHADMO CC1=CC[N@H+](Cc2cc(F)ccc2Cl)CC1 ZINC000445814023 387970643 /nfs/dbraw/zinc/97/06/43/387970643.db2.gz QDMWYBFAGSNWRI-UHFFFAOYSA-N 1 1 239.721 3.631 20 0 BHADMO CCc1ccccc1C[N@H+]1CCC[C@H]1CSC ZINC000445814232 387970550 /nfs/dbraw/zinc/97/05/50/387970550.db2.gz SZLFZTBYEHJMDL-HNNXBMFYSA-N 1 1 249.423 3.576 20 0 BHADMO CCc1ccccc1C[N@H+]1CCC[C@@H]1CSC ZINC000445814233 387971163 /nfs/dbraw/zinc/97/11/63/387971163.db2.gz SZLFZTBYEHJMDL-OAHLLOKOSA-N 1 1 249.423 3.576 20 0 BHADMO CCCCC[C@H]1CCC[N@H+]1Cc1cnoc1C ZINC000445814354 387970293 /nfs/dbraw/zinc/97/02/93/387970293.db2.gz VXSKLMSJPVSXFO-AWEZNQCLSA-N 1 1 236.359 3.528 20 0 BHADMO CCCCC[C@@H]1CCC[N@H+]1Cc1cnoc1C ZINC000445814355 387971029 /nfs/dbraw/zinc/97/10/29/387971029.db2.gz VXSKLMSJPVSXFO-CQSZACIVSA-N 1 1 236.359 3.528 20 0 BHADMO CC[N@@H+](Cc1cc(F)ccc1Cl)C1CCC1 ZINC000445815492 387969912 /nfs/dbraw/zinc/96/99/12/387969912.db2.gz LGNPOTZQVMWGKR-UHFFFAOYSA-N 1 1 241.737 3.854 20 0 BHADMO CCc1ccccc1C[N@H+](CC)C1CCC1 ZINC000445815537 387970689 /nfs/dbraw/zinc/97/06/89/387970689.db2.gz LPLCYWFHUYLODN-UHFFFAOYSA-N 1 1 217.356 3.623 20 0 BHADMO CCc1ccccc1C[N@H+]1CCC2(CCC2)C1 ZINC000445816728 387970670 /nfs/dbraw/zinc/97/06/70/387970670.db2.gz AFYMAURLGADUHE-UHFFFAOYSA-N 1 1 229.367 3.625 20 0 BHADMO Fc1ccc(Cl)c(C[N@H+]2CCC23CCC3)c1 ZINC000445821847 387972135 /nfs/dbraw/zinc/97/21/35/387972135.db2.gz YOKPRTNVONOHDH-UHFFFAOYSA-N 1 1 239.721 3.608 20 0 BHADMO Fc1ccc(Cl)c(C[N@@H+]2CCC23CCC3)c1 ZINC000445821847 387972131 /nfs/dbraw/zinc/97/21/31/387972131.db2.gz YOKPRTNVONOHDH-UHFFFAOYSA-N 1 1 239.721 3.608 20 0 BHADMO Cc1cccc(C[N@H+]2CCCC3(CCCC3)C2)n1 ZINC000445847703 387975320 /nfs/dbraw/zinc/97/53/20/387975320.db2.gz DNDGWPUFDILDSF-UHFFFAOYSA-N 1 1 244.382 3.546 20 0 BHADMO C[C@@H](c1ccccn1)[N@H+]1CCCC2(CCCC2)C1 ZINC000445862105 387974502 /nfs/dbraw/zinc/97/45/02/387974502.db2.gz FSAKAUXZVLXMCR-AWEZNQCLSA-N 1 1 244.382 3.799 20 0 BHADMO C[C@H](c1ccccn1)[N@H+]1CCCC2(CCCC2)C1 ZINC000445862106 387975417 /nfs/dbraw/zinc/97/54/17/387975417.db2.gz FSAKAUXZVLXMCR-CQSZACIVSA-N 1 1 244.382 3.799 20 0 BHADMO C[C@@H](c1cccnc1)[N@H+]1CCCC2(CCCC2)C1 ZINC000445869333 387976305 /nfs/dbraw/zinc/97/63/05/387976305.db2.gz PIECWHMABZGGGI-AWEZNQCLSA-N 1 1 244.382 3.799 20 0 BHADMO C[C@H](c1cccnc1)[N@H+]1CCCC2(CCCC2)C1 ZINC000445869334 387977297 /nfs/dbraw/zinc/97/72/97/387977297.db2.gz PIECWHMABZGGGI-CQSZACIVSA-N 1 1 244.382 3.799 20 0 BHADMO C1=C[C@H]([N@H+]2CCCC3(CCCC3)C2)CCC1 ZINC000445870720 387977397 /nfs/dbraw/zinc/97/73/97/387977397.db2.gz COCYSWYELLDDCF-AWEZNQCLSA-N 1 1 219.372 3.751 20 0 BHADMO C1=C[C@@H]([N@H+]2CCCC3(CCCC3)C2)CCC1 ZINC000445870721 387976316 /nfs/dbraw/zinc/97/63/16/387976316.db2.gz COCYSWYELLDDCF-CQSZACIVSA-N 1 1 219.372 3.751 20 0 BHADMO CCc1ccccc1C[N@H+]1CC[C@H]2CCC[C@H]21 ZINC000445990011 387983171 /nfs/dbraw/zinc/98/31/71/387983171.db2.gz ZXYDMCOSHVUNQI-GDBMZVCRSA-N 1 1 229.367 3.623 20 0 BHADMO CCc1ccccc1C[N@H+]1CC[C@@H]2CCC[C@H]21 ZINC000445990012 387982082 /nfs/dbraw/zinc/98/20/82/387982082.db2.gz ZXYDMCOSHVUNQI-GOEBONIOSA-N 1 1 229.367 3.623 20 0 BHADMO CCc1ccccc1C[N@H+]1CC[C@@H]2CCC[C@@H]21 ZINC000445990013 387981659 /nfs/dbraw/zinc/98/16/59/387981659.db2.gz ZXYDMCOSHVUNQI-HOCLYGCPSA-N 1 1 229.367 3.623 20 0 BHADMO CCc1ccccc1C[N@H+]1CC[C@H]2CCC[C@@H]21 ZINC000445990014 387982172 /nfs/dbraw/zinc/98/21/72/387982172.db2.gz ZXYDMCOSHVUNQI-ZBFHGGJFSA-N 1 1 229.367 3.623 20 0 BHADMO Cc1cnc([C@@H](C)[N@H+]2CCCCC(C)(C)C2)o1 ZINC000446057982 387987813 /nfs/dbraw/zinc/98/78/13/387987813.db2.gz CWFHAIBNKKPHDV-GFCCVEGCSA-N 1 1 236.359 3.556 20 0 BHADMO Cc1cnc([C@H](C)[N@H+]2CCCCC(C)(C)C2)o1 ZINC000446057985 387988332 /nfs/dbraw/zinc/98/83/32/387988332.db2.gz CWFHAIBNKKPHDV-LBPRGKRZSA-N 1 1 236.359 3.556 20 0 BHADMO Cc1ccc(C[N@H+]2CCCCC(C)(C)C2)c(C)n1 ZINC000446060281 201665544 /nfs/dbraw/zinc/66/55/44/201665544.db2.gz HIVJWGNICWIFPC-UHFFFAOYSA-N 1 1 246.398 3.711 20 0 BHADMO CC1(C)CCCC[N@H+]([C@@H]2C=CCCC2)C1 ZINC000446066278 201666849 /nfs/dbraw/zinc/66/68/49/201666849.db2.gz KATIRSHIGPDWRA-CYBMUJFWSA-N 1 1 207.361 3.607 20 0 BHADMO CC1(C)CCCC[N@H+]([C@H]2C=CCCC2)C1 ZINC000446066279 387989560 /nfs/dbraw/zinc/98/95/60/387989560.db2.gz KATIRSHIGPDWRA-ZDUSSCGKSA-N 1 1 207.361 3.607 20 0 BHADMO C[C@H](c1ccccn1)[N@H+]1CCCCC(C)(C)C1 ZINC000446068933 387992874 /nfs/dbraw/zinc/99/28/74/387992874.db2.gz GKWVEAQXMWANGF-CYBMUJFWSA-N 1 1 232.371 3.655 20 0 BHADMO C[C@@H](c1ccccn1)[N@H+]1CCCCC(C)(C)C1 ZINC000446068934 201666508 /nfs/dbraw/zinc/66/65/08/201666508.db2.gz GKWVEAQXMWANGF-ZDUSSCGKSA-N 1 1 232.371 3.655 20 0 BHADMO C[C@H](c1cccnc1)[N@H+]1CCCCC(C)(C)C1 ZINC000446069687 387992699 /nfs/dbraw/zinc/99/26/99/387992699.db2.gz FVOXKBCHYOZBMC-CYBMUJFWSA-N 1 1 232.371 3.655 20 0 BHADMO C[C@@H](c1cccnc1)[N@H+]1CCCCC(C)(C)C1 ZINC000446069688 387992801 /nfs/dbraw/zinc/99/28/01/387992801.db2.gz FVOXKBCHYOZBMC-ZDUSSCGKSA-N 1 1 232.371 3.655 20 0 BHADMO CC1(C)CCCC[N@@H+](CCCc2ccncc2)C1 ZINC000446073230 387995196 /nfs/dbraw/zinc/99/51/96/387995196.db2.gz XKABGIKMSYCNHZ-UHFFFAOYSA-N 1 1 246.398 3.526 20 0 BHADMO CC1(C)CCCC[N@@H+](Cc2ncc(C3CC3)o2)C1 ZINC000446074295 387995420 /nfs/dbraw/zinc/99/54/20/387995420.db2.gz RHRSXIXLTQUYBO-UHFFFAOYSA-N 1 1 248.370 3.564 20 0 BHADMO CC(C)=CCSCCCCn1cc[nH+]c1C ZINC000446127126 388001945 /nfs/dbraw/zinc/00/19/45/388001945.db2.gz PZYPSLABURZVDH-UHFFFAOYSA-N 1 1 238.400 3.671 20 0 BHADMO CCC1(CC)CC[N@H+]([C@@H]2C=CCCC2)C1 ZINC000446712895 388031219 /nfs/dbraw/zinc/03/12/19/388031219.db2.gz VSQRUSBKXPARCW-CYBMUJFWSA-N 1 1 207.361 3.607 20 0 BHADMO CCC1(CC)CC[N@H+]([C@H]2C=CCCC2)C1 ZINC000446712896 388031950 /nfs/dbraw/zinc/03/19/50/388031950.db2.gz VSQRUSBKXPARCW-ZDUSSCGKSA-N 1 1 207.361 3.607 20 0 BHADMO C[C@@]1(c2ccccc2)CC[N@H+]([C@H]2C=CCCC2)C1 ZINC000446716428 388032545 /nfs/dbraw/zinc/03/25/45/388032545.db2.gz ITBHJHBPFORXFL-DLBZAZTESA-N 1 1 241.378 3.759 20 0 BHADMO C[C@@]1(c2ccccc2)CC[N@H+]([C@@H]2C=CCCC2)C1 ZINC000446716429 388033553 /nfs/dbraw/zinc/03/35/53/388033553.db2.gz ITBHJHBPFORXFL-IAGOWNOFSA-N 1 1 241.378 3.759 20 0 BHADMO C[C@]1(c2ccccc2)CC[N@H+]([C@H]2C=CCCC2)C1 ZINC000446716431 388033371 /nfs/dbraw/zinc/03/33/71/388033371.db2.gz ITBHJHBPFORXFL-IRXDYDNUSA-N 1 1 241.378 3.759 20 0 BHADMO C[C@]1(c2ccccc2)CC[N@H+]([C@@H]2C=CCCC2)C1 ZINC000446716433 388033153 /nfs/dbraw/zinc/03/31/53/388033153.db2.gz ITBHJHBPFORXFL-SJORKVTESA-N 1 1 241.378 3.759 20 0 BHADMO CC[C@H]1CC[N@@H+](C[C@H](C)c2ccccc2)C1 ZINC000446716929 388033909 /nfs/dbraw/zinc/03/39/09/388033909.db2.gz NWLXDLYDVWCGPT-KBPBESRZSA-N 1 1 217.356 3.522 20 0 BHADMO CC[C@H]1CC[N@@H+](C[C@@H](C)c2ccccc2)C1 ZINC000446716930 388033502 /nfs/dbraw/zinc/03/35/02/388033502.db2.gz NWLXDLYDVWCGPT-KGLIPLIRSA-N 1 1 217.356 3.522 20 0 BHADMO CC[C@@H]1CC[N@@H+](C[C@H](C)c2ccccc2)C1 ZINC000446716931 388033426 /nfs/dbraw/zinc/03/34/26/388033426.db2.gz NWLXDLYDVWCGPT-UONOGXRCSA-N 1 1 217.356 3.522 20 0 BHADMO CC[C@@H]1CC[N@@H+](C[C@@H](C)c2ccccc2)C1 ZINC000446716932 388033815 /nfs/dbraw/zinc/03/38/15/388033815.db2.gz NWLXDLYDVWCGPT-ZIAGYGMSSA-N 1 1 217.356 3.522 20 0 BHADMO CC[C@@H]1CC[N@H+]([C@H](C)c2c(F)cccc2F)C1 ZINC000446738934 388035900 /nfs/dbraw/zinc/03/59/00/388035900.db2.gz OEYFOUCDKWWNAS-GHMZBOCLSA-N 1 1 239.309 3.758 20 0 BHADMO CC[C@H]1CC[N@H+]([C@H](C)c2c(F)cccc2F)C1 ZINC000446738935 388035762 /nfs/dbraw/zinc/03/57/62/388035762.db2.gz OEYFOUCDKWWNAS-MNOVXSKESA-N 1 1 239.309 3.758 20 0 BHADMO CC[C@H]1CC[N@H+]([C@@H](C)c2c(F)cccc2F)C1 ZINC000446738936 388035653 /nfs/dbraw/zinc/03/56/53/388035653.db2.gz OEYFOUCDKWWNAS-QWRGUYRKSA-N 1 1 239.309 3.758 20 0 BHADMO CC[C@@H]1CC[N@H+]([C@@H](C)c2c(F)cccc2F)C1 ZINC000446738937 388034876 /nfs/dbraw/zinc/03/48/76/388034876.db2.gz OEYFOUCDKWWNAS-WDEREUQCSA-N 1 1 239.309 3.758 20 0 BHADMO CCC(CC)n1ccc(C[N@@H+](C(C)C)C2CC2)n1 ZINC000446758596 388037017 /nfs/dbraw/zinc/03/70/17/388037017.db2.gz KCVPOQHOFCCKSD-UHFFFAOYSA-N 1 1 249.402 3.617 20 0 BHADMO CC[N@@H+](CC[C@H](C)c1ccccc1)CC1CC1 ZINC000446763798 388037924 /nfs/dbraw/zinc/03/79/24/388037924.db2.gz ZEXBGKHMWXWJJX-AWEZNQCLSA-N 1 1 231.383 3.912 20 0 BHADMO CC[N@@H+](CC[C@@H](C)c1ccccc1)CC1CC1 ZINC000446763799 388037952 /nfs/dbraw/zinc/03/79/52/388037952.db2.gz ZEXBGKHMWXWJJX-CQSZACIVSA-N 1 1 231.383 3.912 20 0 BHADMO C[C@H](CC[N@H+]1CCC=C(F)C1)c1ccccc1 ZINC000446821043 388040373 /nfs/dbraw/zinc/04/03/73/388040373.db2.gz KMKGEVCLCVIHGI-CYBMUJFWSA-N 1 1 233.330 3.739 20 0 BHADMO C[C@@H](CC[N@H+]1CCC=C(F)C1)c1ccccc1 ZINC000446821044 388041186 /nfs/dbraw/zinc/04/11/86/388041186.db2.gz KMKGEVCLCVIHGI-ZDUSSCGKSA-N 1 1 233.330 3.739 20 0 BHADMO CCOc1cccc(C[N@H+]2CCCC23CCC3)c1 ZINC000446832794 388040345 /nfs/dbraw/zinc/04/03/45/388040345.db2.gz AJKMGGFXDWGVFR-UHFFFAOYSA-N 1 1 245.366 3.604 20 0 BHADMO C[C@H]1C[C@H]1c1ccc(C[N@H+]2CCCC23CCC3)o1 ZINC000446835551 388040230 /nfs/dbraw/zinc/04/02/30/388040230.db2.gz PGDCTLUPEYOJLO-GXTWGEPZSA-N 1 1 245.366 3.922 20 0 BHADMO C[C@H]1C[C@@H]1c1ccc(C[N@H+]2CCCC23CCC3)o1 ZINC000446835552 388041147 /nfs/dbraw/zinc/04/11/47/388041147.db2.gz PGDCTLUPEYOJLO-JSGCOSHPSA-N 1 1 245.366 3.922 20 0 BHADMO C[C@@H]1C[C@@H]1c1ccc(C[N@H+]2CCCC23CCC3)o1 ZINC000446835553 388040815 /nfs/dbraw/zinc/04/08/15/388040815.db2.gz PGDCTLUPEYOJLO-OCCSQVGLSA-N 1 1 245.366 3.922 20 0 BHADMO C[C@@H]1C[C@H]1c1ccc(C[N@H+]2CCCC23CCC3)o1 ZINC000446835554 388041161 /nfs/dbraw/zinc/04/11/61/388041161.db2.gz PGDCTLUPEYOJLO-TZMCWYRMSA-N 1 1 245.366 3.922 20 0 BHADMO Cc1cc(C[N@H+]2CCCC23CCC3)ccc1F ZINC000446837381 388040129 /nfs/dbraw/zinc/04/01/29/388040129.db2.gz ZIVVYADHIMYWSD-UHFFFAOYSA-N 1 1 233.330 3.653 20 0 BHADMO CCC(CC)n1ccc(C[N@H+]2CCC[C@@H]2CC)n1 ZINC000446839494 388041049 /nfs/dbraw/zinc/04/10/49/388041049.db2.gz APDCTQWCBUBJHO-HNNXBMFYSA-N 1 1 249.402 3.619 20 0 BHADMO CCC(CC)n1ccc(C[N@H+]2CCC[C@H]2CC)n1 ZINC000446839495 388040968 /nfs/dbraw/zinc/04/09/68/388040968.db2.gz APDCTQWCBUBJHO-OAHLLOKOSA-N 1 1 249.402 3.619 20 0 BHADMO Cc1ccc(C[N@H+]2CCCC23CCC3)c(C)c1 ZINC000446840059 388040703 /nfs/dbraw/zinc/04/07/03/388040703.db2.gz WWDBFTTYUCTVFN-UHFFFAOYSA-N 1 1 229.367 3.822 20 0 BHADMO COc1ccc(C[N@H+]2CCCC23CCC3)cc1C ZINC000446842279 388042710 /nfs/dbraw/zinc/04/27/10/388042710.db2.gz DTXRGGXZLKUNEN-UHFFFAOYSA-N 1 1 245.366 3.522 20 0 BHADMO Cc1ccc(C[N@H+]2CCCC23CCC3)cc1F ZINC000446842453 388041964 /nfs/dbraw/zinc/04/19/64/388041964.db2.gz FQJUKEHIACCSCF-UHFFFAOYSA-N 1 1 233.330 3.653 20 0 BHADMO Fc1ccc(/C=C/C[N@H+]2CCCC23CCC3)cc1 ZINC000446842913 388042308 /nfs/dbraw/zinc/04/23/08/388042308.db2.gz IMZGBPCYHZGRTP-DAFODLJHSA-N 1 1 245.341 3.857 20 0 BHADMO Fc1ccc(/C=C\C[N@H+]2CCCC23CCC3)cc1 ZINC000446842914 388042024 /nfs/dbraw/zinc/04/20/24/388042024.db2.gz IMZGBPCYHZGRTP-RJRFIUFISA-N 1 1 245.341 3.857 20 0 BHADMO c1ccc([C@@H]2C[C@@H]2C[N@H+]2CCCC23CCC3)cc1 ZINC000446843308 388041702 /nfs/dbraw/zinc/04/17/02/388041702.db2.gz MHLIFLZQOZFSPR-CVEARBPZSA-N 1 1 241.378 3.809 20 0 BHADMO c1ccc([C@@H]2C[C@H]2C[N@H+]2CCCC23CCC3)cc1 ZINC000446843309 388042154 /nfs/dbraw/zinc/04/21/54/388042154.db2.gz MHLIFLZQOZFSPR-HOTGVXAUSA-N 1 1 241.378 3.809 20 0 BHADMO c1ccc([C@H]2C[C@@H]2C[N@H+]2CCCC23CCC3)cc1 ZINC000446843310 388042550 /nfs/dbraw/zinc/04/25/50/388042550.db2.gz MHLIFLZQOZFSPR-HZPDHXFCSA-N 1 1 241.378 3.809 20 0 BHADMO c1ccc([C@H]2C[C@H]2C[N@H+]2CCCC23CCC3)cc1 ZINC000446843311 388042456 /nfs/dbraw/zinc/04/24/56/388042456.db2.gz MHLIFLZQOZFSPR-JKSUJKDBSA-N 1 1 241.378 3.809 20 0 BHADMO C[C@H](C[N@H+]1CCCC12CCC2)c1ccc(F)cc1 ZINC000446843630 388041693 /nfs/dbraw/zinc/04/16/93/388041693.db2.gz BAQBTWUTKZWJEY-CYBMUJFWSA-N 1 1 247.357 3.948 20 0 BHADMO C[C@@H](C[N@H+]1CCCC12CCC2)c1ccc(F)cc1 ZINC000446843631 388042735 /nfs/dbraw/zinc/04/27/35/388042735.db2.gz BAQBTWUTKZWJEY-ZDUSSCGKSA-N 1 1 247.357 3.948 20 0 BHADMO c1oc2ccccc2c1C[N@H+]1CCCC12CCC2 ZINC000446844258 388042530 /nfs/dbraw/zinc/04/25/30/388042530.db2.gz RZVHSJQQRUVTQP-UHFFFAOYSA-N 1 1 241.334 3.951 20 0 BHADMO Cc1ccc(F)c(C[N@H+]2CCCC23CCC3)c1 ZINC000446845623 388041573 /nfs/dbraw/zinc/04/15/73/388041573.db2.gz OUVATKGWXMGMOW-UHFFFAOYSA-N 1 1 233.330 3.653 20 0 BHADMO Cc1ccc(C[N@H+]2CCCC23CCC3)s1 ZINC000446845836 201698640 /nfs/dbraw/zinc/69/86/40/201698640.db2.gz RQIPBABBNXXIFF-UHFFFAOYSA-N 1 1 221.369 3.575 20 0 BHADMO COc1cc(C[N@H+]2CCCC23CCC3)ccc1C ZINC000446848419 388042575 /nfs/dbraw/zinc/04/25/75/388042575.db2.gz RSGBLRVAILFOKD-UHFFFAOYSA-N 1 1 245.366 3.522 20 0 BHADMO Clc1sccc1C[N@H+]1CCCC12CCC2 ZINC000446849231 388042742 /nfs/dbraw/zinc/04/27/42/388042742.db2.gz XCZFBYWGBOSTTL-UHFFFAOYSA-N 1 1 241.787 3.920 20 0 BHADMO Cc1cccc(C[N@H+]2CCCC23CCC3)c1C ZINC000446851187 388042485 /nfs/dbraw/zinc/04/24/85/388042485.db2.gz HOSTUWFSXYMEIO-UHFFFAOYSA-N 1 1 229.367 3.822 20 0 BHADMO c1cc2cccc(C[N@H+]3CCCC34CCC4)c2[nH]1 ZINC000446853262 388041928 /nfs/dbraw/zinc/04/19/28/388041928.db2.gz OTCGNFKKBMEZSY-UHFFFAOYSA-N 1 1 240.350 3.686 20 0 BHADMO Cc1ccsc1C[N@H+]1CCCC12CCC2 ZINC000446853488 388042069 /nfs/dbraw/zinc/04/20/69/388042069.db2.gz QQSVUOFBMAUZIA-UHFFFAOYSA-N 1 1 221.369 3.575 20 0 BHADMO CC[C@H]([NH2+][C@@H](C)c1ccon1)c1cccc(F)c1 ZINC000446891200 201699182 /nfs/dbraw/zinc/69/91/82/201699182.db2.gz VNOAKLRHMKSFRH-GWCFXTLKSA-N 1 1 248.301 3.616 20 0 BHADMO CC[C@@H]([NH2+][C@@H](C)c1ccon1)c1cccc(F)c1 ZINC000446891201 388044481 /nfs/dbraw/zinc/04/44/81/388044481.db2.gz VNOAKLRHMKSFRH-GXFFZTMASA-N 1 1 248.301 3.616 20 0 BHADMO CC[C@H]([NH2+][C@H](C)c1ccon1)c1cccc(F)c1 ZINC000446891202 388043180 /nfs/dbraw/zinc/04/31/80/388043180.db2.gz VNOAKLRHMKSFRH-MFKMUULPSA-N 1 1 248.301 3.616 20 0 BHADMO CC[C@@H]([NH2+][C@H](C)c1ccon1)c1cccc(F)c1 ZINC000446891203 388043928 /nfs/dbraw/zinc/04/39/28/388043928.db2.gz VNOAKLRHMKSFRH-ZWNOBZJWSA-N 1 1 248.301 3.616 20 0 BHADMO CC(C)[N@H+](Cc1ccc(Cl)o1)CC1CCC1 ZINC000446911576 388043237 /nfs/dbraw/zinc/04/32/37/388043237.db2.gz STUVYLUHGNFCRD-UHFFFAOYSA-N 1 1 241.762 3.944 20 0 BHADMO Cc1ccoc1C[N@H+](CC1CCC1)C(C)C ZINC000446919317 388044269 /nfs/dbraw/zinc/04/42/69/388044269.db2.gz FVGUZZNHHNBILV-UHFFFAOYSA-N 1 1 221.344 3.599 20 0 BHADMO CCC[C@@H](C)C[N@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000446972685 388045846 /nfs/dbraw/zinc/04/58/46/388045846.db2.gz ATYYGJJGQODKQX-GHMZBOCLSA-N 1 1 237.309 3.697 20 0 BHADMO CCC[C@@H](C)C[N@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000446972686 388046776 /nfs/dbraw/zinc/04/67/76/388046776.db2.gz ATYYGJJGQODKQX-MNOVXSKESA-N 1 1 237.309 3.697 20 0 BHADMO CCC[C@H](C)C[N@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000446972687 388046643 /nfs/dbraw/zinc/04/66/43/388046643.db2.gz ATYYGJJGQODKQX-QWRGUYRKSA-N 1 1 237.309 3.697 20 0 BHADMO CCC[C@H](C)C[N@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000446972688 388046100 /nfs/dbraw/zinc/04/61/00/388046100.db2.gz ATYYGJJGQODKQX-WDEREUQCSA-N 1 1 237.309 3.697 20 0 BHADMO C[C@@H](C1CCCCC1)[N@@H+](C)Cc1ccco1 ZINC000447065983 388051171 /nfs/dbraw/zinc/05/11/71/388051171.db2.gz CMCXGBKNTHMGGP-LBPRGKRZSA-N 1 1 221.344 3.680 20 0 BHADMO CCSCC[N@@H+](C)[C@@H](C)C1CCCCC1 ZINC000447067752 388052304 /nfs/dbraw/zinc/05/23/04/388052304.db2.gz LNTWBCHEYPVKEW-LBPRGKRZSA-N 1 1 229.433 3.640 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@@H](C)C2CCCCC2)nc1 ZINC000447068960 206092495 /nfs/dbraw/zinc/09/24/95/206092495.db2.gz NJPCPGZDDYDYLI-AWEZNQCLSA-N 1 1 246.398 3.791 20 0 BHADMO C[C@@H](C1CCCCC1)[N@@H+](C)Cc1cscn1 ZINC000447071858 388051872 /nfs/dbraw/zinc/05/18/72/388051872.db2.gz DBJLYHOEKRLMOA-NSHDSACASA-N 1 1 238.400 3.544 20 0 BHADMO C[C@@H](C1CCCCC1)[N@@H+](C)Cc1cccc(O)c1 ZINC000447071868 388051992 /nfs/dbraw/zinc/05/19/92/388051992.db2.gz DGINGTGNBRPCGF-ZDUSSCGKSA-N 1 1 247.382 3.793 20 0 BHADMO Cc1cccnc1C[N@H+](C)[C@@H](C)C1CCCCC1 ZINC000447072301 388051379 /nfs/dbraw/zinc/05/13/79/388051379.db2.gz ISQXARFEEFCCRU-AWEZNQCLSA-N 1 1 246.398 3.791 20 0 BHADMO C[C@@H](C1CCCCC1)[N@@H+](C)Cc1cncs1 ZINC000447072593 388052321 /nfs/dbraw/zinc/05/23/21/388052321.db2.gz LTSALYLNRABYDP-NSHDSACASA-N 1 1 238.400 3.544 20 0 BHADMO CC(C)[C@@H]1CCN(c2cc[nH+]c3ccsc32)C1 ZINC000447073957 388050971 /nfs/dbraw/zinc/05/09/71/388050971.db2.gz ARERBETZCUSFEQ-LLVKDONJSA-N 1 1 246.379 3.779 20 0 BHADMO CC(C)[C@H]1CCN(c2cc[nH+]c3ccsc32)C1 ZINC000447073958 388050960 /nfs/dbraw/zinc/05/09/60/388050960.db2.gz ARERBETZCUSFEQ-NSHDSACASA-N 1 1 246.379 3.779 20 0 BHADMO C[C@@H](C1CCCCC1)[N@@H+](C)C[C@@H]1C[C@H]1C ZINC000447075463 388051613 /nfs/dbraw/zinc/05/16/13/388051613.db2.gz JZINPBJPAPWLCA-DYEKYZERSA-N 1 1 209.377 3.543 20 0 BHADMO C[C@@H](C1CCCCC1)[N@@H+](C)C[C@H]1C[C@H]1C ZINC000447075467 388052226 /nfs/dbraw/zinc/05/22/26/388052226.db2.gz JZINPBJPAPWLCA-MBNYWOFBSA-N 1 1 209.377 3.543 20 0 BHADMO C[C@@H](C1CCCCC1)[N@@H+](C)C[C@@H]1C[C@@H]1C ZINC000447075468 388051522 /nfs/dbraw/zinc/05/15/22/388051522.db2.gz JZINPBJPAPWLCA-OBJOEFQTSA-N 1 1 209.377 3.543 20 0 BHADMO C[C@@H](C1CCCCC1)[N@@H+](C)C[C@H]1C[C@@H]1C ZINC000447075469 388051396 /nfs/dbraw/zinc/05/13/96/388051396.db2.gz JZINPBJPAPWLCA-SGMGOOAPSA-N 1 1 209.377 3.543 20 0 BHADMO Cc1ccccc1C[C@H](C)[N@@H+](C)C[C@@H]1C[C@@H]1C ZINC000447093991 388053782 /nfs/dbraw/zinc/05/37/82/388053782.db2.gz OAOLZUPTCCSICD-DZKIICNBSA-N 1 1 231.383 3.514 20 0 BHADMO Cc1ccccc1C[C@H](C)[N@@H+](C)C[C@H]1C[C@H]1C ZINC000447093992 388053030 /nfs/dbraw/zinc/05/30/30/388053030.db2.gz OAOLZUPTCCSICD-IJEWVQPXSA-N 1 1 231.383 3.514 20 0 BHADMO Cc1ccccc1C[C@H](C)[N@@H+](C)C[C@H]1C[C@@H]1C ZINC000447093993 388053714 /nfs/dbraw/zinc/05/37/14/388053714.db2.gz OAOLZUPTCCSICD-OFQRWUPVSA-N 1 1 231.383 3.514 20 0 BHADMO Cc1ccccc1C[C@H](C)[N@@H+](C)C[C@@H]1C[C@H]1C ZINC000447093994 388053799 /nfs/dbraw/zinc/05/37/99/388053799.db2.gz OAOLZUPTCCSICD-YCPHGPKFSA-N 1 1 231.383 3.514 20 0 BHADMO C[N@@H+](CCc1cc(Cl)cc(Cl)c1)C1CC1 ZINC000447128464 388054583 /nfs/dbraw/zinc/05/45/83/388054583.db2.gz KNOZUFARAUHYOY-UHFFFAOYSA-N 1 1 244.165 3.630 20 0 BHADMO CC[N@@H+](Cc1ccc(C)cc1Cl)C1CC1 ZINC000447129390 388055481 /nfs/dbraw/zinc/05/54/81/388055481.db2.gz TVTAEZGABVYOJY-UHFFFAOYSA-N 1 1 223.747 3.633 20 0 BHADMO CCc1[nH+]ccn1Cc1ccc(C2CCC2)cc1 ZINC000447298967 388061491 /nfs/dbraw/zinc/06/14/91/388061491.db2.gz MKTHLHKFKKTSSA-UHFFFAOYSA-N 1 1 240.350 3.761 20 0 BHADMO Cc1ccc(C[N@H+]2CCC23CCC3)c(Cl)c1 ZINC000447300831 388061843 /nfs/dbraw/zinc/06/18/43/388061843.db2.gz ZJCRLWSQLPSVBQ-UHFFFAOYSA-N 1 1 235.758 3.777 20 0 BHADMO Cc1ccc(C[N@@H+]2CCC[C@H]2C)c(Cl)c1 ZINC000447302276 388060577 /nfs/dbraw/zinc/06/05/77/388060577.db2.gz PANFOLSAHBLMBY-LLVKDONJSA-N 1 1 223.747 3.633 20 0 BHADMO Cc1ccc(C[N@@H+]2CCC[C@@H]2C)c(Cl)c1 ZINC000447302278 388061382 /nfs/dbraw/zinc/06/13/82/388061382.db2.gz PANFOLSAHBLMBY-NSHDSACASA-N 1 1 223.747 3.633 20 0 BHADMO Cc1ccc(C[N@H+]2CC[C@@](C)(F)C2)c(Cl)c1 ZINC000447302986 388061901 /nfs/dbraw/zinc/06/19/01/388061901.db2.gz RANCTWVPELUHRF-CYBMUJFWSA-N 1 1 241.737 3.582 20 0 BHADMO Cc1ccc(C[N@@H+]2CC[C@@](C)(F)C2)c(Cl)c1 ZINC000447302986 388061896 /nfs/dbraw/zinc/06/18/96/388061896.db2.gz RANCTWVPELUHRF-CYBMUJFWSA-N 1 1 241.737 3.582 20 0 BHADMO Cc1ccc(C[N@H+]2CC[C@](C)(F)C2)c(Cl)c1 ZINC000447302989 388061158 /nfs/dbraw/zinc/06/11/58/388061158.db2.gz RANCTWVPELUHRF-ZDUSSCGKSA-N 1 1 241.737 3.582 20 0 BHADMO Cc1ccc(C[N@@H+]2CC[C@](C)(F)C2)c(Cl)c1 ZINC000447302989 388061155 /nfs/dbraw/zinc/06/11/55/388061155.db2.gz RANCTWVPELUHRF-ZDUSSCGKSA-N 1 1 241.737 3.582 20 0 BHADMO Cc1ccc(C[N@H+](C)C2CCC2)c(Cl)c1 ZINC000447309376 388062995 /nfs/dbraw/zinc/06/29/95/388062995.db2.gz NDNJGQFBNSXCIU-UHFFFAOYSA-N 1 1 223.747 3.633 20 0 BHADMO COCC[C@H](C)[N@H+]1CCC[C@H](C(C)(C)C)CC1 ZINC000447366881 537957453 /nfs/dbraw/zinc/95/74/53/537957453.db2.gz MAFKJSSDVKSLIK-KBPBESRZSA-N 1 1 241.419 3.560 20 0 BHADMO COCC[C@@H](C)[N@H+]1CCC[C@H](C(C)(C)C)CC1 ZINC000447366883 537957383 /nfs/dbraw/zinc/95/73/83/537957383.db2.gz MAFKJSSDVKSLIK-KGLIPLIRSA-N 1 1 241.419 3.560 20 0 BHADMO COCC[C@H](C)[N@H+]1CCC[C@@H](C(C)(C)C)CC1 ZINC000447366884 537957824 /nfs/dbraw/zinc/95/78/24/537957824.db2.gz MAFKJSSDVKSLIK-UONOGXRCSA-N 1 1 241.419 3.560 20 0 BHADMO COCC[C@@H](C)[N@H+]1CCC[C@@H](C(C)(C)C)CC1 ZINC000447366886 537957065 /nfs/dbraw/zinc/95/70/65/537957065.db2.gz MAFKJSSDVKSLIK-ZIAGYGMSSA-N 1 1 241.419 3.560 20 0 BHADMO CCC[N@@H+](CC)Cc1nc(C(C)(C)C)cs1 ZINC000447371372 388067199 /nfs/dbraw/zinc/06/71/99/388067199.db2.gz GCRIKGQAJILRTG-UHFFFAOYSA-N 1 1 240.416 3.673 20 0 BHADMO CC(C)C[N@@H+](C)Cc1nc(C(C)(C)C)cs1 ZINC000447372994 388067426 /nfs/dbraw/zinc/06/74/26/388067426.db2.gz JXJJJSQZKAOVBQ-UHFFFAOYSA-N 1 1 240.416 3.528 20 0 BHADMO C[C@@H](C1CCCCC1)[N@@H+](C)CCC(F)(F)F ZINC000447381157 388067054 /nfs/dbraw/zinc/06/70/54/388067054.db2.gz FXKHIBPWIWTVSB-JTQLQIEISA-N 1 1 237.309 3.839 20 0 BHADMO C[C@@H](C1CCCCC1)[N@@H+](C)CCC1CC1 ZINC000447381748 388066984 /nfs/dbraw/zinc/06/69/84/388066984.db2.gz HNAOMPZJBAHXIR-LBPRGKRZSA-N 1 1 209.377 3.687 20 0 BHADMO CSCCC[N@@H+](C)[C@@H](C)C1CCCCC1 ZINC000447382954 388067628 /nfs/dbraw/zinc/06/76/28/388067628.db2.gz JUMVBPABZSKBGK-LBPRGKRZSA-N 1 1 229.433 3.640 20 0 BHADMO C[C@@H](C1CCCCC1)[N@@H+](C)CCc1cccnc1 ZINC000447386015 388066893 /nfs/dbraw/zinc/06/68/93/388066893.db2.gz QFWHTOUSQYTFBR-AWEZNQCLSA-N 1 1 246.398 3.525 20 0 BHADMO COC(C)(C)CC[N@@H+](C)[C@@H](C)C1CCCCC1 ZINC000447386841 388066478 /nfs/dbraw/zinc/06/64/78/388066478.db2.gz RUALECYGEYTEGA-ZDUSSCGKSA-N 1 1 241.419 3.702 20 0 BHADMO COCCCCC[N@@H+](C)[C@@H](C)C1CCCCC1 ZINC000447387388 388068030 /nfs/dbraw/zinc/06/80/30/388068030.db2.gz UKDSTRFMZCOAKF-AWEZNQCLSA-N 1 1 241.419 3.704 20 0 BHADMO Cc1cncc(C[N@H+](C)[C@@H](C)C2CCCCC2)c1 ZINC000447388840 388069152 /nfs/dbraw/zinc/06/91/52/388069152.db2.gz XRFXHLPXMIGSLG-AWEZNQCLSA-N 1 1 246.398 3.791 20 0 BHADMO C[C@@H](C1CCCCC1)[N@@H+](C)CCOC(C)(C)C ZINC000447397438 388068934 /nfs/dbraw/zinc/06/89/34/388068934.db2.gz OYCHUGXJDJILGH-ZDUSSCGKSA-N 1 1 241.419 3.702 20 0 BHADMO CC(C)OCCC[N@@H+](C)[C@@H](C)C1CCCCC1 ZINC000447398687 388068371 /nfs/dbraw/zinc/06/83/71/388068371.db2.gz UGZICRMZTAOKLY-AWEZNQCLSA-N 1 1 241.419 3.702 20 0 BHADMO C[C@@H](C1CCCCC1)[N@@H+](C)CCc1ccccn1 ZINC000447398939 388069046 /nfs/dbraw/zinc/06/90/46/388069046.db2.gz VKZBKFIQTVAPHB-AWEZNQCLSA-N 1 1 246.398 3.525 20 0 BHADMO C[C@@H](CC[N@@H+](C)CC1CCC1)c1ccccc1 ZINC000447698577 388086701 /nfs/dbraw/zinc/08/67/01/388086701.db2.gz CTESNLSJRNQEMS-AWEZNQCLSA-N 1 1 231.383 3.912 20 0 BHADMO C[C@H](CC[N@@H+](C)CC1CCC1)c1ccccc1 ZINC000447698582 388086846 /nfs/dbraw/zinc/08/68/46/388086846.db2.gz CTESNLSJRNQEMS-CQSZACIVSA-N 1 1 231.383 3.912 20 0 BHADMO C=Cn1cc(C[N@@H+]2CCC[C@@H]2CCCCC)cn1 ZINC000447723775 388087537 /nfs/dbraw/zinc/08/75/37/388087537.db2.gz REZULKIWFFUNLE-HNNXBMFYSA-N 1 1 247.386 3.528 20 0 BHADMO C=Cn1cc(C[N@@H+]2CCC[C@H]2CCCCC)cn1 ZINC000447723776 388087592 /nfs/dbraw/zinc/08/75/92/388087592.db2.gz REZULKIWFFUNLE-OAHLLOKOSA-N 1 1 247.386 3.528 20 0 BHADMO Cc1ccc(C[N@H+]2CCC23CCC3)cc1Cl ZINC000447725275 388088094 /nfs/dbraw/zinc/08/80/94/388088094.db2.gz AOFZDOOJRXYNAK-UHFFFAOYSA-N 1 1 235.758 3.777 20 0 BHADMO C[C@@H](CC[N@@H+](C)Cc1ccc[nH]1)c1ccccc1 ZINC000447729133 388089660 /nfs/dbraw/zinc/08/96/60/388089660.db2.gz NFNQIWMNSBABOC-AWEZNQCLSA-N 1 1 242.366 3.640 20 0 BHADMO C[C@H](CC[N@@H+](C)Cc1ccc[nH]1)c1ccccc1 ZINC000447729138 388088942 /nfs/dbraw/zinc/08/89/42/388088942.db2.gz NFNQIWMNSBABOC-CQSZACIVSA-N 1 1 242.366 3.640 20 0 BHADMO COc1cc(C[N@@H+](C(C)C)C2CCC2)ccc1C ZINC000447730472 388088853 /nfs/dbraw/zinc/08/88/53/388088853.db2.gz KJOUWECKSHMXBC-UHFFFAOYSA-N 1 1 247.382 3.767 20 0 BHADMO C[C@@H](CC[N@H+]1CC[C@@](C)(F)C1)c1ccccc1 ZINC000447731828 388089570 /nfs/dbraw/zinc/08/95/70/388089570.db2.gz NTZPFMXKCKYCIQ-DZGCQCFKSA-N 1 1 235.346 3.614 20 0 BHADMO C[C@H](CC[N@H+]1CC[C@](C)(F)C1)c1ccccc1 ZINC000447731831 388088807 /nfs/dbraw/zinc/08/88/07/388088807.db2.gz NTZPFMXKCKYCIQ-HIFRSBDPSA-N 1 1 235.346 3.614 20 0 BHADMO C[C@H](CC[N@H+]1CC[C@@](C)(F)C1)c1ccccc1 ZINC000447731832 388089734 /nfs/dbraw/zinc/08/97/34/388089734.db2.gz NTZPFMXKCKYCIQ-UKRRQHHQSA-N 1 1 235.346 3.614 20 0 BHADMO C[C@@H](CC[N@H+]1CC[C@](C)(F)C1)c1ccccc1 ZINC000447731833 388089354 /nfs/dbraw/zinc/08/93/54/388089354.db2.gz NTZPFMXKCKYCIQ-ZFWWWQNUSA-N 1 1 235.346 3.614 20 0 BHADMO Cc1ccc(C[N@@H+](C)Cc2ccc[nH]2)cc1Cl ZINC000447732435 388089513 /nfs/dbraw/zinc/08/95/13/388089513.db2.gz WFCHXUZHOYQBMY-UHFFFAOYSA-N 1 1 248.757 3.609 20 0 BHADMO C[C@@H](CC[N@H+]1CCC12CCC2)c1ccccc1 ZINC000447732560 388089422 /nfs/dbraw/zinc/08/94/22/388089422.db2.gz XHRYJKOCZJRXOI-AWEZNQCLSA-N 1 1 229.367 3.809 20 0 BHADMO C[C@H](CC[N@H+]1CCC12CCC2)c1ccccc1 ZINC000447732561 388089346 /nfs/dbraw/zinc/08/93/46/388089346.db2.gz XHRYJKOCZJRXOI-CQSZACIVSA-N 1 1 229.367 3.809 20 0 BHADMO C=Cn1cc(C[N@H+](CC(C)C)C(CC)CC)cn1 ZINC000447733423 388088665 /nfs/dbraw/zinc/08/86/65/388088665.db2.gz YNQJYVQHXNSNKD-UHFFFAOYSA-N 1 1 249.402 3.630 20 0 BHADMO C[C@@H](CC[N@@H+](C)CCC1CC1)c1ccccc1 ZINC000447733558 388089375 /nfs/dbraw/zinc/08/93/75/388089375.db2.gz ZNAPXMMIKHQCRP-AWEZNQCLSA-N 1 1 231.383 3.912 20 0 BHADMO C[C@H](CC[N@@H+](C)CCC1CC1)c1ccccc1 ZINC000447733559 388089380 /nfs/dbraw/zinc/08/93/80/388089380.db2.gz ZNAPXMMIKHQCRP-CQSZACIVSA-N 1 1 231.383 3.912 20 0 BHADMO Cc1ccc(C[N@H+]2CC[C@@](C)(F)C2)cc1Cl ZINC000447733764 388089337 /nfs/dbraw/zinc/08/93/37/388089337.db2.gz QXKIPAIXNAFZJE-CYBMUJFWSA-N 1 1 241.737 3.582 20 0 BHADMO Cc1ccc(C[N@@H+]2CC[C@@](C)(F)C2)cc1Cl ZINC000447733764 388089336 /nfs/dbraw/zinc/08/93/36/388089336.db2.gz QXKIPAIXNAFZJE-CYBMUJFWSA-N 1 1 241.737 3.582 20 0 BHADMO Cc1ccc(C[N@H+]2CC[C@](C)(F)C2)cc1Cl ZINC000447733765 388089299 /nfs/dbraw/zinc/08/92/99/388089299.db2.gz QXKIPAIXNAFZJE-ZDUSSCGKSA-N 1 1 241.737 3.582 20 0 BHADMO Cc1ccc(C[N@@H+]2CC[C@](C)(F)C2)cc1Cl ZINC000447733765 388089297 /nfs/dbraw/zinc/08/92/97/388089297.db2.gz QXKIPAIXNAFZJE-ZDUSSCGKSA-N 1 1 241.737 3.582 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)Cc1ccc(C)c(OC)c1 ZINC000447734925 388089709 /nfs/dbraw/zinc/08/97/09/388089709.db2.gz AHJASCGSPCIWMH-CYBMUJFWSA-N 1 1 235.371 3.624 20 0 BHADMO CCC[C@H](C)[N@@H+](C)Cc1ccc(C)c(OC)c1 ZINC000447734926 388089201 /nfs/dbraw/zinc/08/92/01/388089201.db2.gz AHJASCGSPCIWMH-ZDUSSCGKSA-N 1 1 235.371 3.624 20 0 BHADMO CCC[N@@H+](C)CCCc1c(F)cccc1Cl ZINC000447736049 388089194 /nfs/dbraw/zinc/08/91/94/388089194.db2.gz IZLWTAWIGLCNJL-UHFFFAOYSA-N 1 1 243.753 3.754 20 0 BHADMO C[C@@H](CC[N@H+]1CC[C@H](C)C1)c1ccccc1 ZINC000447736178 388089578 /nfs/dbraw/zinc/08/95/78/388089578.db2.gz KCPCYXCFUMTJRO-KBPBESRZSA-N 1 1 217.356 3.522 20 0 BHADMO C[C@@H](CC[N@H+]1CC[C@@H](C)C1)c1ccccc1 ZINC000447736179 388089425 /nfs/dbraw/zinc/08/94/25/388089425.db2.gz KCPCYXCFUMTJRO-KGLIPLIRSA-N 1 1 217.356 3.522 20 0 BHADMO C[C@H](CC[N@H+]1CC[C@H](C)C1)c1ccccc1 ZINC000447736180 388089360 /nfs/dbraw/zinc/08/93/60/388089360.db2.gz KCPCYXCFUMTJRO-UONOGXRCSA-N 1 1 217.356 3.522 20 0 BHADMO C[C@H](CC[N@H+]1CC[C@@H](C)C1)c1ccccc1 ZINC000447736181 388089520 /nfs/dbraw/zinc/08/95/20/388089520.db2.gz KCPCYXCFUMTJRO-ZIAGYGMSSA-N 1 1 217.356 3.522 20 0 BHADMO CC[C@H](C)[N@@H+](C)CC[C@H](C)c1ccccc1 ZINC000447736963 388090690 /nfs/dbraw/zinc/09/06/90/388090690.db2.gz PXSAHCFYCGZAGB-KBPBESRZSA-N 1 1 219.372 3.911 20 0 BHADMO CC[C@H](C)[N@@H+](C)CC[C@@H](C)c1ccccc1 ZINC000447736964 388090727 /nfs/dbraw/zinc/09/07/27/388090727.db2.gz PXSAHCFYCGZAGB-KGLIPLIRSA-N 1 1 219.372 3.911 20 0 BHADMO CC[C@@H](C)[N@@H+](C)CC[C@H](C)c1ccccc1 ZINC000447736965 388090482 /nfs/dbraw/zinc/09/04/82/388090482.db2.gz PXSAHCFYCGZAGB-UONOGXRCSA-N 1 1 219.372 3.911 20 0 BHADMO CC[C@@H](C)[N@@H+](C)CC[C@@H](C)c1ccccc1 ZINC000447736966 388090637 /nfs/dbraw/zinc/09/06/37/388090637.db2.gz PXSAHCFYCGZAGB-ZIAGYGMSSA-N 1 1 219.372 3.911 20 0 BHADMO CCOCC[N@@H+](CC)CC[C@H](C)c1ccccc1 ZINC000447737294 388090544 /nfs/dbraw/zinc/09/05/44/388090544.db2.gz BXPFTKQKRRLIQS-HNNXBMFYSA-N 1 1 249.398 3.539 20 0 BHADMO CCOCC[N@@H+](CC)CC[C@@H](C)c1ccccc1 ZINC000447737295 388090870 /nfs/dbraw/zinc/09/08/70/388090870.db2.gz BXPFTKQKRRLIQS-OAHLLOKOSA-N 1 1 249.398 3.539 20 0 BHADMO C[C@@H](CC[N@@H+](C)Cc1ccoc1)c1ccccc1 ZINC000447737613 388090512 /nfs/dbraw/zinc/09/05/12/388090512.db2.gz COAOVDKZRZXYIY-AWEZNQCLSA-N 1 1 243.350 3.905 20 0 BHADMO C[C@H](CC[N@@H+](C)Cc1ccoc1)c1ccccc1 ZINC000447737614 388090343 /nfs/dbraw/zinc/09/03/43/388090343.db2.gz COAOVDKZRZXYIY-CQSZACIVSA-N 1 1 243.350 3.905 20 0 BHADMO C[C@@H](CC[N@H+]1CCSC[C@@H]1C)c1ccccc1 ZINC000447737728 388090198 /nfs/dbraw/zinc/09/01/98/388090198.db2.gz DEDWUEUIMMNAMK-KBPBESRZSA-N 1 1 249.423 3.618 20 0 BHADMO C[C@H](CC[N@H+]1CCSC[C@@H]1C)c1ccccc1 ZINC000447737730 388090557 /nfs/dbraw/zinc/09/05/57/388090557.db2.gz DEDWUEUIMMNAMK-KGLIPLIRSA-N 1 1 249.423 3.618 20 0 BHADMO C[C@@H](CC[N@H+]1CCSC[C@H]1C)c1ccccc1 ZINC000447737732 388090271 /nfs/dbraw/zinc/09/02/71/388090271.db2.gz DEDWUEUIMMNAMK-UONOGXRCSA-N 1 1 249.423 3.618 20 0 BHADMO C[C@H](CC[N@H+]1CCSC[C@H]1C)c1ccccc1 ZINC000447737733 388090734 /nfs/dbraw/zinc/09/07/34/388090734.db2.gz DEDWUEUIMMNAMK-ZIAGYGMSSA-N 1 1 249.423 3.618 20 0 BHADMO C[C@@H](CC[N@@H+](C)[C@@H](C)C1CC1)c1ccccc1 ZINC000447739288 388090146 /nfs/dbraw/zinc/09/01/46/388090146.db2.gz GWKFRIHRPLSBSH-KBPBESRZSA-N 1 1 231.383 3.911 20 0 BHADMO C[C@H](CC[N@@H+](C)[C@@H](C)C1CC1)c1ccccc1 ZINC000447739290 388090653 /nfs/dbraw/zinc/09/06/53/388090653.db2.gz GWKFRIHRPLSBSH-KGLIPLIRSA-N 1 1 231.383 3.911 20 0 BHADMO C[C@H](C1CC1)[N@H+](C)CC[C@H](C)c1ccccc1 ZINC000447739292 388090256 /nfs/dbraw/zinc/09/02/56/388090256.db2.gz GWKFRIHRPLSBSH-UONOGXRCSA-N 1 1 231.383 3.911 20 0 BHADMO C[C@H](CC[N@@H+](C)[C@H](C)C1CC1)c1ccccc1 ZINC000447739294 388090175 /nfs/dbraw/zinc/09/01/75/388090175.db2.gz GWKFRIHRPLSBSH-ZIAGYGMSSA-N 1 1 231.383 3.911 20 0 BHADMO CC1=CC[N@@H+](CC[C@H](C)c2ccccc2)CC1 ZINC000447739962 388090073 /nfs/dbraw/zinc/09/00/73/388090073.db2.gz ISQBZGBRKGLNND-HNNXBMFYSA-N 1 1 229.367 3.832 20 0 BHADMO CC1=CC[N@@H+](CC[C@@H](C)c2ccccc2)CC1 ZINC000447739963 388090673 /nfs/dbraw/zinc/09/06/73/388090673.db2.gz ISQBZGBRKGLNND-OAHLLOKOSA-N 1 1 229.367 3.832 20 0 BHADMO CC[N@@H+](CC[C@@H](C)c1ccccc1)C1CC1 ZINC000447740766 388090577 /nfs/dbraw/zinc/09/05/77/388090577.db2.gz IITPSPRSHYSNOA-CYBMUJFWSA-N 1 1 217.356 3.665 20 0 BHADMO CC[N@@H+](CC[C@H](C)c1ccccc1)C1CC1 ZINC000447740767 388090337 /nfs/dbraw/zinc/09/03/37/388090337.db2.gz IITPSPRSHYSNOA-ZDUSSCGKSA-N 1 1 217.356 3.665 20 0 BHADMO Cc1ccc(C[N@@H+](C)Cc2ccoc2)cc1Cl ZINC000447741281 388090437 /nfs/dbraw/zinc/09/04/37/388090437.db2.gz MMEDYWAPCMIUCQ-UHFFFAOYSA-N 1 1 249.741 3.873 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@H](C)C2CC2)cc1Cl ZINC000447743423 388090486 /nfs/dbraw/zinc/09/04/86/388090486.db2.gz UJNAOFVHDRHZKH-LLVKDONJSA-N 1 1 237.774 3.879 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@@H](C)C2CC2)cc1Cl ZINC000447743427 388090328 /nfs/dbraw/zinc/09/03/28/388090328.db2.gz UJNAOFVHDRHZKH-NSHDSACASA-N 1 1 237.774 3.879 20 0 BHADMO C[C@@H](CC[N@H+]1CCS[C@H](C)C1)c1ccccc1 ZINC000447744891 388090594 /nfs/dbraw/zinc/09/05/94/388090594.db2.gz ZCENRJIEJCKXTD-UONOGXRCSA-N 1 1 249.423 3.618 20 0 BHADMO C[C@H](CC[N@H+]1CCS[C@H](C)C1)c1ccccc1 ZINC000447744893 388090550 /nfs/dbraw/zinc/09/05/50/388090550.db2.gz ZCENRJIEJCKXTD-ZIAGYGMSSA-N 1 1 249.423 3.618 20 0 BHADMO CC[N@@H+](Cc1ccc(C)c(Cl)c1)C1CC1 ZINC000447746731 388090377 /nfs/dbraw/zinc/09/03/77/388090377.db2.gz QIUXNSIDKUAFNH-UHFFFAOYSA-N 1 1 223.747 3.633 20 0 BHADMO C[C@@H](CC[N@H+]1CCC[C@@H]1C)c1ccccc1 ZINC000447748485 388090381 /nfs/dbraw/zinc/09/03/81/388090381.db2.gz XRYTYWZPEFHKGW-KBPBESRZSA-N 1 1 217.356 3.665 20 0 BHADMO C[C@H](CC[N@H+]1CCC[C@@H]1C)c1ccccc1 ZINC000447748486 388090220 /nfs/dbraw/zinc/09/02/20/388090220.db2.gz XRYTYWZPEFHKGW-KGLIPLIRSA-N 1 1 217.356 3.665 20 0 BHADMO C[C@@H](CC[N@H+]1CCC[C@H]1C)c1ccccc1 ZINC000447748487 388090874 /nfs/dbraw/zinc/09/08/74/388090874.db2.gz XRYTYWZPEFHKGW-UONOGXRCSA-N 1 1 217.356 3.665 20 0 BHADMO C[C@H](CC[N@H+]1CCC[C@H]1C)c1ccccc1 ZINC000447748488 388090522 /nfs/dbraw/zinc/09/05/22/388090522.db2.gz XRYTYWZPEFHKGW-ZIAGYGMSSA-N 1 1 217.356 3.665 20 0 BHADMO Cc1ccc(C[N@H+](C)C2CCC2)cc1Cl ZINC000447748847 388090704 /nfs/dbraw/zinc/09/07/04/388090704.db2.gz YRWRRUSTWCOWNC-UHFFFAOYSA-N 1 1 223.747 3.633 20 0 BHADMO COc1cc(C[N@@H+](CC(C)C)C2CC2)ccc1C ZINC000447748907 388090828 /nfs/dbraw/zinc/09/08/28/388090828.db2.gz XXZCOJVFJZJNOZ-UHFFFAOYSA-N 1 1 247.382 3.624 20 0 BHADMO COc1cc(C[N@H+]2CCC[C@H]2C(C)C)ccc1C ZINC000447749257 388090303 /nfs/dbraw/zinc/09/03/03/388090303.db2.gz YWGUFSDKDRTWRF-HNNXBMFYSA-N 1 1 247.382 3.624 20 0 BHADMO COc1cc(C[N@H+]2CCC[C@@H]2C(C)C)ccc1C ZINC000447749258 388089986 /nfs/dbraw/zinc/08/99/86/388089986.db2.gz YWGUFSDKDRTWRF-OAHLLOKOSA-N 1 1 247.382 3.624 20 0 BHADMO C[N@@H+](CCCc1c(F)cccc1Cl)C1CC1 ZINC000447749376 388090860 /nfs/dbraw/zinc/09/08/60/388090860.db2.gz ZRNNUWHZUAKWNH-UHFFFAOYSA-N 1 1 241.737 3.506 20 0 BHADMO CC(C)C[N@@H+](C)CC[C@H](C)c1ccccc1 ZINC000447749657 388091770 /nfs/dbraw/zinc/09/17/70/388091770.db2.gz ZVENPQVUDRWHTN-AWEZNQCLSA-N 1 1 219.372 3.768 20 0 BHADMO CC(C)C[N@@H+](C)CC[C@@H](C)c1ccccc1 ZINC000447749658 388091451 /nfs/dbraw/zinc/09/14/51/388091451.db2.gz ZVENPQVUDRWHTN-CQSZACIVSA-N 1 1 219.372 3.768 20 0 BHADMO Cc1ccc(C[N@@H+](C)Cc2ccco2)cc1Cl ZINC000447793113 384924606 /nfs/dbraw/zinc/92/46/06/384924606.db2.gz AAIWQDBXRSVGSO-UHFFFAOYSA-N 1 1 249.741 3.873 20 0 BHADMO CC(C)[N@@H+](C)CCCc1c(F)cccc1Cl ZINC000447793360 388092615 /nfs/dbraw/zinc/09/26/15/388092615.db2.gz BTHUQDDCLLQMMW-UHFFFAOYSA-N 1 1 243.753 3.752 20 0 BHADMO C[C@@H](CC[N@@H+](C)Cc1ccco1)c1ccccc1 ZINC000447795288 388092817 /nfs/dbraw/zinc/09/28/17/388092817.db2.gz NAWWZOGTTJVQMF-AWEZNQCLSA-N 1 1 243.350 3.905 20 0 BHADMO C[C@H](CC[N@@H+](C)Cc1ccco1)c1ccccc1 ZINC000447795289 388093068 /nfs/dbraw/zinc/09/30/68/388093068.db2.gz NAWWZOGTTJVQMF-CQSZACIVSA-N 1 1 243.350 3.905 20 0 BHADMO CC[N@@H+](CC[C@H](C)c1ccccc1)C(C)C ZINC000447797152 388092179 /nfs/dbraw/zinc/09/21/79/388092179.db2.gz GMQBQTJSWNIJJB-AWEZNQCLSA-N 1 1 219.372 3.911 20 0 BHADMO CC[N@@H+](CC[C@@H](C)c1ccccc1)C(C)C ZINC000447797153 388093087 /nfs/dbraw/zinc/09/30/87/388093087.db2.gz GMQBQTJSWNIJJB-CQSZACIVSA-N 1 1 219.372 3.911 20 0 BHADMO CCCC[N@@H+](C)CC[C@H](C)c1ccccc1 ZINC000447797855 388093642 /nfs/dbraw/zinc/09/36/42/388093642.db2.gz OJMQPTVGPYWDON-AWEZNQCLSA-N 1 1 219.372 3.912 20 0 BHADMO CCCC[N@@H+](C)CC[C@@H](C)c1ccccc1 ZINC000447797856 388093330 /nfs/dbraw/zinc/09/33/30/388093330.db2.gz OJMQPTVGPYWDON-CQSZACIVSA-N 1 1 219.372 3.912 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1ncc(C(C)(C)C)s1 ZINC000448212745 384925168 /nfs/dbraw/zinc/92/51/68/384925168.db2.gz JQLYKOWJJZAMFM-JTQLQIEISA-N 1 1 240.416 3.671 20 0 BHADMO CC[C@@H](C)[N@@H+](C)Cc1ncc(C(C)(C)C)s1 ZINC000448212746 384922487 /nfs/dbraw/zinc/92/24/87/384922487.db2.gz JQLYKOWJJZAMFM-SNVBAGLBSA-N 1 1 240.416 3.671 20 0 BHADMO CC[N@@H+](Cc1ncc(C(C)(C)C)s1)C(C)C ZINC000448214110 384924426 /nfs/dbraw/zinc/92/44/26/384924426.db2.gz RIANAWYYWLVUEA-UHFFFAOYSA-N 1 1 240.416 3.671 20 0 BHADMO CCCC[N@@H+](C)Cc1ncc(C(C)(C)C)s1 ZINC000448216805 384927004 /nfs/dbraw/zinc/92/70/04/384927004.db2.gz GUTJINOEKDJMPW-UHFFFAOYSA-N 1 1 240.416 3.673 20 0 BHADMO CCCC[N@H+](C)Cc1ncc(C(C)(C)C)s1 ZINC000448216805 384926999 /nfs/dbraw/zinc/92/69/99/384926999.db2.gz GUTJINOEKDJMPW-UHFFFAOYSA-N 1 1 240.416 3.673 20 0 BHADMO CC(C)C[N@@H+](C)Cc1ncc(C(C)(C)C)s1 ZINC000448223269 384931679 /nfs/dbraw/zinc/93/16/79/384931679.db2.gz NGMKMBOYGKXINZ-UHFFFAOYSA-N 1 1 240.416 3.528 20 0 BHADMO CCC[N@@H+](CC)Cc1ncc(C(C)(C)C)s1 ZINC000448225369 384937847 /nfs/dbraw/zinc/93/78/47/384937847.db2.gz VRCXDZUDYPVUBQ-UHFFFAOYSA-N 1 1 240.416 3.673 20 0 BHADMO CCC(CC)n1ccc(C[N@H+]2CCCC[C@H]2C)n1 ZINC000448453468 201050033 /nfs/dbraw/zinc/05/00/33/201050033.db2.gz YTZLOCBXHKPCTO-CYBMUJFWSA-N 1 1 249.402 3.619 20 0 BHADMO CCC(CC)n1ccc(C[N@H+]2CCCC[C@@H]2C)n1 ZINC000448453469 201049104 /nfs/dbraw/zinc/04/91/04/201049104.db2.gz YTZLOCBXHKPCTO-ZDUSSCGKSA-N 1 1 249.402 3.619 20 0 BHADMO COc1cc2ccccc2cc1C[N@@H+](C)C(C)C ZINC000449001110 388127512 /nfs/dbraw/zinc/12/75/12/388127512.db2.gz BMCWMACXBYPFGC-UHFFFAOYSA-N 1 1 243.350 3.689 20 0 BHADMO CC(C)[N@@H+](C)Cc1cc(Cl)sc1Cl ZINC000449001130 388127705 /nfs/dbraw/zinc/12/77/05/388127705.db2.gz BUHGITUIHJYNML-UHFFFAOYSA-N 1 1 238.183 3.895 20 0 BHADMO CC(C)[N@H+](C)Cc1cc(Cl)sc1Cl ZINC000449001130 388127703 /nfs/dbraw/zinc/12/77/03/388127703.db2.gz BUHGITUIHJYNML-UHFFFAOYSA-N 1 1 238.183 3.895 20 0 BHADMO COc1cc(C[N@@H+](C)C(C)C)cc2ccccc21 ZINC000449001765 388126931 /nfs/dbraw/zinc/12/69/31/388126931.db2.gz GESOMMCGUBUMPX-UHFFFAOYSA-N 1 1 243.350 3.689 20 0 BHADMO CC[C@@H]1CCCC[N@H+]1Cc1cc2cccnc2o1 ZINC000449002014 410581192 /nfs/dbraw/zinc/58/11/92/410581192.db2.gz ILBCIACAPAYMII-CYBMUJFWSA-N 1 1 244.338 3.592 20 0 BHADMO CC[C@H]1CCCC[N@H+]1Cc1cc2cccnc2o1 ZINC000449002015 410581557 /nfs/dbraw/zinc/58/15/57/410581557.db2.gz ILBCIACAPAYMII-ZDUSSCGKSA-N 1 1 244.338 3.592 20 0 BHADMO C[N@@H+](Cc1cc2cccnc2o1)C1CCCCC1 ZINC000449003027 388127675 /nfs/dbraw/zinc/12/76/75/388127675.db2.gz OQPARICUKBZTNW-UHFFFAOYSA-N 1 1 244.338 3.592 20 0 BHADMO COc1cccc2c(C[N@@H+](C)C(C)C)cccc12 ZINC000449003570 385249621 /nfs/dbraw/zinc/24/96/21/385249621.db2.gz RESKOORCXJNXOD-UHFFFAOYSA-N 1 1 243.350 3.689 20 0 BHADMO CCCC[N@@H+](CC)Cc1ccnn1C1CCCC1 ZINC000449003789 388127365 /nfs/dbraw/zinc/12/73/65/388127365.db2.gz STDPRSOOHQMHHC-UHFFFAOYSA-N 1 1 249.402 3.620 20 0 BHADMO Cc1ccc(C[N@H+](C)Cc2csc(C)c2)o1 ZINC000449004000 388127462 /nfs/dbraw/zinc/12/74/62/388127462.db2.gz UXOSTGOQKOVDCM-UHFFFAOYSA-N 1 1 235.352 3.590 20 0 BHADMO Cc1ccc(C[N@@H+](C)Cc2csc(C)c2)o1 ZINC000449004000 388127461 /nfs/dbraw/zinc/12/74/61/388127461.db2.gz UXOSTGOQKOVDCM-UHFFFAOYSA-N 1 1 235.352 3.590 20 0 BHADMO Cc1cc(C[N@@H+](C)Cc2cccs2)cs1 ZINC000449004253 388126626 /nfs/dbraw/zinc/12/66/26/388126626.db2.gz WSSTXMGSWZKZRZ-UHFFFAOYSA-N 1 1 237.393 3.750 20 0 BHADMO CC[N@@H+](C[C@H](C)c1cc(F)cc(F)c1)C1CC1 ZINC000449009150 517649451 /nfs/dbraw/zinc/64/94/51/517649451.db2.gz HJLNLMCJJUZONY-JTQLQIEISA-N 1 1 239.309 3.553 20 0 BHADMO CC[N@@H+](C[C@@H](C)c1cc(F)cc(F)c1)C1CC1 ZINC000449009351 388128097 /nfs/dbraw/zinc/12/80/97/388128097.db2.gz HJLNLMCJJUZONY-SNVBAGLBSA-N 1 1 239.309 3.553 20 0 BHADMO CC(C)C[N@@H+](C)Cc1cccc2ccoc21 ZINC000449009429 388128143 /nfs/dbraw/zinc/12/81/43/388128143.db2.gz IFHSRIPXZXPPHQ-UHFFFAOYSA-N 1 1 217.312 3.521 20 0 BHADMO CC[N@@H+](Cc1cccc2ccoc21)C(C)C ZINC000449010784 388128489 /nfs/dbraw/zinc/12/84/89/388128489.db2.gz UXAFHJILSHTACZ-UHFFFAOYSA-N 1 1 217.312 3.663 20 0 BHADMO Cc1cc(C[N@H+]2CCc3sccc3C2)cs1 ZINC000449010824 388128105 /nfs/dbraw/zinc/12/81/05/388128105.db2.gz VIXYYXAHHRZERI-UHFFFAOYSA-N 1 1 249.404 3.676 20 0 BHADMO CC[N@@H+](Cc1cc2cccnc2o1)C1CCCC1 ZINC000449011743 385297821 /nfs/dbraw/zinc/29/78/21/385297821.db2.gz UGRFFDDDAULACL-UHFFFAOYSA-N 1 1 244.338 3.592 20 0 BHADMO Cc1cccc(C[N@H+](C)[C@H](C)c2ccco2)c1F ZINC000449012017 388129027 /nfs/dbraw/zinc/12/90/27/388129027.db2.gz XNDLBLIWPFFITD-GFCCVEGCSA-N 1 1 247.313 3.920 20 0 BHADMO Cc1cccc(C[N@@H+](C)[C@H](C)c2ccco2)c1F ZINC000449012017 388129026 /nfs/dbraw/zinc/12/90/26/388129026.db2.gz XNDLBLIWPFFITD-GFCCVEGCSA-N 1 1 247.313 3.920 20 0 BHADMO Cc1cccc(C[N@H+](C)[C@@H](C)c2ccco2)c1F ZINC000449012018 388128076 /nfs/dbraw/zinc/12/80/76/388128076.db2.gz XNDLBLIWPFFITD-LBPRGKRZSA-N 1 1 247.313 3.920 20 0 BHADMO Cc1cccc(C[N@@H+](C)[C@@H](C)c2ccco2)c1F ZINC000449012018 388128074 /nfs/dbraw/zinc/12/80/74/388128074.db2.gz XNDLBLIWPFFITD-LBPRGKRZSA-N 1 1 247.313 3.920 20 0 BHADMO CCCC[N@@H+](Cc1cc2cccnc2o1)C1CC1 ZINC000449012228 388129082 /nfs/dbraw/zinc/12/90/82/388129082.db2.gz ZVIMSIMTYNNNHX-UHFFFAOYSA-N 1 1 244.338 3.592 20 0 BHADMO Cc1cc(C[N@H+](C)[C@H](C)C(C)C)cs1 ZINC000449012229 388129044 /nfs/dbraw/zinc/12/90/44/388129044.db2.gz ZVKNAEDTVVSHMN-LLVKDONJSA-N 1 1 211.374 3.533 20 0 BHADMO Cc1cc(C[N@H+](C)[C@@H](C)C(C)C)cs1 ZINC000449012230 388128945 /nfs/dbraw/zinc/12/89/45/388128945.db2.gz ZVKNAEDTVVSHMN-NSHDSACASA-N 1 1 211.374 3.533 20 0 BHADMO CCCCC[N@@H+](Cc1ccncc1F)C(C)C ZINC000449012645 388129074 /nfs/dbraw/zinc/12/90/74/388129074.db2.gz FSPZUDVGESAGBK-UHFFFAOYSA-N 1 1 238.350 3.621 20 0 BHADMO CC(C)C[N@@H+](Cc1cc2cccnc2o1)C(C)C ZINC000449012732 388128370 /nfs/dbraw/zinc/12/83/70/388128370.db2.gz GKTSXRXHQKPPJU-UHFFFAOYSA-N 1 1 246.354 3.694 20 0 BHADMO C[C@H](C1CC1)[N@@H+](C)Cc1cccc2ccoc21 ZINC000449013345 388129642 /nfs/dbraw/zinc/12/96/42/388129642.db2.gz KVAKVSOJFGVCPM-LLVKDONJSA-N 1 1 229.323 3.663 20 0 BHADMO C[C@@H](C1CC1)[N@@H+](C)Cc1cccc2ccoc21 ZINC000449013425 388129514 /nfs/dbraw/zinc/12/95/14/388129514.db2.gz KVAKVSOJFGVCPM-NSHDSACASA-N 1 1 229.323 3.663 20 0 BHADMO CC(C)[N@@H+](Cc1cccc2ccoc21)C1CC1 ZINC000449013851 388129949 /nfs/dbraw/zinc/12/99/49/388129949.db2.gz MQKQBECOOIWEBW-UHFFFAOYSA-N 1 1 229.323 3.806 20 0 BHADMO Cc1cc(C[N@H+]([C@H](C)C2CC2)C2CC2)cs1 ZINC000449014568 388129786 /nfs/dbraw/zinc/12/97/86/388129786.db2.gz QBAKMVJSMXQLIB-LLVKDONJSA-N 1 1 235.396 3.819 20 0 BHADMO Cc1cc(C[N@H+]([C@@H](C)C2CC2)C2CC2)cs1 ZINC000449014569 388129909 /nfs/dbraw/zinc/12/99/09/388129909.db2.gz QBAKMVJSMXQLIB-NSHDSACASA-N 1 1 235.396 3.819 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)Cc1ccnn1C1CCCC1 ZINC000449015977 388130319 /nfs/dbraw/zinc/13/03/19/388130319.db2.gz USIKPNPPSCQPNK-CYBMUJFWSA-N 1 1 249.402 3.619 20 0 BHADMO CCC[C@H](C)[N@@H+](C)Cc1ccnn1C1CCCC1 ZINC000449015978 388130019 /nfs/dbraw/zinc/13/00/19/388130019.db2.gz USIKPNPPSCQPNK-ZDUSSCGKSA-N 1 1 249.402 3.619 20 0 BHADMO CCC[N@H+](Cc1cc2cccnc2o1)CC(C)C ZINC000449015989 388129548 /nfs/dbraw/zinc/12/95/48/388129548.db2.gz UYDZMJDJXCAZHN-UHFFFAOYSA-N 1 1 246.354 3.696 20 0 BHADMO CC[C@@H](C)[N@@H+](C)Cc1cccc2ccoc21 ZINC000449016026 388129781 /nfs/dbraw/zinc/12/97/81/388129781.db2.gz VEYJJESSIBGNPO-LLVKDONJSA-N 1 1 217.312 3.663 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1cccc2ccoc21 ZINC000449016027 388129591 /nfs/dbraw/zinc/12/95/91/388129591.db2.gz VEYJJESSIBGNPO-NSHDSACASA-N 1 1 217.312 3.663 20 0 BHADMO Cc1cc(C[N@H+](C)C(C2CC2)C2CC2)cs1 ZINC000449017185 388130502 /nfs/dbraw/zinc/13/05/02/388130502.db2.gz JOFHKNSNEBHCFP-UHFFFAOYSA-N 1 1 235.396 3.677 20 0 BHADMO Cc1cc(C[N@H+](C)CC(C)(C)C)cs1 ZINC000449019688 491078931 /nfs/dbraw/zinc/07/89/31/491078931.db2.gz WTOFYTWBWJRCOJ-UHFFFAOYSA-N 1 1 211.374 3.534 20 0 BHADMO CC[N@@H+](Cc1cc2cccnc2o1)[C@H](C)C(C)C ZINC000449019934 491078925 /nfs/dbraw/zinc/07/89/25/491078925.db2.gz OINGQQXCYXFRGI-GFCCVEGCSA-N 1 1 246.354 3.694 20 0 BHADMO CC[N@@H+](Cc1cc2cccnc2o1)[C@@H](C)C(C)C ZINC000449019935 491078923 /nfs/dbraw/zinc/07/89/23/491078923.db2.gz OINGQQXCYXFRGI-LBPRGKRZSA-N 1 1 246.354 3.694 20 0 BHADMO Cc1cccc(C[N@@H+](C)CCC(F)(F)F)c1F ZINC000449020265 397950727 /nfs/dbraw/zinc/95/07/27/397950727.db2.gz PXHYNFIQPDUDKH-UHFFFAOYSA-N 1 1 249.251 3.518 20 0 BHADMO Cc1cccc(C[N@H+](C)CCC(F)(F)F)c1F ZINC000449020265 397950724 /nfs/dbraw/zinc/95/07/24/397950724.db2.gz PXHYNFIQPDUDKH-UHFFFAOYSA-N 1 1 249.251 3.518 20 0 BHADMO Cc1cc(C[N@H+](C)Cc2ccoc2C)cs1 ZINC000449022771 397950534 /nfs/dbraw/zinc/95/05/34/397950534.db2.gz ZVRYYEDEAOJHAE-UHFFFAOYSA-N 1 1 235.352 3.590 20 0 BHADMO Cc1cc(C[NH+]2Cc3ccccc3C2)cs1 ZINC000449022881 388131733 /nfs/dbraw/zinc/13/17/33/388131733.db2.gz LJYPNKGTSPMBOZ-UHFFFAOYSA-N 1 1 229.348 3.572 20 0 BHADMO CCC(C)(C)[N@@H+](C)Cc1ccnn1C1CCCC1 ZINC000449025009 388132159 /nfs/dbraw/zinc/13/21/59/388132159.db2.gz FURYOFKOKOLWIJ-UHFFFAOYSA-N 1 1 249.402 3.619 20 0 BHADMO CC[N@@H+](Cc1cccc2ccoc21)C1CCC1 ZINC000449025083 388132117 /nfs/dbraw/zinc/13/21/17/388132117.db2.gz AKNBWYHVRMIZRC-UHFFFAOYSA-N 1 1 229.323 3.807 20 0 BHADMO C[C@H](C[N@H+]1CCC[C@H]1C)c1cc(F)cc(F)c1 ZINC000449027219 201792565 /nfs/dbraw/zinc/79/25/65/201792565.db2.gz LDDZUDWATNOHOR-GHMZBOCLSA-N 1 1 239.309 3.553 20 0 BHADMO CC1=CC[N@@H+](Cc2cccc3ccoc32)CC1 ZINC000449027349 388132014 /nfs/dbraw/zinc/13/20/14/388132014.db2.gz INMVUMLQMIFLLH-UHFFFAOYSA-N 1 1 227.307 3.585 20 0 BHADMO Fc1cnccc1C[N@H+]1CCCC12CCCCC2 ZINC000449027872 388132153 /nfs/dbraw/zinc/13/21/53/388132153.db2.gz JQLPMCWRUAFGIN-UHFFFAOYSA-N 1 1 248.345 3.519 20 0 BHADMO Cc1cc(C[N@H+](C(C)C)C2CCC2)cs1 ZINC000449028404 388133336 /nfs/dbraw/zinc/13/33/36/388133336.db2.gz LPBSTJDDALQBKA-UHFFFAOYSA-N 1 1 223.385 3.819 20 0 BHADMO C[C@@H](C[N@@H+](C)C1CCC1)c1cc(F)cc(F)c1 ZINC000449028730 385429582 /nfs/dbraw/zinc/42/95/82/385429582.db2.gz MOAIJVBWRHLLQV-JTQLQIEISA-N 1 1 239.309 3.553 20 0 BHADMO C[C@H](C[N@@H+](C)C1CCC1)c1cc(F)cc(F)c1 ZINC000449028731 385429112 /nfs/dbraw/zinc/42/91/12/385429112.db2.gz MOAIJVBWRHLLQV-SNVBAGLBSA-N 1 1 239.309 3.553 20 0 BHADMO CC(C)[N@@H+](Cc1cc2cccnc2o1)C1CCC1 ZINC000449028926 388132813 /nfs/dbraw/zinc/13/28/13/388132813.db2.gz NAIUAULQVQPZPV-UHFFFAOYSA-N 1 1 244.338 3.591 20 0 BHADMO CSCC[C@H](C)[N@@H+](C)Cc1csc(C)c1 ZINC000449029819 388132369 /nfs/dbraw/zinc/13/23/69/388132369.db2.gz PTQIFUSBRIOZHL-JTQLQIEISA-N 1 1 243.441 3.630 20 0 BHADMO CSCC[C@@H](C)[N@@H+](C)Cc1csc(C)c1 ZINC000449029820 388133023 /nfs/dbraw/zinc/13/30/23/388133023.db2.gz PTQIFUSBRIOZHL-SNVBAGLBSA-N 1 1 243.441 3.630 20 0 BHADMO CCC(C)(C)[N@@H+](C)Cc1csc(C)c1 ZINC000449031583 388132966 /nfs/dbraw/zinc/13/29/66/388132966.db2.gz WTLHCKYTGUIWRO-UHFFFAOYSA-N 1 1 211.374 3.677 20 0 BHADMO c1cc2cccc(C[N@H+]3CCC34CCC4)c2o1 ZINC000449031987 388133515 /nfs/dbraw/zinc/13/35/15/388133515.db2.gz WGCRDIXQRGXSGD-UHFFFAOYSA-N 1 1 227.307 3.561 20 0 BHADMO C[C@@H]1CCCCC[N@H+]1Cc1cc2cccnc2o1 ZINC000449033520 385438006 /nfs/dbraw/zinc/43/80/06/385438006.db2.gz DNUDMRWFUKOXGH-GFCCVEGCSA-N 1 1 244.338 3.592 20 0 BHADMO C[C@H]1CCCCC[N@H+]1Cc1cc2cccnc2o1 ZINC000449033521 385437720 /nfs/dbraw/zinc/43/77/20/385437720.db2.gz DNUDMRWFUKOXGH-LBPRGKRZSA-N 1 1 244.338 3.592 20 0 BHADMO Cc1cc(C[N@H+]2CCc3ccsc3C2)cs1 ZINC000449035244 388134429 /nfs/dbraw/zinc/13/44/29/388134429.db2.gz NFYCCYQMUZKLFA-UHFFFAOYSA-N 1 1 249.404 3.676 20 0 BHADMO CC[C@@H](C)C[N@@H+](CC)Cc1cc2cccnc2o1 ZINC000449038950 388134448 /nfs/dbraw/zinc/13/44/48/388134448.db2.gz XUZMHAGQGSUZCN-GFCCVEGCSA-N 1 1 246.354 3.696 20 0 BHADMO CC[C@H](C)C[N@@H+](CC)Cc1cc2cccnc2o1 ZINC000449038951 388134344 /nfs/dbraw/zinc/13/43/44/388134344.db2.gz XUZMHAGQGSUZCN-LBPRGKRZSA-N 1 1 246.354 3.696 20 0 BHADMO Cc1cc(C[N@H+](C)[C@H](C)C2(C)CC2)cs1 ZINC000449048851 487569096 /nfs/dbraw/zinc/56/90/96/487569096.db2.gz QHXCITJYGPUUFG-LLVKDONJSA-N 1 1 223.385 3.677 20 0 BHADMO Cc1cc(C[N@H+](C)[C@@H](C)C2(C)CC2)cs1 ZINC000449048852 487569524 /nfs/dbraw/zinc/56/95/24/487569524.db2.gz QHXCITJYGPUUFG-NSHDSACASA-N 1 1 223.385 3.677 20 0 BHADMO Cc1cc[nH+]c(N[C@@H]2CCCC23CCC3)c1 ZINC000449085673 388140432 /nfs/dbraw/zinc/14/04/32/388140432.db2.gz ABOZRCXRQWTRCW-GFCCVEGCSA-N 1 1 216.328 3.525 20 0 BHADMO Cc1cc[nH+]c(N[C@H]2CCCC23CCC3)c1 ZINC000449085674 388140768 /nfs/dbraw/zinc/14/07/68/388140768.db2.gz ABOZRCXRQWTRCW-LBPRGKRZSA-N 1 1 216.328 3.525 20 0 BHADMO Cc1ccc(N[C@@H]2CCCC23CCC3)[nH+]c1 ZINC000449092172 201805251 /nfs/dbraw/zinc/80/52/51/201805251.db2.gz RZPSRRHUSAMQDX-GFCCVEGCSA-N 1 1 216.328 3.525 20 0 BHADMO Cc1ccc(N[C@H]2CCCC23CCC3)[nH+]c1 ZINC000449092173 388141481 /nfs/dbraw/zinc/14/14/81/388141481.db2.gz RZPSRRHUSAMQDX-LBPRGKRZSA-N 1 1 216.328 3.525 20 0 BHADMO CCc1ccc[nH+]c1NCc1csc(C)c1 ZINC000449222097 388159349 /nfs/dbraw/zinc/15/93/49/388159349.db2.gz LJGYOAQFQCLFHX-UHFFFAOYSA-N 1 1 232.352 3.626 20 0 BHADMO Cc1cc(C[N@H+]2CCCC23CCC3)cs1 ZINC000449281240 388167471 /nfs/dbraw/zinc/16/74/71/388167471.db2.gz CNZUKUKQWCRBJJ-UHFFFAOYSA-N 1 1 221.369 3.575 20 0 BHADMO COc1cc(C)ccc1C[N@H+]1CCCC12CCC2 ZINC000449288567 388167947 /nfs/dbraw/zinc/16/79/47/388167947.db2.gz 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3.598 20 0 BHADMO CCC(CC)[N@@H+](CC)Cc1cc2cccnc2o1 ZINC000449328790 388173074 /nfs/dbraw/zinc/17/30/74/388173074.db2.gz LHINGZURNPHCPV-UHFFFAOYSA-N 1 1 246.354 3.838 20 0 BHADMO Cc1cc(C[N@H+](C)[C@H](C)C2CCC2)cs1 ZINC000449329700 383875172 /nfs/dbraw/zinc/87/51/72/383875172.db2.gz IYJSAANWCBOUMV-LLVKDONJSA-N 1 1 223.385 3.677 20 0 BHADMO Cc1cc(C[N@H+](C)[C@@H](C)C2CCC2)cs1 ZINC000449329701 383873558 /nfs/dbraw/zinc/87/35/58/383873558.db2.gz IYJSAANWCBOUMV-NSHDSACASA-N 1 1 223.385 3.677 20 0 BHADMO CC[C@H]1CC[C@H](C)[N@H+]1Cc1cc2cccnc2o1 ZINC000449332465 388174126 /nfs/dbraw/zinc/17/41/26/388174126.db2.gz RHZFLEZPIFUOFG-AAEUAGOBSA-N 1 1 244.338 3.591 20 0 BHADMO CC[C@@H]1CC[C@@H](C)[N@H+]1Cc1cc2cccnc2o1 ZINC000449332466 388174493 /nfs/dbraw/zinc/17/44/93/388174493.db2.gz RHZFLEZPIFUOFG-DGCLKSJQSA-N 1 1 244.338 3.591 20 0 BHADMO CC[C@@H]1CC[C@H](C)[N@H+]1Cc1cc2cccnc2o1 ZINC000449332467 388174061 /nfs/dbraw/zinc/17/40/61/388174061.db2.gz RHZFLEZPIFUOFG-WCQYABFASA-N 1 1 244.338 3.591 20 0 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CC[C@@H]([NH2+]C[C@H](C)c1ccc(F)cc1)C(F)F ZINC000449362914 388181960 /nfs/dbraw/zinc/18/19/60/388181960.db2.gz OENYKPAJJXDMFH-JOYOIKCWSA-N 1 1 245.288 3.563 20 0 BHADMO CC[C@H]([NH2+]C[C@@H](C)c1ccc(F)cc1)C(F)F ZINC000449362915 388182373 /nfs/dbraw/zinc/18/23/73/388182373.db2.gz OENYKPAJJXDMFH-SKDRFNHKSA-N 1 1 245.288 3.563 20 0 BHADMO CC[C@H]([NH2+][C@@H](C)Cc1ccccc1C)C(F)F ZINC000449363537 383988178 /nfs/dbraw/zinc/98/81/78/383988178.db2.gz PQUAUGWFJUUMLF-AAEUAGOBSA-N 1 1 241.325 3.559 20 0 BHADMO CC[C@@H]([NH2+][C@H](C)Cc1ccccc1C)C(F)F ZINC000449363542 383986262 /nfs/dbraw/zinc/98/62/62/383986262.db2.gz PQUAUGWFJUUMLF-DGCLKSJQSA-N 1 1 241.325 3.559 20 0 BHADMO CC[C@@H]([NH2+][C@@H](C)Cc1ccccc1C)C(F)F ZINC000449363544 383985907 /nfs/dbraw/zinc/98/59/07/383985907.db2.gz PQUAUGWFJUUMLF-WCQYABFASA-N 1 1 241.325 3.559 20 0 BHADMO CC[C@H]([NH2+][C@H](C)Cc1ccccc1C)C(F)F ZINC000449363545 383985755 /nfs/dbraw/zinc/98/57/55/383985755.db2.gz PQUAUGWFJUUMLF-YPMHNXCESA-N 1 1 241.325 3.559 20 0 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241.325 3.814 20 0 BHADMO Clc1oc2ccccc2c1C[NH+]1CC2(CC2)C1 ZINC000449370621 398292215 /nfs/dbraw/zinc/29/22/15/398292215.db2.gz LGUBIRLUMFDKPR-UHFFFAOYSA-N 1 1 247.725 3.682 20 0 BHADMO Cc1ccccc1C[C@@H](C)[NH2+][C@@H](C)C(C)(F)F ZINC000449412833 384297747 /nfs/dbraw/zinc/29/77/47/384297747.db2.gz GTSMUUMSSMFGNY-NEPJUHHUSA-N 1 1 241.325 3.559 20 0 BHADMO Cc1ccccc1C[C@H](C)[NH2+][C@H](C)C(C)(F)F ZINC000449412834 384298936 /nfs/dbraw/zinc/29/89/36/384298936.db2.gz GTSMUUMSSMFGNY-NWDGAFQWSA-N 1 1 241.325 3.559 20 0 BHADMO Cc1ccccc1C[C@H](C)[NH2+][C@@H](C)C(C)(F)F ZINC000449412835 384298773 /nfs/dbraw/zinc/29/87/73/384298773.db2.gz GTSMUUMSSMFGNY-RYUDHWBXSA-N 1 1 241.325 3.559 20 0 BHADMO Cc1ccccc1C[C@@H](C)[NH2+][C@H](C)C(C)(F)F ZINC000449412836 384297180 /nfs/dbraw/zinc/29/71/80/384297180.db2.gz GTSMUUMSSMFGNY-VXGBXAGGSA-N 1 1 241.325 3.559 20 0 BHADMO C[C@H](CCc1ccsc1)[NH2+][C@H](C)C(C)(F)F ZINC000449417251 388199524 /nfs/dbraw/zinc/19/95/24/388199524.db2.gz XIZUZHOEWVDTOU-NXEZZACHSA-N 1 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20 0 BHADMO CC(=O)c1cccc(C[N@@H+]2CCCC[C@@H](C)C2)c1 ZINC000450765292 202259234 /nfs/dbraw/zinc/25/92/34/202259234.db2.gz AOXFIQHEHRZLRK-CYBMUJFWSA-N 1 1 245.366 3.511 20 0 BHADMO CC(=O)c1cccc(C[N@@H+]2CCCC[C@H](C)C2)c1 ZINC000450765293 386687621 /nfs/dbraw/zinc/68/76/21/386687621.db2.gz AOXFIQHEHRZLRK-ZDUSSCGKSA-N 1 1 245.366 3.511 20 0 BHADMO CC(=O)c1ccc(C[N@@H+]2CCCC[C@@H](C)C2)cc1 ZINC000450767902 202260862 /nfs/dbraw/zinc/26/08/62/202260862.db2.gz CUWNADLZHPKYLC-CYBMUJFWSA-N 1 1 245.366 3.511 20 0 BHADMO CC(=O)c1ccc(C[N@@H+]2CCCC[C@H](C)C2)cc1 ZINC000450767903 202260799 /nfs/dbraw/zinc/26/07/99/202260799.db2.gz CUWNADLZHPKYLC-ZDUSSCGKSA-N 1 1 245.366 3.511 20 0 BHADMO CC[C@@H]1[C@@H](C)CC[N@H+]1Cc1cccc(C(C)=O)c1 ZINC000450777714 202264853 /nfs/dbraw/zinc/26/48/53/202264853.db2.gz YIGYDKBFIOBVAI-BLLLJJGKSA-N 1 1 245.366 3.510 20 0 BHADMO CC[C@H]1[C@@H](C)CC[N@H+]1Cc1cccc(C(C)=O)c1 ZINC000450777715 386698650 /nfs/dbraw/zinc/69/86/50/386698650.db2.gz YIGYDKBFIOBVAI-LRDDRELGSA-N 1 1 245.366 3.510 20 0 BHADMO CC[C@@H]1[C@H](C)CC[N@H+]1Cc1cccc(C(C)=O)c1 ZINC000450777716 386699065 /nfs/dbraw/zinc/69/90/65/386699065.db2.gz YIGYDKBFIOBVAI-MLGOLLRUSA-N 1 1 245.366 3.510 20 0 BHADMO CC[C@H]1[C@H](C)CC[N@H+]1Cc1cccc(C(C)=O)c1 ZINC000450777717 386698297 /nfs/dbraw/zinc/69/82/97/386698297.db2.gz YIGYDKBFIOBVAI-WBMJQRKESA-N 1 1 245.366 3.510 20 0 BHADMO C[C@@H]1CCCC[N@@H+](C[C@H]2CCC(F)(F)C2)C1 ZINC000450781237 202264308 /nfs/dbraw/zinc/26/43/08/202264308.db2.gz RPTDWWYJFPTQLT-NEPJUHHUSA-N 1 1 231.330 3.544 20 0 BHADMO C[C@H]1CCCC[N@@H+](C[C@@H]2CCC(F)(F)C2)C1 ZINC000450781238 202264334 /nfs/dbraw/zinc/26/43/34/202264334.db2.gz RPTDWWYJFPTQLT-NWDGAFQWSA-N 1 1 231.330 3.544 20 0 BHADMO C[C@H]1CCCC[N@@H+](C[C@H]2CCC(F)(F)C2)C1 ZINC000450781239 202263714 /nfs/dbraw/zinc/26/37/14/202263714.db2.gz RPTDWWYJFPTQLT-RYUDHWBXSA-N 1 1 231.330 3.544 20 0 BHADMO C[C@@H]1CCCC[N@@H+](C[C@@H]2CCC(F)(F)C2)C1 ZINC000450781240 202263415 /nfs/dbraw/zinc/26/34/15/202263415.db2.gz RPTDWWYJFPTQLT-VXGBXAGGSA-N 1 1 231.330 3.544 20 0 BHADMO FC1(F)CCCC[C@@H]1C[N@H+]1CC[C@H]2CCC[C@H]21 ZINC000450782761 202265940 /nfs/dbraw/zinc/26/59/40/202265940.db2.gz YXUZEHIDRSFZLL-JHJVBQTASA-N 1 1 243.341 3.686 20 0 BHADMO FC1(F)CCCC[C@@H]1C[N@H+]1CC[C@H]2CCC[C@@H]21 ZINC000450782762 202264952 /nfs/dbraw/zinc/26/49/52/202264952.db2.gz YXUZEHIDRSFZLL-UPJWGTAASA-N 1 1 243.341 3.686 20 0 BHADMO FC1(F)CCCC[C@@H]1C[N@H+]1CC[C@@H]2CCC[C@@H]21 ZINC000450782763 202264635 /nfs/dbraw/zinc/26/46/35/202264635.db2.gz YXUZEHIDRSFZLL-XQQFMLRXSA-N 1 1 243.341 3.686 20 0 BHADMO FC1(F)CCCC[C@@H]1C[N@H+]1CC[C@@H]2CCC[C@H]21 ZINC000450782764 202263733 /nfs/dbraw/zinc/26/37/33/202263733.db2.gz YXUZEHIDRSFZLL-YNEHKIRRSA-N 1 1 243.341 3.686 20 0 BHADMO C[C@H]1CCCC[C@H]1[N@@H+](C)CC1CC(F)(F)C1 ZINC000450805354 202269941 /nfs/dbraw/zinc/26/99/41/202269941.db2.gz ALBIZRDCODLPSY-CMPLNLGQSA-N 1 1 231.330 3.542 20 0 BHADMO C[C@H]1CCCC[C@@H]1[N@@H+](C)CC1CC(F)(F)C1 ZINC000450805356 202270723 /nfs/dbraw/zinc/27/07/23/202270723.db2.gz ALBIZRDCODLPSY-JQWIXIFHSA-N 1 1 231.330 3.542 20 0 BHADMO C[C@@H]1CCCC[C@@H]1[N@@H+](C)CC1CC(F)(F)C1 ZINC000450805358 202269482 /nfs/dbraw/zinc/26/94/82/202269482.db2.gz ALBIZRDCODLPSY-PWSUYJOCSA-N 1 1 231.330 3.542 20 0 BHADMO C[C@@H]1CCCC[C@H]1[N@@H+](C)CC1CC(F)(F)C1 ZINC000450805361 202270320 /nfs/dbraw/zinc/27/03/20/202270320.db2.gz ALBIZRDCODLPSY-ZYHUDNBSSA-N 1 1 231.330 3.542 20 0 BHADMO CC1(C)CCCC[N@@H+](CC2CC(F)(F)C2)C1 ZINC000450822177 202275443 /nfs/dbraw/zinc/27/54/43/202275443.db2.gz SQFYLSOYZYHVEJ-UHFFFAOYSA-N 1 1 231.330 3.544 20 0 BHADMO FC1(F)CC(C[N@H+]2CCCC3(CCCC3)C2)C1 ZINC000450824870 202277103 /nfs/dbraw/zinc/27/71/03/202277103.db2.gz FNVCITLTYBUTFJ-UHFFFAOYSA-N 1 1 243.341 3.688 20 0 BHADMO CC(=O)c1cccc(C[N@H+](C)[C@@H]2CC[C@H](C)C2)c1 ZINC000450853694 202289161 /nfs/dbraw/zinc/28/91/61/202289161.db2.gz IFRFQPNUVJOKLL-BLLLJJGKSA-N 1 1 245.366 3.510 20 0 BHADMO CC(=O)c1cccc(C[N@H+](C)[C@H]2CC[C@H](C)C2)c1 ZINC000450853695 202290478 /nfs/dbraw/zinc/29/04/78/202290478.db2.gz IFRFQPNUVJOKLL-LRDDRELGSA-N 1 1 245.366 3.510 20 0 BHADMO CC(=O)c1cccc(C[N@H+](C)[C@@H]2CC[C@@H](C)C2)c1 ZINC000450853696 202290422 /nfs/dbraw/zinc/29/04/22/202290422.db2.gz IFRFQPNUVJOKLL-MLGOLLRUSA-N 1 1 245.366 3.510 20 0 BHADMO CC(=O)c1cccc(C[N@H+](C)[C@H]2CC[C@@H](C)C2)c1 ZINC000450853697 202290831 /nfs/dbraw/zinc/29/08/31/202290831.db2.gz IFRFQPNUVJOKLL-WBMJQRKESA-N 1 1 245.366 3.510 20 0 BHADMO CC(=O)c1ccc(C[N@H+](C)[C@@H]2CC[C@H](C)C2)cc1 ZINC000450854417 202289308 /nfs/dbraw/zinc/28/93/08/202289308.db2.gz KGUKYRJRWPOSHB-BLLLJJGKSA-N 1 1 245.366 3.510 20 0 BHADMO CC(=O)c1ccc(C[N@H+](C)[C@H]2CC[C@H](C)C2)cc1 ZINC000450854418 202290258 /nfs/dbraw/zinc/29/02/58/202290258.db2.gz KGUKYRJRWPOSHB-LRDDRELGSA-N 1 1 245.366 3.510 20 0 BHADMO CC(=O)c1ccc(C[N@H+](C)[C@@H]2CC[C@@H](C)C2)cc1 ZINC000450854419 202289790 /nfs/dbraw/zinc/28/97/90/202289790.db2.gz KGUKYRJRWPOSHB-MLGOLLRUSA-N 1 1 245.366 3.510 20 0 BHADMO CC(=O)c1ccc(C[N@H+](C)[C@H]2CC[C@@H](C)C2)cc1 ZINC000450854420 202290122 /nfs/dbraw/zinc/29/01/22/202290122.db2.gz KGUKYRJRWPOSHB-WBMJQRKESA-N 1 1 245.366 3.510 20 0 BHADMO C[C@@H]1CC[C@@H]([N@@H+](C)C[C@H]2CCC(F)(F)C2)C1 ZINC000450856957 386774458 /nfs/dbraw/zinc/77/44/58/386774458.db2.gz PQXHSQYLUGIAJT-GRYCIOLGSA-N 1 1 231.330 3.542 20 0 BHADMO C[C@@H]1CC[C@@H]([N@@H+](C)C[C@@H]2CCC(F)(F)C2)C1 ZINC000450856958 386775558 /nfs/dbraw/zinc/77/55/58/386775558.db2.gz PQXHSQYLUGIAJT-IJLUTSLNSA-N 1 1 231.330 3.542 20 0 BHADMO C[C@@H]1CC[C@H]([N@@H+](C)C[C@@H]2CCC(F)(F)C2)C1 ZINC000450856960 386775357 /nfs/dbraw/zinc/77/53/57/386775357.db2.gz PQXHSQYLUGIAJT-UTUOFQBUSA-N 1 1 231.330 3.542 20 0 BHADMO C[C@@H]1CC[C@H]([N@@H+](C)C[C@H]2CCC(F)(F)C2)C1 ZINC000450856962 219878734 /nfs/dbraw/zinc/87/87/34/219878734.db2.gz PQXHSQYLUGIAJT-WOPDTQHZSA-N 1 1 231.330 3.542 20 0 BHADMO FC(F)(F)C[C@H]1CC[N@@H+](CC2=CCCCC2)C1 ZINC000450858727 202292660 /nfs/dbraw/zinc/29/26/60/202292660.db2.gz 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/nfs/dbraw/zinc/29/39/46/202293946.db2.gz UPCKVIHMKQLUKX-UHFFFAOYSA-N 1 1 231.330 3.542 20 0 BHADMO CC(C)[N@@H+](CC1CCC1)C[C@@H]1CCC(F)(F)C1 ZINC000450867071 202293622 /nfs/dbraw/zinc/29/36/22/202293622.db2.gz XVIFYNAPUFVODW-CYBMUJFWSA-N 1 1 245.357 3.932 20 0 BHADMO CC(C)[N@@H+](CC1CCC1)C[C@H]1CCC(F)(F)C1 ZINC000450867072 386786205 /nfs/dbraw/zinc/78/62/05/386786205.db2.gz XVIFYNAPUFVODW-ZDUSSCGKSA-N 1 1 245.357 3.932 20 0 BHADMO CC(C)C[C@@H](C)[N@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000450867674 528258642 /nfs/dbraw/zinc/25/86/42/528258642.db2.gz ZQCQWGWRUOFOGF-GHMZBOCLSA-N 1 1 237.309 3.695 20 0 BHADMO CC(C)C[C@@H](C)[N@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000450867680 528259104 /nfs/dbraw/zinc/25/91/04/528259104.db2.gz ZQCQWGWRUOFOGF-MNOVXSKESA-N 1 1 237.309 3.695 20 0 BHADMO CC(C)C[C@H](C)[N@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000450867681 528468182 /nfs/dbraw/zinc/46/81/82/528468182.db2.gz ZQCQWGWRUOFOGF-QWRGUYRKSA-N 1 1 237.309 3.695 20 0 BHADMO CC(C)C[C@H](C)[N@H+]1CC[C@H](CC(F)(F)F)C1 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ZINC000450876326 202296296 /nfs/dbraw/zinc/29/62/96/202296296.db2.gz OXYOUCQFFDCEGC-NSHDSACASA-N 1 1 231.330 3.686 20 0 BHADMO C[N@@H+](C[C@H]1CCCCC1(F)F)[C@@H]1CC1(C)C ZINC000450879362 202295237 /nfs/dbraw/zinc/29/52/37/202295237.db2.gz UUMSJSVWZBNOQB-GHMZBOCLSA-N 1 1 231.330 3.542 20 0 BHADMO C[N@@H+](C[C@H]1CCCCC1(F)F)[C@H]1CC1(C)C ZINC000450879363 202294887 /nfs/dbraw/zinc/29/48/87/202294887.db2.gz UUMSJSVWZBNOQB-MNOVXSKESA-N 1 1 231.330 3.542 20 0 BHADMO C[N@@H+](C[C@@H]1CCCCC1(F)F)[C@H]1CC1(C)C ZINC000450879364 202294867 /nfs/dbraw/zinc/29/48/67/202294867.db2.gz UUMSJSVWZBNOQB-QWRGUYRKSA-N 1 1 231.330 3.542 20 0 BHADMO C[N@@H+](C[C@@H]1CCCCC1(F)F)[C@@H]1CC1(C)C ZINC000450879365 202295558 /nfs/dbraw/zinc/29/55/58/202295558.db2.gz UUMSJSVWZBNOQB-WDEREUQCSA-N 1 1 231.330 3.542 20 0 BHADMO CC(=O)c1cccc(C[N@H+](C)C2(C)CCCC2)c1 ZINC000450880974 202294587 /nfs/dbraw/zinc/29/45/87/202294587.db2.gz XSZLVYGVAORPDJ-UHFFFAOYSA-N 1 1 245.366 3.654 20 0 BHADMO C[C@@H](C1CCCCC1)[N@@H+](C)CC1CC(F)(F)C1 ZINC000450881084 202296410 /nfs/dbraw/zinc/29/64/10/202296410.db2.gz YGQJSWUAEXVPJV-NSHDSACASA-N 1 1 245.357 3.932 20 0 BHADMO FC1(F)CC[C@@H](C[N@H+]2CCCC3(CCC3)C2)C1 ZINC000450883455 202296739 /nfs/dbraw/zinc/29/67/39/202296739.db2.gz PXWDKMALRZCEIS-GFCCVEGCSA-N 1 1 243.341 3.688 20 0 BHADMO FC1(F)CC[C@H](C[N@H+]2CCCC3(CCC3)C2)C1 ZINC000450883456 202297734 /nfs/dbraw/zinc/29/77/34/202297734.db2.gz PXWDKMALRZCEIS-LBPRGKRZSA-N 1 1 243.341 3.688 20 0 BHADMO CCCc1[nH+]ccn1Cc1c(C)cccc1Cl ZINC000450884971 202298093 /nfs/dbraw/zinc/29/80/93/202298093.db2.gz AHBLTURFOSDDKC-UHFFFAOYSA-N 1 1 248.757 3.846 20 0 BHADMO C[C@H]1[C@H](C(F)(F)F)CC[N@H+]1CC1=CCCCC1 ZINC000450885954 202297678 /nfs/dbraw/zinc/29/76/78/202297678.db2.gz DEBOVVBTEDTUPV-CMPLNLGQSA-N 1 1 247.304 3.760 20 0 BHADMO C[C@H]1[C@@H](C(F)(F)F)CC[N@H+]1CC1=CCCCC1 ZINC000450885955 202297904 /nfs/dbraw/zinc/29/79/04/202297904.db2.gz DEBOVVBTEDTUPV-JQWIXIFHSA-N 1 1 247.304 3.760 20 0 BHADMO C[C@@H]1[C@@H](C(F)(F)F)CC[N@H+]1CC1=CCCCC1 ZINC000450885956 202297137 /nfs/dbraw/zinc/29/71/37/202297137.db2.gz DEBOVVBTEDTUPV-PWSUYJOCSA-N 1 1 247.304 3.760 20 0 BHADMO C[C@@H]1[C@H](C(F)(F)F)CC[N@H+]1CC1=CCCCC1 ZINC000450885957 202298098 /nfs/dbraw/zinc/29/80/98/202298098.db2.gz DEBOVVBTEDTUPV-ZYHUDNBSSA-N 1 1 247.304 3.760 20 0 BHADMO CC(C)C[C@H](C)[N@H+]1CC[C@H](C(F)(F)F)[C@H]1C ZINC000450889232 202298682 /nfs/dbraw/zinc/29/86/82/202298682.db2.gz QGCQRFSKTCQDIU-AXFHLTTASA-N 1 1 237.309 3.694 20 0 BHADMO CC(C)C[C@H](C)[N@H+]1CC[C@H](C(F)(F)F)[C@@H]1C ZINC000450889233 202297298 /nfs/dbraw/zinc/29/72/98/202297298.db2.gz QGCQRFSKTCQDIU-DCAQKATOSA-N 1 1 237.309 3.694 20 0 BHADMO CC(C)C[C@H](C)[N@H+]1CC[C@@H](C(F)(F)F)[C@@H]1C ZINC000450889234 202296743 /nfs/dbraw/zinc/29/67/43/202296743.db2.gz QGCQRFSKTCQDIU-GARJFASQSA-N 1 1 237.309 3.694 20 0 BHADMO CC(C)C[C@H](C)[N@H+]1CC[C@@H](C(F)(F)F)[C@H]1C ZINC000450889235 202297346 /nfs/dbraw/zinc/29/73/46/202297346.db2.gz 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/nfs/dbraw/zinc/24/29/93/388242993.db2.gz XJYHWMSLTNMPQJ-SNVBAGLBSA-N 1 1 219.319 3.542 20 0 BHADMO C[N@@H+](CC1CCC(F)(F)CC1)[C@@H]1CC1(C)C ZINC000459414884 203275547 /nfs/dbraw/zinc/27/55/47/203275547.db2.gz ARPNJIMLWQMDBN-LLVKDONJSA-N 1 1 231.330 3.542 20 0 BHADMO C[N@@H+](CC1CCC(F)(F)CC1)[C@H]1CC1(C)C ZINC000459414888 203275388 /nfs/dbraw/zinc/27/53/88/203275388.db2.gz ARPNJIMLWQMDBN-NSHDSACASA-N 1 1 231.330 3.542 20 0 BHADMO FC1(F)CCC(C[N@H+]2CCCC3(CC3)C2)CC1 ZINC000459415776 203278586 /nfs/dbraw/zinc/27/85/86/203278586.db2.gz XEELOJBFHXUZOP-UHFFFAOYSA-N 1 1 243.341 3.688 20 0 BHADMO FC1(F)CCC(C[N@H+]2CCCC23CCC3)CC1 ZINC000459420807 324147232 /nfs/dbraw/zinc/14/72/32/324147232.db2.gz GHCPIPPDUAVSLH-UHFFFAOYSA-N 1 1 243.341 3.830 20 0 BHADMO FC1(F)CCC(C[N@H+]2CC[C@H]3CCC[C@H]32)CC1 ZINC000459432240 203279575 /nfs/dbraw/zinc/27/95/75/203279575.db2.gz SEDJUHYHSCLSGP-CHWSQXEVSA-N 1 1 243.341 3.686 20 0 BHADMO FC1(F)CCC(C[N@H+]2CC[C@H]3CCC[C@@H]32)CC1 ZINC000459432241 203279911 /nfs/dbraw/zinc/27/99/11/203279911.db2.gz SEDJUHYHSCLSGP-OLZOCXBDSA-N 1 1 243.341 3.686 20 0 BHADMO FC1(F)CCC(C[N@H+]2CC[C@@H]3CCC[C@H]32)CC1 ZINC000459432243 203281133 /nfs/dbraw/zinc/28/11/33/203281133.db2.gz SEDJUHYHSCLSGP-QWHCGFSZSA-N 1 1 243.341 3.686 20 0 BHADMO FC1(F)CCC(C[N@H+]2CC[C@@H]3CCC[C@@H]32)CC1 ZINC000459432244 203280882 /nfs/dbraw/zinc/28/08/82/203280882.db2.gz SEDJUHYHSCLSGP-STQMWFEESA-N 1 1 243.341 3.686 20 0 BHADMO C[C@H](C1CCC1)[N@@H+](C)CC1CCC(F)(F)CC1 ZINC000459476519 203286647 /nfs/dbraw/zinc/28/66/47/203286647.db2.gz RGPXYJOEKQFYHW-LLVKDONJSA-N 1 1 245.357 3.932 20 0 BHADMO C[C@@H](C1CCC1)[N@@H+](C)CC1CCC(F)(F)CC1 ZINC000459476520 203287903 /nfs/dbraw/zinc/28/79/03/203287903.db2.gz RGPXYJOEKQFYHW-NSHDSACASA-N 1 1 245.357 3.932 20 0 BHADMO c1cc(C2CC2)ccc1C[N@H+]1CCCSCC1 ZINC000459477435 203287196 /nfs/dbraw/zinc/28/71/96/203287196.db2.gz HEDDDIYVZCPOIS-UHFFFAOYSA-N 1 1 247.407 3.503 20 0 BHADMO C[C@@]1(F)CCC[N@@H+](CC2CCC(F)(F)CC2)C1 ZINC000459481843 203291562 /nfs/dbraw/zinc/29/15/62/203291562.db2.gz BMDPLKCANKSWRX-GFCCVEGCSA-N 1 1 249.320 3.636 20 0 BHADMO C[C@]1(F)CCC[N@@H+](CC2CCC(F)(F)CC2)C1 ZINC000459481847 203291162 /nfs/dbraw/zinc/29/11/62/203291162.db2.gz BMDPLKCANKSWRX-LBPRGKRZSA-N 1 1 249.320 3.636 20 0 BHADMO c1ccc([C@@H]2C[C@H]2C[N@H+]2CC[C@H]3CCC[C@H]32)cc1 ZINC000459489371 203292080 /nfs/dbraw/zinc/29/20/80/203292080.db2.gz JXMNPGBNIXDSRL-LTIDMASMSA-N 1 1 241.378 3.665 20 0 BHADMO c1ccc([C@@H]2C[C@H]2C[N@H+]2CC[C@@H]3CCC[C@H]32)cc1 ZINC000459489372 387949291 /nfs/dbraw/zinc/94/92/91/387949291.db2.gz JXMNPGBNIXDSRL-LUKYLMHMSA-N 1 1 241.378 3.665 20 0 BHADMO c1ccc([C@@H]2C[C@H]2C[N@H+]2CC[C@@H]3CCC[C@@H]32)cc1 ZINC000459489374 219955747 /nfs/dbraw/zinc/95/57/47/219955747.db2.gz JXMNPGBNIXDSRL-QAETUUGQSA-N 1 1 241.378 3.665 20 0 BHADMO c1ccc([C@@H]2C[C@H]2C[N@H+]2CC[C@H]3CCC[C@@H]32)cc1 ZINC000459489375 387950005 /nfs/dbraw/zinc/95/00/05/387950005.db2.gz JXMNPGBNIXDSRL-QZWWFDLISA-N 1 1 241.378 3.665 20 0 BHADMO CCC[C@H](CCc1ccccc1)[NH2+]CC(F)F ZINC000459550554 203297776 /nfs/dbraw/zinc/29/77/76/203297776.db2.gz UMFLUYLYCUPYOQ-CYBMUJFWSA-N 1 1 241.325 3.643 20 0 BHADMO CCC[C@@H](CCc1ccccc1)[NH2+]CC(F)F ZINC000459550555 203297716 /nfs/dbraw/zinc/29/77/16/203297716.db2.gz UMFLUYLYCUPYOQ-ZDUSSCGKSA-N 1 1 241.325 3.643 20 0 BHADMO C[C@H]([NH2+]CC(F)F)[C@@H](C)c1ccc(Cl)cc1 ZINC000459551405 203299244 /nfs/dbraw/zinc/29/92/44/203299244.db2.gz VYZIQMHXXRUPNT-BDAKNGLRSA-N 1 1 247.716 3.687 20 0 BHADMO C[C@@H]([NH2+]CC(F)F)[C@H](C)c1ccc(Cl)cc1 ZINC000459551406 203299015 /nfs/dbraw/zinc/29/90/15/203299015.db2.gz VYZIQMHXXRUPNT-DTWKUNHWSA-N 1 1 247.716 3.687 20 0 BHADMO C[C@H](c1ccc(Cl)cc1)[C@H](C)[NH2+]CC(F)F ZINC000459551407 203298172 /nfs/dbraw/zinc/29/81/72/203298172.db2.gz VYZIQMHXXRUPNT-IUCAKERBSA-N 1 1 247.716 3.687 20 0 BHADMO C[C@@H]([NH2+]CC(F)F)[C@@H](C)c1ccc(Cl)cc1 ZINC000459551408 203297635 /nfs/dbraw/zinc/29/76/35/203297635.db2.gz VYZIQMHXXRUPNT-RKDXNWHRSA-N 1 1 247.716 3.687 20 0 BHADMO c1cc(C2CC2)cc(NC2CC3(CCC3)C2)[nH+]1 ZINC000459557190 203300694 /nfs/dbraw/zinc/30/06/94/203300694.db2.gz CWVUIZGXKLBXMQ-UHFFFAOYSA-N 1 1 228.339 3.704 20 0 BHADMO Clc1csc(C[NH+]2CC3(C2)CCCC3)c1 ZINC000459558158 203300632 /nfs/dbraw/zinc/30/06/32/203300632.db2.gz ILADNRRTIZJUQN-UHFFFAOYSA-N 1 1 241.787 3.778 20 0 BHADMO Clc1ccsc1C[NH+]1CC2(C1)CCCC2 ZINC000459558197 203300367 /nfs/dbraw/zinc/30/03/67/203300367.db2.gz IXLNEHJPXNGKBQ-UHFFFAOYSA-N 1 1 241.787 3.778 20 0 BHADMO Clc1sccc1C[NH+]1CC2(C1)CCCC2 ZINC000459559580 203299943 /nfs/dbraw/zinc/29/99/43/203299943.db2.gz LAZTTXAADGNPSY-UHFFFAOYSA-N 1 1 241.787 3.778 20 0 BHADMO Clc1ccc(C[NH+]2CC3(C2)CCCC3)s1 ZINC000459563598 203299878 /nfs/dbraw/zinc/29/98/78/203299878.db2.gz PXKMMQXMIQEPNY-UHFFFAOYSA-N 1 1 241.787 3.778 20 0 BHADMO CC[C@@H]([NH2+]CCc1ccc(Cl)cc1)C(F)F ZINC000459570002 203303367 /nfs/dbraw/zinc/30/33/67/203303367.db2.gz MYSWSHOJXWKEHB-LLVKDONJSA-N 1 1 247.716 3.516 20 0 BHADMO CC[C@H]([NH2+]CCc1ccc(Cl)cc1)C(F)F ZINC000459570003 203304604 /nfs/dbraw/zinc/30/46/04/203304604.db2.gz MYSWSHOJXWKEHB-NSHDSACASA-N 1 1 247.716 3.516 20 0 BHADMO CS[C@H]1CC[N@@H+](Cc2ccc(C3CC3)cc2)C1 ZINC000459573233 387058679 /nfs/dbraw/zinc/05/86/79/387058679.db2.gz IGTISSSAEQEEDF-HNNXBMFYSA-N 1 1 247.407 3.501 20 0 BHADMO CS[C@@H]1CC[N@@H+](Cc2ccc(C3CC3)cc2)C1 ZINC000459573236 387058166 /nfs/dbraw/zinc/05/81/66/387058166.db2.gz IGTISSSAEQEEDF-OAHLLOKOSA-N 1 1 247.407 3.501 20 0 BHADMO C[C@@H]([NH2+]CCc1cccc(Cl)c1)C(C)(F)F ZINC000459574061 203305713 /nfs/dbraw/zinc/30/57/13/203305713.db2.gz SOZPMEBJPYJSJA-SECBINFHSA-N 1 1 247.716 3.516 20 0 BHADMO C[C@H]([NH2+]CCc1cccc(Cl)c1)C(C)(F)F ZINC000459574062 203305339 /nfs/dbraw/zinc/30/53/39/203305339.db2.gz SOZPMEBJPYJSJA-VIFPVBQESA-N 1 1 247.716 3.516 20 0 BHADMO CC1(C)Cc2ccsc2C[N@H+]1CCCCF ZINC000459575851 324148674 /nfs/dbraw/zinc/14/86/74/324148674.db2.gz FKYOVVWBEQPPRN-UHFFFAOYSA-N 1 1 241.375 3.635 20 0 BHADMO CC[C@@H]([NH2+]CCc1cccc(Cl)c1)C(F)F ZINC000459576617 324148611 /nfs/dbraw/zinc/14/86/11/324148611.db2.gz VPJBMGHDDVSIEG-LLVKDONJSA-N 1 1 247.716 3.516 20 0 BHADMO CC[C@H]([NH2+]CCc1cccc(Cl)c1)C(F)F ZINC000459576619 324148665 /nfs/dbraw/zinc/14/86/65/324148665.db2.gz VPJBMGHDDVSIEG-NSHDSACASA-N 1 1 247.716 3.516 20 0 BHADMO c1cc(C2CC2)ccc1C[N@H+]1CC[C@H]1C1CC1 ZINC000459577850 206135363 /nfs/dbraw/zinc/13/53/63/206135363.db2.gz MDJSOKDANGZDRG-INIZCTEOSA-N 1 1 227.351 3.548 20 0 BHADMO c1cc(C2CC2)ccc1C[N@H+]1CC[C@@H]1C1CC1 ZINC000459577853 206134699 /nfs/dbraw/zinc/13/46/99/206134699.db2.gz MDJSOKDANGZDRG-MRXNPFEDSA-N 1 1 227.351 3.548 20 0 BHADMO CC[N@H+]1CC2(CCCC2)[C@@H]1c1ccccc1 ZINC000459579771 206136229 /nfs/dbraw/zinc/13/62/29/206136229.db2.gz ZLXVCMGSGHDHJF-AWEZNQCLSA-N 1 1 215.340 3.624 20 0 BHADMO CC[N@H+]1CC2(CCCC2)[C@H]1c1ccccc1 ZINC000459579772 387065805 /nfs/dbraw/zinc/06/58/05/387065805.db2.gz ZLXVCMGSGHDHJF-CQSZACIVSA-N 1 1 215.340 3.624 20 0 BHADMO FCCC[N@H+]1CC2(CCCC2)[C@@H]1c1ccccc1 ZINC000459583644 534429857 /nfs/dbraw/zinc/42/98/57/534429857.db2.gz STEBTAVZPJQSIH-HNNXBMFYSA-N 1 1 247.357 3.963 20 0 BHADMO FCCC[N@H+]1CC2(CCCC2)[C@H]1c1ccccc1 ZINC000459583645 534430102 /nfs/dbraw/zinc/43/01/02/534430102.db2.gz STEBTAVZPJQSIH-OAHLLOKOSA-N 1 1 247.357 3.963 20 0 BHADMO C[C@H](F)CC[N@H+]1Cc2sccc2CC1(C)C ZINC000459588928 203310136 /nfs/dbraw/zinc/31/01/36/203310136.db2.gz WZHFURFOMLNJRH-JTQLQIEISA-N 1 1 241.375 3.633 20 0 BHADMO C[C@@H](F)CC[N@H+]1Cc2sccc2CC1(C)C ZINC000459588931 203309136 /nfs/dbraw/zinc/30/91/36/203309136.db2.gz WZHFURFOMLNJRH-SNVBAGLBSA-N 1 1 241.375 3.633 20 0 BHADMO Clc1ccc(C[NH+]2CC3(C2)CCCCC3)o1 ZINC000459597519 203312667 /nfs/dbraw/zinc/31/26/67/203312667.db2.gz QHAHTFAGIDERHL-UHFFFAOYSA-N 1 1 239.746 3.699 20 0 BHADMO Clc1ccc(C[NH+]2CC(C3CCCC3)C2)o1 ZINC000459606026 203314397 /nfs/dbraw/zinc/31/43/97/203314397.db2.gz DWEZAOUDTKXRSD-UHFFFAOYSA-N 1 1 239.746 3.555 20 0 BHADMO CC1(CC(F)(F)F)C[NH+](Cc2cccs2)C1 ZINC000459636299 203326665 /nfs/dbraw/zinc/32/66/65/203326665.db2.gz KNVADEYJCFAOGS-UHFFFAOYSA-N 1 1 249.301 3.522 20 0 BHADMO CC1(CC(F)(F)F)C[NH+](Cc2ccsc2)C1 ZINC000459638667 203327391 /nfs/dbraw/zinc/32/73/91/203327391.db2.gz MXZRJKYAENRNAM-UHFFFAOYSA-N 1 1 249.301 3.522 20 0 BHADMO CCC1(C)C[NH+](Cc2cc3c(cccc3F)[nH]2)C1 ZINC000459640710 203329009 /nfs/dbraw/zinc/32/90/09/203329009.db2.gz XKYUQYXPBLLXQR-UHFFFAOYSA-N 1 1 246.329 3.539 20 0 BHADMO C[N@@H+](CCCF)[C@H]1CCC[C@@H]1c1ccccc1 ZINC000459680954 203335199 /nfs/dbraw/zinc/33/51/99/203335199.db2.gz WTIDCMBEPDSAJN-CABCVRRESA-N 1 1 235.346 3.614 20 0 BHADMO C[N@@H+](CCCF)[C@H]1CCC[C@H]1c1ccccc1 ZINC000459680956 203334999 /nfs/dbraw/zinc/33/49/99/203334999.db2.gz WTIDCMBEPDSAJN-GJZGRUSLSA-N 1 1 235.346 3.614 20 0 BHADMO C[N@@H+](CCCF)[C@@H]1CCC[C@@H]1c1ccccc1 ZINC000459680957 203335760 /nfs/dbraw/zinc/33/57/60/203335760.db2.gz WTIDCMBEPDSAJN-HUUCEWRRSA-N 1 1 235.346 3.614 20 0 BHADMO C[N@@H+](CCCF)[C@@H]1CCC[C@H]1c1ccccc1 ZINC000459680958 203334921 /nfs/dbraw/zinc/33/49/21/203334921.db2.gz WTIDCMBEPDSAJN-LSDHHAIUSA-N 1 1 235.346 3.614 20 0 BHADMO C[N@@H+](Cc1ccc(Cl)o1)C1CC(C)(C)C1 ZINC000459727059 203343363 /nfs/dbraw/zinc/34/33/63/203343363.db2.gz HCGWEKMUXBRAEI-UHFFFAOYSA-N 1 1 227.735 3.553 20 0 BHADMO CC(C)C[C@@H](C)[N@H+]1Cc2cccc(F)c2C1 ZINC000459727403 203341467 /nfs/dbraw/zinc/34/14/67/203341467.db2.gz DYJIUEDUVIRXSW-LLVKDONJSA-N 1 1 221.319 3.576 20 0 BHADMO CC(C)C[C@H](C)[N@H+]1Cc2cccc(F)c2C1 ZINC000459727404 203342507 /nfs/dbraw/zinc/34/25/07/203342507.db2.gz DYJIUEDUVIRXSW-NSHDSACASA-N 1 1 221.319 3.576 20 0 BHADMO C[N@@H+](Cc1cccc2cc[nH]c21)C1CC(C)(C)C1 ZINC000459728510 203345422 /nfs/dbraw/zinc/34/54/22/203345422.db2.gz IEBCBCJTTFLYPA-UHFFFAOYSA-N 1 1 242.366 3.788 20 0 BHADMO C[N@@H+](Cc1cccc2[nH]ccc21)C1CC(C)(C)C1 ZINC000459740280 203348784 /nfs/dbraw/zinc/34/87/84/203348784.db2.gz UBCAQUSRAJZGJY-UHFFFAOYSA-N 1 1 242.366 3.788 20 0 BHADMO C[N@@H+](CCCCOC(C)(C)C)C1CC(C)(C)C1 ZINC000459743442 203352337 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/nfs/dbraw/zinc/35/57/21/203355721.db2.gz NXQSKNJDXVFPDH-UHFFFAOYSA-N 1 1 231.314 3.642 20 0 BHADMO Clc1ccc2c(c1)C[N@@H+]([C@H]1C=CCCC1)C2 ZINC000459756736 203359198 /nfs/dbraw/zinc/35/91/98/203359198.db2.gz GXRWTLGTHVAPTA-AWEZNQCLSA-N 1 1 233.742 3.764 20 0 BHADMO Clc1ccc2c(c1)C[N@@H+]([C@@H]1C=CCCC1)C2 ZINC000459756738 203358852 /nfs/dbraw/zinc/35/88/52/203358852.db2.gz GXRWTLGTHVAPTA-CQSZACIVSA-N 1 1 233.742 3.764 20 0 BHADMO CC(=O)c1cccc(C[N@H+](C)C2CC(C)(C)C2)c1 ZINC000459773998 527353170 /nfs/dbraw/zinc/35/31/70/527353170.db2.gz VEMPGPIOMUISIN-UHFFFAOYSA-N 1 1 245.366 3.510 20 0 BHADMO FCCCCC[N@H+]1Cc2ccc(Cl)cc2C1 ZINC000459775806 203364849 /nfs/dbraw/zinc/36/48/49/203364849.db2.gz XRJFFPBMMMKVDD-UHFFFAOYSA-N 1 1 241.737 3.795 20 0 BHADMO FCCCCC[N@@H+]1Cc2ccc(Cl)cc2C1 ZINC000459775806 203364845 /nfs/dbraw/zinc/36/48/45/203364845.db2.gz XRJFFPBMMMKVDD-UHFFFAOYSA-N 1 1 241.737 3.795 20 0 BHADMO Cc1ccc2c(C)cc(N3CC[C@@H](C)C3)[nH+]c2c1 ZINC000460937125 387940467 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528585214 /nfs/dbraw/zinc/58/52/14/528585214.db2.gz WJCGSIMXAIUSPT-HUUCEWRRSA-N 1 1 249.398 3.537 20 0 BHADMO CC[N@@H+](CC[C@H](C)c1ccccc1)C[C@@H](C)OC ZINC000462827339 388273082 /nfs/dbraw/zinc/27/30/82/388273082.db2.gz WJCGSIMXAIUSPT-LSDHHAIUSA-N 1 1 249.398 3.537 20 0 BHADMO CC[N@@H+](CCCc1ccc(C)nc1)CC(C)(C)C ZINC000462827342 388272751 /nfs/dbraw/zinc/27/27/51/388272751.db2.gz WMZVEFVLZKHDSH-UHFFFAOYSA-N 1 1 248.414 3.691 20 0 BHADMO CC[N@@H+](Cc1sccc1C)CC(C)(C)C ZINC000462827855 388272614 /nfs/dbraw/zinc/27/26/14/388272614.db2.gz RBKCHEXHMSFMKQ-UHFFFAOYSA-N 1 1 225.401 3.925 20 0 BHADMO CC[N@@H+](CC(C)(C)C)CC1(SC)CCC1 ZINC000462828016 388273019 /nfs/dbraw/zinc/27/30/19/388273019.db2.gz XVSPYPUSADKIRN-UHFFFAOYSA-N 1 1 229.433 3.640 20 0 BHADMO CC[N@@H+](Cc1sccc1OC)CC(C)(C)C ZINC000462828136 388272599 /nfs/dbraw/zinc/27/25/99/388272599.db2.gz TWHFRITVAYMHHE-UHFFFAOYSA-N 1 1 241.400 3.625 20 0 BHADMO CC(C)CC[N@H+]1CCn2c(cc3ccccc32)C1 ZINC000462828451 388272991 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CC[N@@H+](CCC1CC1)C[C@@H]1C[C@H]1c1ccccc1 ZINC000463124851 528425398 /nfs/dbraw/zinc/42/53/98/528425398.db2.gz OQARYWQBXJZHDC-IRXDYDNUSA-N 1 1 243.394 3.912 20 0 BHADMO C[C@@H]1CC[N@H+]([C@@H]2C[C@H]2c2ccccc2)C[C@@H]1C ZINC000463145626 388086773 /nfs/dbraw/zinc/08/67/73/388086773.db2.gz MSKNQVRAASFMKL-BFJAYTPKSA-N 1 1 229.367 3.520 20 0 BHADMO C[C@@H]1CC[N@H+]([C@@H]2C[C@H]2c2ccccc2)C[C@H]1C ZINC000463145627 388087728 /nfs/dbraw/zinc/08/77/28/388087728.db2.gz MSKNQVRAASFMKL-LUYZLQTOSA-N 1 1 229.367 3.520 20 0 BHADMO C[C@@H]1CC[N@H+]([C@@H]2C[C@@H]2c2ccccc2)C[C@@H]1C ZINC000463145628 534054761 /nfs/dbraw/zinc/05/47/61/534054761.db2.gz MSKNQVRAASFMKL-OCVGTWLNSA-N 1 1 229.367 3.520 20 0 BHADMO C[C@@H]1CC[N@H+]([C@@H]2C[C@@H]2c2ccccc2)C[C@H]1C ZINC000463145629 388087738 /nfs/dbraw/zinc/08/77/38/388087738.db2.gz MSKNQVRAASFMKL-RRCSTGOVSA-N 1 1 229.367 3.520 20 0 BHADMO C[C@H](C1CCC1)[N@@H+](C)C[C@@H]1C[C@H]1c1ccccc1 ZINC000463148570 388086767 /nfs/dbraw/zinc/08/67/67/388086767.db2.gz CKLGIMDINWVFCK-COXVUDFISA-N 1 1 243.394 3.911 20 0 BHADMO C[C@@H](C1CCC1)[N@@H+](C)C[C@@H]1C[C@H]1c1ccccc1 ZINC000463148572 388087177 /nfs/dbraw/zinc/08/71/77/388087177.db2.gz CKLGIMDINWVFCK-JQFCIGGWSA-N 1 1 243.394 3.911 20 0 BHADMO CC1=C[C@@H](C)C[N@@H+](C[C@@H]2C[C@H]2c2ccccc2)C1 ZINC000463197173 388088594 /nfs/dbraw/zinc/08/85/94/388088594.db2.gz PNCFYCFYKHFCFV-COXVUDFISA-N 1 1 241.378 3.688 20 0 BHADMO CC[N@@H+](C[C@@H]1C[C@H]1c1ccccc1)CC1CCC1 ZINC000463197460 388088846 /nfs/dbraw/zinc/08/88/46/388088846.db2.gz AWXMUJNBHOAOSM-IRXDYDNUSA-N 1 1 243.394 3.912 20 0 BHADMO C[C@@H]1CCCC[N@H+]([C@H]2C[C@@H]2c2ccccc2)C1 ZINC000463200659 388088146 /nfs/dbraw/zinc/08/81/46/388088146.db2.gz GUUAFAJHSYVNLL-BMFZPTHFSA-N 1 1 229.367 3.665 20 0 BHADMO C[C@@H]1CCCC[N@H+]([C@@H]2C[C@@H]2c2ccccc2)C1 ZINC000463200660 534155201 /nfs/dbraw/zinc/15/52/01/534155201.db2.gz GUUAFAJHSYVNLL-FVQBIDKESA-N 1 1 229.367 3.665 20 0 BHADMO C[C@@H]1CCCC[N@H+]([C@H]2C[C@H]2c2ccccc2)C1 ZINC000463200661 388088432 /nfs/dbraw/zinc/08/84/32/388088432.db2.gz GUUAFAJHSYVNLL-KBMXLJTQSA-N 1 1 229.367 3.665 20 0 BHADMO C[C@@H]1CCCC[N@H+]([C@@H]2C[C@H]2c2ccccc2)C1 ZINC000463200662 388088524 /nfs/dbraw/zinc/08/85/24/388088524.db2.gz GUUAFAJHSYVNLL-VNQPRFMTSA-N 1 1 229.367 3.665 20 0 BHADMO c1ccc([C@@H]2C[C@@H]2[N@H+]2CCC[C@@H](C3CC3)C2)cc1 ZINC000463210479 388088519 /nfs/dbraw/zinc/08/85/19/388088519.db2.gz DCVQIJSDERLFSZ-IKGGRYGDSA-N 1 1 241.378 3.665 20 0 BHADMO c1ccc([C@@H]2C[C@H]2[N@H+]2CCC[C@@H](C3CC3)C2)cc1 ZINC000463210481 388089230 /nfs/dbraw/zinc/08/92/30/388089230.db2.gz DCVQIJSDERLFSZ-IXDOHACOSA-N 1 1 241.378 3.665 20 0 BHADMO c1ccc([C@@H]2C[C@@H]2[N@H+]2CCC[C@H](C3CC3)C2)cc1 ZINC000463210483 388088667 /nfs/dbraw/zinc/08/86/67/388088667.db2.gz DCVQIJSDERLFSZ-ULQDDVLXSA-N 1 1 241.378 3.665 20 0 BHADMO c1ccc([C@@H]2C[C@H]2[N@H+]2CCC[C@H](C3CC3)C2)cc1 ZINC000463210486 388088363 /nfs/dbraw/zinc/08/83/63/388088363.db2.gz DCVQIJSDERLFSZ-YESZJQIVSA-N 1 1 241.378 3.665 20 0 BHADMO CC1=C(C)C[N@H+]([C@H]2C[C@@H]2c2ccccc2)CC1 ZINC000463211898 388088493 /nfs/dbraw/zinc/08/84/93/388088493.db2.gz HHYQKMMZVTYQKF-CVEARBPZSA-N 1 1 227.351 3.585 20 0 BHADMO CC1=C(C)C[N@H+]([C@H]2C[C@H]2c2ccccc2)CC1 ZINC000463211899 388088926 /nfs/dbraw/zinc/08/89/26/388088926.db2.gz HHYQKMMZVTYQKF-HOTGVXAUSA-N 1 1 227.351 3.585 20 0 BHADMO CC1=C(C)C[N@H+]([C@@H]2C[C@@H]2c2ccccc2)CC1 ZINC000463211900 388089084 /nfs/dbraw/zinc/08/90/84/388089084.db2.gz HHYQKMMZVTYQKF-HZPDHXFCSA-N 1 1 227.351 3.585 20 0 BHADMO CC1=C(C)C[N@H+]([C@@H]2C[C@H]2c2ccccc2)CC1 ZINC000463211901 388088379 /nfs/dbraw/zinc/08/83/79/388088379.db2.gz HHYQKMMZVTYQKF-JKSUJKDBSA-N 1 1 227.351 3.585 20 0 BHADMO CC1=C(C)C[N@@H+](C[C@@H]2C[C@H]2c2ccccc2)CC1 ZINC000463214514 388089167 /nfs/dbraw/zinc/08/91/67/388089167.db2.gz LJPGNODSXMJURN-IRXDYDNUSA-N 1 1 241.378 3.832 20 0 BHADMO C[C@H]1CC[C@H]([N@@H+](C)C[C@@H]2C[C@H]2c2ccccc2)C1 ZINC000463216307 388089832 /nfs/dbraw/zinc/08/98/32/388089832.db2.gz UICNTPMJMPIUAD-HJWJTTGWSA-N 1 1 243.394 3.911 20 0 BHADMO C[C@H]1CC[C@@H]([N@@H+](C)C[C@@H]2C[C@H]2c2ccccc2)C1 ZINC000463216308 388090262 /nfs/dbraw/zinc/09/02/62/388090262.db2.gz UICNTPMJMPIUAD-LLLHUVSDSA-N 1 1 243.394 3.911 20 0 BHADMO C[C@@H]1CC[C@@H]([N@@H+](C)C[C@@H]2C[C@H]2c2ccccc2)C1 ZINC000463216309 388089620 /nfs/dbraw/zinc/08/96/20/388089620.db2.gz UICNTPMJMPIUAD-XBVQOTNRSA-N 1 1 243.394 3.911 20 0 BHADMO CC[C@H](C)C[N@@H+](CC)CCCC1CCOCC1 ZINC000463285562 324150926 /nfs/dbraw/zinc/15/09/26/324150926.db2.gz GEOLOWDKUGQMNM-AWEZNQCLSA-N 1 1 241.419 3.561 20 0 BHADMO CC[C@@H](C)C[N@@H+](CC)CCCC1CCOCC1 ZINC000463285563 324150944 /nfs/dbraw/zinc/15/09/44/324150944.db2.gz GEOLOWDKUGQMNM-CQSZACIVSA-N 1 1 241.419 3.561 20 0 BHADMO CC[N@@H+](CCCC1CCOCC1)[C@@H](C)C(C)C ZINC000463286240 398013233 /nfs/dbraw/zinc/01/32/33/398013233.db2.gz ZZPFDFGTUGPXPE-AWEZNQCLSA-N 1 1 241.419 3.560 20 0 BHADMO CC[N@@H+](CCCC1CCOCC1)[C@H](C)C(C)C ZINC000463286241 398012515 /nfs/dbraw/zinc/01/25/15/398012515.db2.gz ZZPFDFGTUGPXPE-CQSZACIVSA-N 1 1 241.419 3.560 20 0 BHADMO CC[N@@H+](C[C@H](OC)c1ccccc1)CC(C)(C)C ZINC000463358046 388090969 /nfs/dbraw/zinc/09/09/69/388090969.db2.gz CRBSZMPMUQYOBV-HNNXBMFYSA-N 1 1 249.398 3.742 20 0 BHADMO CC[N@@H+](C[C@@H](OC)c1ccccc1)CC(C)(C)C ZINC000463358047 388091080 /nfs/dbraw/zinc/09/10/80/388091080.db2.gz CRBSZMPMUQYOBV-OAHLLOKOSA-N 1 1 249.398 3.742 20 0 BHADMO CC[N@@H+](C[C@@H]1Cc2ccccc21)CC(C)(C)C ZINC000463358267 388091302 /nfs/dbraw/zinc/09/13/02/388091302.db2.gz LTLLWXDPSWVZKQ-AWEZNQCLSA-N 1 1 231.383 3.694 20 0 BHADMO CC[N@@H+](C[C@H]1Cc2ccccc21)CC(C)(C)C ZINC000463358268 388090976 /nfs/dbraw/zinc/09/09/76/388090976.db2.gz LTLLWXDPSWVZKQ-CQSZACIVSA-N 1 1 231.383 3.694 20 0 BHADMO CC[N@@H+](CCCCOC(C)(C)C)CC(C)(C)C ZINC000463367499 259506022 /nfs/dbraw/zinc/50/60/22/259506022.db2.gz GTZCZGLTERKXJX-UHFFFAOYSA-N 1 1 243.435 3.950 20 0 BHADMO CC[N@@H+](Cc1nc2ccccc2o1)CC(C)(C)C ZINC000463373432 388090988 /nfs/dbraw/zinc/09/09/88/388090988.db2.gz WLWKAAHNJRKWTD-UHFFFAOYSA-N 1 1 246.354 3.696 20 0 BHADMO CCC[C@@H](C)[N@H+]1CCn2c(cc3ccccc32)C1 ZINC000463423616 388090889 /nfs/dbraw/zinc/09/08/89/388090889.db2.gz HPWSERHDLLISHS-CYBMUJFWSA-N 1 1 242.366 3.646 20 0 BHADMO CCC[C@@H](C)[N@@H+]1CCn2c(cc3ccccc32)C1 ZINC000463423616 388090888 /nfs/dbraw/zinc/09/08/88/388090888.db2.gz HPWSERHDLLISHS-CYBMUJFWSA-N 1 1 242.366 3.646 20 0 BHADMO CCC[C@H](C)[N@H+]1CCn2c(cc3ccccc32)C1 ZINC000463423617 388091007 /nfs/dbraw/zinc/09/10/07/388091007.db2.gz HPWSERHDLLISHS-ZDUSSCGKSA-N 1 1 242.366 3.646 20 0 BHADMO CCC[C@H](C)[N@@H+]1CCn2c(cc3ccccc32)C1 ZINC000463423617 388091004 /nfs/dbraw/zinc/09/10/04/388091004.db2.gz HPWSERHDLLISHS-ZDUSSCGKSA-N 1 1 242.366 3.646 20 0 BHADMO C[N@@H+](CCC1CC1)[C@H]1CCCC[C@H]1C(F)(F)F ZINC000463436856 388090850 /nfs/dbraw/zinc/09/08/50/388090850.db2.gz CDMSZKCACQAKCK-NEPJUHHUSA-N 1 1 249.320 3.839 20 0 BHADMO CCCC[N@@H+](C)[C@H]1CCCC[C@H]1C(F)(F)F ZINC000463441342 388091240 /nfs/dbraw/zinc/09/12/40/388091240.db2.gz IQQMONXKUQGXOC-MNOVXSKESA-N 1 1 237.309 3.839 20 0 BHADMO C[N@@H+](CC1CCC1)[C@H]1CCCC[C@H]1C(F)(F)F ZINC000463444573 529863286 /nfs/dbraw/zinc/86/32/86/529863286.db2.gz NOSIDOWWBAKQIU-NEPJUHHUSA-N 1 1 249.320 3.839 20 0 BHADMO CCC[N@@H+](CCc1cccs1)CC1CCC1 ZINC000464577958 388101565 /nfs/dbraw/zinc/10/15/65/388101565.db2.gz WGTUAYLQQZQXBR-UHFFFAOYSA-N 1 1 237.412 3.803 20 0 BHADMO CC[N@@H+](CCCc1ccccc1C)CC1CC1 ZINC000464586720 388101136 /nfs/dbraw/zinc/10/11/36/388101136.db2.gz KQSZJNVIYJYCLD-UHFFFAOYSA-N 1 1 231.383 3.660 20 0 BHADMO CCC[N@H+](CCc1cccs1)CCC1CC1 ZINC000464593294 388100906 /nfs/dbraw/zinc/10/09/06/388100906.db2.gz MFKLQKVMSNJQHA-UHFFFAOYSA-N 1 1 237.412 3.803 20 0 BHADMO CC[N@H+]1Cc2ccccc2C[C@H]1c1ccccc1 ZINC000464724765 388101825 /nfs/dbraw/zinc/10/18/25/388101825.db2.gz JKZXYEHAWSTNID-KRWDZBQOSA-N 1 1 237.346 3.806 20 0 BHADMO CC[N@H+]1Cc2ccccc2C[C@@H]1c1ccccc1 ZINC000464724766 388102158 /nfs/dbraw/zinc/10/21/58/388102158.db2.gz JKZXYEHAWSTNID-QGZVFWFLSA-N 1 1 237.346 3.806 20 0 BHADMO CCC[C@H]1[C@H](C)CCC[N@H+]1CCCCCOC ZINC000464732065 388102379 /nfs/dbraw/zinc/10/23/79/388102379.db2.gz GGTZGRUCQPBTBZ-CABCVRRESA-N 1 1 241.419 3.704 20 0 BHADMO CCC[C@H]1[C@@H](C)CCC[N@H+]1CCCCCOC ZINC000464732067 388102398 /nfs/dbraw/zinc/10/23/98/388102398.db2.gz GGTZGRUCQPBTBZ-GJZGRUSLSA-N 1 1 241.419 3.704 20 0 BHADMO CCC[C@@H]1[C@H](C)CCC[N@H+]1CCCCCOC ZINC000464732068 388102320 /nfs/dbraw/zinc/10/23/20/388102320.db2.gz GGTZGRUCQPBTBZ-HUUCEWRRSA-N 1 1 241.419 3.704 20 0 BHADMO CCC[C@@H]1[C@@H](C)CCC[N@H+]1CCCCCOC ZINC000464732070 388101845 /nfs/dbraw/zinc/10/18/45/388101845.db2.gz GGTZGRUCQPBTBZ-LSDHHAIUSA-N 1 1 241.419 3.704 20 0 BHADMO CCC[N@H+]1C[C@H](C)C[C@@H]1c1ccccc1F ZINC000464734941 388101803 /nfs/dbraw/zinc/10/18/03/388101803.db2.gz KVFMIAOUULVTKI-BXUZGUMPSA-N 1 1 221.319 3.619 20 0 BHADMO CCC[N@H+]1C[C@@H](C)C[C@H]1c1ccccc1F ZINC000464734942 388102632 /nfs/dbraw/zinc/10/26/32/388102632.db2.gz KVFMIAOUULVTKI-FZMZJTMJSA-N 1 1 221.319 3.619 20 0 BHADMO CCC[N@H+]1C[C@H](C)C[C@H]1c1ccccc1F ZINC000464734943 388102103 /nfs/dbraw/zinc/10/21/03/388102103.db2.gz KVFMIAOUULVTKI-RISCZKNCSA-N 1 1 221.319 3.619 20 0 BHADMO CCC[N@H+]1C[C@@H](C)C[C@@H]1c1ccccc1F ZINC000464734944 388102365 /nfs/dbraw/zinc/10/23/65/388102365.db2.gz KVFMIAOUULVTKI-SMDDNHRTSA-N 1 1 221.319 3.619 20 0 BHADMO CCC[C@@H]1[C@H](C)CCC[N@H+]1CCCSC ZINC000464741231 388102309 /nfs/dbraw/zinc/10/23/09/388102309.db2.gz RPJANFCXTDOTAD-CHWSQXEVSA-N 1 1 229.433 3.640 20 0 BHADMO CCC[C@H]1[C@H](C)CCC[N@H+]1CCCSC ZINC000464741232 388101820 /nfs/dbraw/zinc/10/18/20/388101820.db2.gz RPJANFCXTDOTAD-OLZOCXBDSA-N 1 1 229.433 3.640 20 0 BHADMO CCC[C@@H]1[C@@H](C)CCC[N@H+]1CCCSC ZINC000464741233 388101877 /nfs/dbraw/zinc/10/18/77/388101877.db2.gz RPJANFCXTDOTAD-QWHCGFSZSA-N 1 1 229.433 3.640 20 0 BHADMO CCC[C@H]1[C@@H](C)CCC[N@H+]1CCCSC ZINC000464741234 388102127 /nfs/dbraw/zinc/10/21/27/388102127.db2.gz RPJANFCXTDOTAD-STQMWFEESA-N 1 1 229.433 3.640 20 0 BHADMO CCC[C@H]1[C@H](C)CCC[N@H+]1CCCOC(C)C ZINC000464743620 388102299 /nfs/dbraw/zinc/10/22/99/388102299.db2.gz ZROZGUNHKLZLGW-CABCVRRESA-N 1 1 241.419 3.702 20 0 BHADMO CCC[C@H]1[C@@H](C)CCC[N@H+]1CCCOC(C)C ZINC000464743621 388102020 /nfs/dbraw/zinc/10/20/20/388102020.db2.gz ZROZGUNHKLZLGW-GJZGRUSLSA-N 1 1 241.419 3.702 20 0 BHADMO CCC[C@@H]1[C@H](C)CCC[N@H+]1CCCOC(C)C ZINC000464743622 388101795 /nfs/dbraw/zinc/10/17/95/388101795.db2.gz ZROZGUNHKLZLGW-HUUCEWRRSA-N 1 1 241.419 3.702 20 0 BHADMO CCC[C@@H]1[C@@H](C)CCC[N@H+]1CCCOC(C)C ZINC000464743623 388101951 /nfs/dbraw/zinc/10/19/51/388101951.db2.gz ZROZGUNHKLZLGW-LSDHHAIUSA-N 1 1 241.419 3.702 20 0 BHADMO C[N@H+](CCc1cccs1)CCC1CCCC1 ZINC000464759886 388103759 /nfs/dbraw/zinc/10/37/59/388103759.db2.gz ABJDCOUOGNRNMB-UHFFFAOYSA-N 1 1 237.412 3.803 20 0 BHADMO CCCC[N@H+]1CC[C@H](CSc2ccccc2)C1 ZINC000464763840 388103985 /nfs/dbraw/zinc/10/39/85/388103985.db2.gz SEFRDECNPFXMLE-AWEZNQCLSA-N 1 1 249.423 3.901 20 0 BHADMO CCCC[N@H+]1CC[C@@H](CSc2ccccc2)C1 ZINC000464763841 388104019 /nfs/dbraw/zinc/10/40/19/388104019.db2.gz SEFRDECNPFXMLE-CQSZACIVSA-N 1 1 249.423 3.901 20 0 BHADMO CC(C)[N@H+]1CCCC2(C1)CCCCCC2 ZINC000464767365 388103714 /nfs/dbraw/zinc/10/37/14/388103714.db2.gz WJDICSSBVUYSRS-UHFFFAOYSA-N 1 1 209.377 3.831 20 0 BHADMO CCCCC[N@@H+](C)[C@@H]1CC[C@@H](SCC)C1 ZINC000464767978 388102950 /nfs/dbraw/zinc/10/29/50/388102950.db2.gz GCBMJRJMYKUXGH-CHWSQXEVSA-N 1 1 229.433 3.783 20 0 BHADMO CCCCC[N@@H+](C)[C@@H]1CC[C@H](SCC)C1 ZINC000464768479 388102971 /nfs/dbraw/zinc/10/29/71/388102971.db2.gz GCBMJRJMYKUXGH-OLZOCXBDSA-N 1 1 229.433 3.783 20 0 BHADMO CCCCC[N@@H+](C)[C@H]1CC[C@@H](SCC)C1 ZINC000464768480 388102930 /nfs/dbraw/zinc/10/29/30/388102930.db2.gz GCBMJRJMYKUXGH-QWHCGFSZSA-N 1 1 229.433 3.783 20 0 BHADMO CCCCC[N@@H+](C)[C@H]1CC[C@H](SCC)C1 ZINC000464768481 388102947 /nfs/dbraw/zinc/10/29/47/388102947.db2.gz GCBMJRJMYKUXGH-STQMWFEESA-N 1 1 229.433 3.783 20 0 BHADMO Cc1ccc(C[N@H+]2CCS[C@H](C(C)C)C2)cc1 ZINC000464768482 388101931 /nfs/dbraw/zinc/10/19/31/388101931.db2.gz GCTCSAVEJWQXHR-HNNXBMFYSA-N 1 1 249.423 3.568 20 0 BHADMO Cc1ccc(C[N@H+]2CCS[C@@H](C(C)C)C2)cc1 ZINC000464768483 388102674 /nfs/dbraw/zinc/10/26/74/388102674.db2.gz GCTCSAVEJWQXHR-OAHLLOKOSA-N 1 1 249.423 3.568 20 0 BHADMO CCC[N@H+]1CCCC2(C1)CCCCCC2 ZINC000464768699 388102968 /nfs/dbraw/zinc/10/29/68/388102968.db2.gz YTZYIIVLXJRXLC-UHFFFAOYSA-N 1 1 209.377 3.833 20 0 BHADMO CC[C@@]1(C)CCC[N@@H+](Cc2ccccc2F)C1 ZINC000464769006 388103463 /nfs/dbraw/zinc/10/34/63/388103463.db2.gz BHJJIUJFEABKPQ-HNNXBMFYSA-N 1 1 235.346 3.838 20 0 BHADMO CC[C@]1(C)CCC[N@@H+](Cc2ccccc2F)C1 ZINC000464769007 388103945 /nfs/dbraw/zinc/10/39/45/388103945.db2.gz BHJJIUJFEABKPQ-OAHLLOKOSA-N 1 1 235.346 3.838 20 0 BHADMO CC[C@@]1(C)CCC[N@@H+](CC2CCCC2)C1 ZINC000464770316 323075715 /nfs/dbraw/zinc/07/57/15/323075715.db2.gz FGELHXUKFLOZBP-AWEZNQCLSA-N 1 1 209.377 3.689 20 0 BHADMO CC[C@]1(C)CCC[N@@H+](CC2CCCC2)C1 ZINC000464770317 323075660 /nfs/dbraw/zinc/07/56/60/323075660.db2.gz FGELHXUKFLOZBP-CQSZACIVSA-N 1 1 209.377 3.689 20 0 BHADMO CC[C@@]1(C)CCC[N@@H+](CCOc2ccccc2)C1 ZINC000464772567 388103328 /nfs/dbraw/zinc/10/33/28/388103328.db2.gz HNJIYZBHRWSJQQ-INIZCTEOSA-N 1 1 247.382 3.578 20 0 BHADMO CC[C@]1(C)CCC[N@@H+](CCOc2ccccc2)C1 ZINC000464772568 388103681 /nfs/dbraw/zinc/10/36/81/388103681.db2.gz HNJIYZBHRWSJQQ-MRXNPFEDSA-N 1 1 247.382 3.578 20 0 BHADMO CC(C)[C@@H]1C[N@@H+](CC2CCCCC2)CCS1 ZINC000464772777 388102977 /nfs/dbraw/zinc/10/29/77/388102977.db2.gz MJVWUTJCXBWDHM-AWEZNQCLSA-N 1 1 241.444 3.640 20 0 BHADMO CC(C)[C@H]1C[N@@H+](CC2CCCCC2)CCS1 ZINC000464772778 388103059 /nfs/dbraw/zinc/10/30/59/388103059.db2.gz MJVWUTJCXBWDHM-CQSZACIVSA-N 1 1 241.444 3.640 20 0 BHADMO CC[C@@]1(C)CCC[N@@H+](Cc2ccccc2)C1 ZINC000464773623 388103173 /nfs/dbraw/zinc/10/31/73/388103173.db2.gz JIPPQQZXFXIELU-HNNXBMFYSA-N 1 1 217.356 3.699 20 0 BHADMO CC[C@]1(C)CCC[N@@H+](Cc2ccccc2)C1 ZINC000464773624 388103009 /nfs/dbraw/zinc/10/30/09/388103009.db2.gz JIPPQQZXFXIELU-OAHLLOKOSA-N 1 1 217.356 3.699 20 0 BHADMO Cc1ccccc1C[N@H+]1CCS[C@H](C(C)C)C1 ZINC000464774701 388103039 /nfs/dbraw/zinc/10/30/39/388103039.db2.gz PYBUNZDMNZJYCQ-HNNXBMFYSA-N 1 1 249.423 3.568 20 0 BHADMO Cc1ccccc1C[N@H+]1CCS[C@@H](C(C)C)C1 ZINC000464774702 388103632 /nfs/dbraw/zinc/10/36/32/388103632.db2.gz PYBUNZDMNZJYCQ-OAHLLOKOSA-N 1 1 249.423 3.568 20 0 BHADMO CC(C)[C@@H]1C[N@@H+](CCC2CCCC2)CCS1 ZINC000464775881 388103484 /nfs/dbraw/zinc/10/34/84/388103484.db2.gz SEYLINPNCUFERS-AWEZNQCLSA-N 1 1 241.444 3.640 20 0 BHADMO CC(C)[C@H]1C[N@@H+](CCC2CCCC2)CCS1 ZINC000464775883 527855354 /nfs/dbraw/zinc/85/53/54/527855354.db2.gz SEYLINPNCUFERS-CQSZACIVSA-N 1 1 241.444 3.640 20 0 BHADMO CC[C@@]1(C)CCC[N@@H+](Cc2ccc(F)cc2)C1 ZINC000464779991 388103118 /nfs/dbraw/zinc/10/31/18/388103118.db2.gz SOIFOKSZRMPBHR-HNNXBMFYSA-N 1 1 235.346 3.838 20 0 BHADMO CC[C@]1(C)CCC[N@@H+](Cc2ccc(F)cc2)C1 ZINC000464779992 388103253 /nfs/dbraw/zinc/10/32/53/388103253.db2.gz SOIFOKSZRMPBHR-OAHLLOKOSA-N 1 1 235.346 3.838 20 0 BHADMO CC[C@@]1(C)CCC[N@@H+](Cc2cccc(F)c2)C1 ZINC000464780005 388103196 /nfs/dbraw/zinc/10/31/96/388103196.db2.gz SRODQFFQWINTCK-HNNXBMFYSA-N 1 1 235.346 3.838 20 0 BHADMO CC[C@]1(C)CCC[N@@H+](Cc2cccc(F)c2)C1 ZINC000464780006 388103780 /nfs/dbraw/zinc/10/37/80/388103780.db2.gz SRODQFFQWINTCK-OAHLLOKOSA-N 1 1 235.346 3.838 20 0 BHADMO CCS[C@@H]1CC[C@@H]([N@@H+](C)CCC(C)C)C1 ZINC000464780156 388103919 /nfs/dbraw/zinc/10/39/19/388103919.db2.gz XRYLTUZOGCCVET-CHWSQXEVSA-N 1 1 229.433 3.639 20 0 BHADMO CCS[C@H]1CC[C@@H]([N@@H+](C)CCC(C)C)C1 ZINC000464780157 388103272 /nfs/dbraw/zinc/10/32/72/388103272.db2.gz XRYLTUZOGCCVET-OLZOCXBDSA-N 1 1 229.433 3.639 20 0 BHADMO CCS[C@@H]1CC[C@H]([N@@H+](C)CCC(C)C)C1 ZINC000464780158 388103654 /nfs/dbraw/zinc/10/36/54/388103654.db2.gz XRYLTUZOGCCVET-QWHCGFSZSA-N 1 1 229.433 3.639 20 0 BHADMO CCS[C@H]1CC[C@H]([N@@H+](C)CCC(C)C)C1 ZINC000464780159 388103858 /nfs/dbraw/zinc/10/38/58/388103858.db2.gz XRYLTUZOGCCVET-STQMWFEESA-N 1 1 229.433 3.639 20 0 BHADMO Cc1cccc(C[N@H+]2CCS[C@H](C(C)C)C2)c1 ZINC000464781112 388103292 /nfs/dbraw/zinc/10/32/92/388103292.db2.gz ZNURQDHZZKMISN-HNNXBMFYSA-N 1 1 249.423 3.568 20 0 BHADMO Cc1cccc(C[N@H+]2CCS[C@@H](C(C)C)C2)c1 ZINC000464781113 388103702 /nfs/dbraw/zinc/10/37/02/388103702.db2.gz ZNURQDHZZKMISN-OAHLLOKOSA-N 1 1 249.423 3.568 20 0 BHADMO CC[C@@]1(C)CCC[N@H+]([C@H]2C=CCCC2)C1 ZINC000464782170 388102986 /nfs/dbraw/zinc/10/29/86/388102986.db2.gz VMFQVQXJZJRYQB-KBPBESRZSA-N 1 1 207.361 3.607 20 0 BHADMO CC[C@@]1(C)CCC[N@H+]([C@@H]2C=CCCC2)C1 ZINC000464782172 388103597 /nfs/dbraw/zinc/10/35/97/388103597.db2.gz VMFQVQXJZJRYQB-KGLIPLIRSA-N 1 1 207.361 3.607 20 0 BHADMO CC[C@]1(C)CCC[N@H+]([C@H]2C=CCCC2)C1 ZINC000464782173 388102943 /nfs/dbraw/zinc/10/29/43/388102943.db2.gz VMFQVQXJZJRYQB-UONOGXRCSA-N 1 1 207.361 3.607 20 0 BHADMO CC[C@]1(C)CCC[N@H+]([C@@H]2C=CCCC2)C1 ZINC000464782175 388102941 /nfs/dbraw/zinc/10/29/41/388102941.db2.gz VMFQVQXJZJRYQB-ZIAGYGMSSA-N 1 1 207.361 3.607 20 0 BHADMO CC[N@H+]1CCCC[C@H]1c1cccc(C)c1C ZINC000464782637 388103974 /nfs/dbraw/zinc/10/39/74/388103974.db2.gz YYCFVESCBYYJTO-HNNXBMFYSA-N 1 1 217.356 3.850 20 0 BHADMO CC[N@H+]1CCCC[C@@H]1c1cccc(C)c1C ZINC000464782638 388103032 /nfs/dbraw/zinc/10/30/32/388103032.db2.gz YYCFVESCBYYJTO-OAHLLOKOSA-N 1 1 217.356 3.850 20 0 BHADMO CC[C@H]1C[N@@H+](Cc2cc(C)ccc2C)CCS1 ZINC000464786086 388103893 /nfs/dbraw/zinc/10/38/93/388103893.db2.gz KIWBAVXQPGOEOO-HNNXBMFYSA-N 1 1 249.423 3.631 20 0 BHADMO CC[C@@H]1C[N@@H+](Cc2cc(C)ccc2C)CCS1 ZINC000464786087 388103414 /nfs/dbraw/zinc/10/34/14/388103414.db2.gz KIWBAVXQPGOEOO-OAHLLOKOSA-N 1 1 249.423 3.631 20 0 BHADMO CC[C@H]1C[N@@H+](Cc2cc(C)cc(C)c2)CCS1 ZINC000464786176 388103067 /nfs/dbraw/zinc/10/30/67/388103067.db2.gz VWVTZDIUUBPYOB-HNNXBMFYSA-N 1 1 249.423 3.631 20 0 BHADMO CC[C@@H]1C[N@@H+](Cc2cc(C)cc(C)c2)CCS1 ZINC000464786177 388103617 /nfs/dbraw/zinc/10/36/17/388103617.db2.gz VWVTZDIUUBPYOB-OAHLLOKOSA-N 1 1 249.423 3.631 20 0 BHADMO CC[C@H]1C[N@@H+](Cc2c(C)cccc2C)CCS1 ZINC000464787186 388103139 /nfs/dbraw/zinc/10/31/39/388103139.db2.gz YINZMHJQGYFWDE-AWEZNQCLSA-N 1 1 249.423 3.631 20 0 BHADMO CC[C@@H]1C[N@@H+](Cc2c(C)cccc2C)CCS1 ZINC000464787187 388104014 /nfs/dbraw/zinc/10/40/14/388104014.db2.gz YINZMHJQGYFWDE-CQSZACIVSA-N 1 1 249.423 3.631 20 0 BHADMO CC[C@@H](c1ccccc1)[N@H+]1CCS[C@H](CC)C1 ZINC000464787444 388103903 /nfs/dbraw/zinc/10/39/03/388103903.db2.gz ASQNFMDVKKTBPT-CABCVRRESA-N 1 1 249.423 3.965 20 0 BHADMO CC[C@@H](c1ccccc1)[N@H+]1CCS[C@@H](CC)C1 ZINC000464787445 388103003 /nfs/dbraw/zinc/10/30/03/388103003.db2.gz ASQNFMDVKKTBPT-GJZGRUSLSA-N 1 1 249.423 3.965 20 0 BHADMO CC[C@H](c1ccccc1)[N@H+]1CCS[C@H](CC)C1 ZINC000464787446 388102945 /nfs/dbraw/zinc/10/29/45/388102945.db2.gz ASQNFMDVKKTBPT-HUUCEWRRSA-N 1 1 249.423 3.965 20 0 BHADMO CC[C@H](c1ccccc1)[N@H+]1CCS[C@@H](CC)C1 ZINC000464787447 388103671 /nfs/dbraw/zinc/10/36/71/388103671.db2.gz ASQNFMDVKKTBPT-LSDHHAIUSA-N 1 1 249.423 3.965 20 0 BHADMO CCc1ccc(C[N@H+]2CCS[C@@H](CC)C2)cc1 ZINC000464787750 388102981 /nfs/dbraw/zinc/10/29/81/388102981.db2.gz FDSVPBVZPPJFIH-HNNXBMFYSA-N 1 1 249.423 3.576 20 0 BHADMO CCc1ccc(C[N@H+]2CCS[C@H](CC)C2)cc1 ZINC000464787751 388103818 /nfs/dbraw/zinc/10/38/18/388103818.db2.gz FDSVPBVZPPJFIH-OAHLLOKOSA-N 1 1 249.423 3.576 20 0 BHADMO CC[C@@H]1C[N@@H+](CCC(C)(C)CC)CCS1 ZINC000464787850 388103568 /nfs/dbraw/zinc/10/35/68/388103568.db2.gz FKYRGAROAFCZKX-GFCCVEGCSA-N 1 1 229.433 3.640 20 0 BHADMO CC[C@H]1C[N@@H+](CCC(C)(C)CC)CCS1 ZINC000464787851 529291243 /nfs/dbraw/zinc/29/12/43/529291243.db2.gz FKYRGAROAFCZKX-LBPRGKRZSA-N 1 1 229.433 3.640 20 0 BHADMO C[C@H](c1cccc(F)c1)[N@H+]1CCC(C)(C)C1 ZINC000464788994 388103881 /nfs/dbraw/zinc/10/38/81/388103881.db2.gz BOAFLPJNEAFMJB-LLVKDONJSA-N 1 1 221.319 3.619 20 0 BHADMO C[C@@H](c1cccc(F)c1)[N@H+]1CCC(C)(C)C1 ZINC000464788995 388103553 /nfs/dbraw/zinc/10/35/53/388103553.db2.gz BOAFLPJNEAFMJB-NSHDSACASA-N 1 1 221.319 3.619 20 0 BHADMO CC[C@@H]1C[N@H+]([C@@H](C)c2cccc(C)c2)CCS1 ZINC000464789546 388103357 /nfs/dbraw/zinc/10/33/57/388103357.db2.gz OSXDIBBCMXVWHX-DZGCQCFKSA-N 1 1 249.423 3.883 20 0 BHADMO CC[C@H]1C[N@H+]([C@H](C)c2cccc(C)c2)CCS1 ZINC000464789550 388103156 /nfs/dbraw/zinc/10/31/56/388103156.db2.gz OSXDIBBCMXVWHX-HIFRSBDPSA-N 1 1 249.423 3.883 20 0 BHADMO CC[C@@H]1C[N@H+]([C@H](C)c2cccc(C)c2)CCS1 ZINC000464789551 388103229 /nfs/dbraw/zinc/10/32/29/388103229.db2.gz OSXDIBBCMXVWHX-UKRRQHHQSA-N 1 1 249.423 3.883 20 0 BHADMO CC[C@H]1C[N@H+]([C@@H](C)c2cccc(C)c2)CCS1 ZINC000464789553 388103725 /nfs/dbraw/zinc/10/37/25/388103725.db2.gz OSXDIBBCMXVWHX-ZFWWWQNUSA-N 1 1 249.423 3.883 20 0 BHADMO Cc1ccc(C)c(C[N@H+]2CCC(C)(C)C2)c1 ZINC000464790062 388103026 /nfs/dbraw/zinc/10/30/26/388103026.db2.gz AVIPSLFYOMNUMI-UHFFFAOYSA-N 1 1 217.356 3.535 20 0 BHADMO CC[C@@H]1C[N@@H+](C[C@H](C)c2ccccc2)CCS1 ZINC000464790332 388103165 /nfs/dbraw/zinc/10/31/65/388103165.db2.gz QDRPSSLBCAFANF-DZGCQCFKSA-N 1 1 249.423 3.618 20 0 BHADMO CC[C@H]1C[N@@H+](C[C@@H](C)c2ccccc2)CCS1 ZINC000464790333 388103536 /nfs/dbraw/zinc/10/35/36/388103536.db2.gz QDRPSSLBCAFANF-HIFRSBDPSA-N 1 1 249.423 3.618 20 0 BHADMO CC[C@@H]1C[N@@H+](C[C@@H](C)c2ccccc2)CCS1 ZINC000464790334 388103865 /nfs/dbraw/zinc/10/38/65/388103865.db2.gz QDRPSSLBCAFANF-UKRRQHHQSA-N 1 1 249.423 3.618 20 0 BHADMO CC[C@H]1C[N@@H+](C[C@H](C)c2ccccc2)CCS1 ZINC000464790335 388103107 /nfs/dbraw/zinc/10/31/07/388103107.db2.gz QDRPSSLBCAFANF-ZFWWWQNUSA-N 1 1 249.423 3.618 20 0 BHADMO CCc1ccc(CC[N@H+]2CCC(C)(C)C2)cc1 ZINC000464791318 388103314 /nfs/dbraw/zinc/10/33/14/388103314.db2.gz DXUPUQIHANOWKL-UHFFFAOYSA-N 1 1 231.383 3.523 20 0 BHADMO C[C@H](c1ccccc1F)[N@H+]1CCC(C)(C)C1 ZINC000464792132 388105095 /nfs/dbraw/zinc/10/50/95/388105095.db2.gz IHXSQNIFIOGGNF-LLVKDONJSA-N 1 1 221.319 3.619 20 0 BHADMO CCC[N@@H+](C)[C@@H](Cc1ccc(F)cc1)C(C)C ZINC000464792612 388104254 /nfs/dbraw/zinc/10/42/54/388104254.db2.gz WWFGGNRJCXDIQR-HNNXBMFYSA-N 1 1 237.362 3.735 20 0 BHADMO CCC[N@@H+](C)[C@H](Cc1ccc(F)cc1)C(C)C ZINC000464792613 388104789 /nfs/dbraw/zinc/10/47/89/388104789.db2.gz WWFGGNRJCXDIQR-OAHLLOKOSA-N 1 1 237.362 3.735 20 0 BHADMO C[C@@H](c1ccccc1F)[N@H+]1CCC(C)(C)C1 ZINC000464792633 388104979 /nfs/dbraw/zinc/10/49/79/388104979.db2.gz IHXSQNIFIOGGNF-NSHDSACASA-N 1 1 221.319 3.619 20 0 BHADMO CC[C@@H](c1ccccc1)[N@H+]1CCC(C)(C)C1 ZINC000464793483 388104590 /nfs/dbraw/zinc/10/45/90/388104590.db2.gz KGIGWLKWNQVVRG-AWEZNQCLSA-N 1 1 217.356 3.870 20 0 BHADMO CC[C@H](c1ccccc1)[N@H+]1CCC(C)(C)C1 ZINC000464793485 388104922 /nfs/dbraw/zinc/10/49/22/388104922.db2.gz KGIGWLKWNQVVRG-CQSZACIVSA-N 1 1 217.356 3.870 20 0 BHADMO C[C@@H](c1ccc(F)c(F)c1)[N@H+]1CCC(C)(C)C1 ZINC000464794202 388105079 /nfs/dbraw/zinc/10/50/79/388105079.db2.gz MGHKAFRBIYRKMI-JTQLQIEISA-N 1 1 239.309 3.758 20 0 BHADMO C[C@H](c1ccc(F)c(F)c1)[N@H+]1CCC(C)(C)C1 ZINC000464794209 388104330 /nfs/dbraw/zinc/10/43/30/388104330.db2.gz MGHKAFRBIYRKMI-SNVBAGLBSA-N 1 1 239.309 3.758 20 0 BHADMO C[C@H](C[N@H+]1CCC(C)(C)C1)c1ccccc1 ZINC000464794690 388104759 /nfs/dbraw/zinc/10/47/59/388104759.db2.gz NJPDILIEFANADW-CYBMUJFWSA-N 1 1 217.356 3.522 20 0 BHADMO C[C@@H](C[N@H+]1CCC(C)(C)C1)c1ccccc1 ZINC000464794691 388104469 /nfs/dbraw/zinc/10/44/69/388104469.db2.gz NJPDILIEFANADW-ZDUSSCGKSA-N 1 1 217.356 3.522 20 0 BHADMO CC1(C)CC[N@@H+](Cc2ccc(F)cc2Cl)C1 ZINC000464794935 388104904 /nfs/dbraw/zinc/10/49/04/388104904.db2.gz OGBDYPMFMWFFKG-UHFFFAOYSA-N 1 1 241.737 3.711 20 0 BHADMO CC1(C)CC[N@@H+](CCCCOc2ccccc2)C1 ZINC000464795083 388104681 /nfs/dbraw/zinc/10/46/81/388104681.db2.gz OMZMHOBIJYNAHG-UHFFFAOYSA-N 1 1 247.382 3.578 20 0 BHADMO C[C@@H](CCc1ccccc1)[N@H+]1CCC(C)(C)C1 ZINC000464795470 388104688 /nfs/dbraw/zinc/10/46/88/388104688.db2.gz PUEIEGUNVWEDDC-AWEZNQCLSA-N 1 1 231.383 3.740 20 0 BHADMO C[C@H](CCc1ccccc1)[N@H+]1CCC(C)(C)C1 ZINC000464795471 388104948 /nfs/dbraw/zinc/10/49/48/388104948.db2.gz PUEIEGUNVWEDDC-CQSZACIVSA-N 1 1 231.383 3.740 20 0 BHADMO CC1(C)CC[N@@H+](Cc2c(F)cccc2Cl)C1 ZINC000464796227 388104965 /nfs/dbraw/zinc/10/49/65/388104965.db2.gz AHXZWRGGYFIDHP-UHFFFAOYSA-N 1 1 241.737 3.711 20 0 BHADMO C[C@@H](c1ccc(F)cc1F)[N@H+]1CCC(C)(C)C1 ZINC000464796474 388105119 /nfs/dbraw/zinc/10/51/19/388105119.db2.gz UJWSPMDXLHEODX-JTQLQIEISA-N 1 1 239.309 3.758 20 0 BHADMO C[C@H](c1ccc(F)cc1F)[N@H+]1CCC(C)(C)C1 ZINC000464796475 388104182 /nfs/dbraw/zinc/10/41/82/388104182.db2.gz UJWSPMDXLHEODX-SNVBAGLBSA-N 1 1 239.309 3.758 20 0 BHADMO CC1(C)CC[N@@H+](CCc2ccccc2Cl)C1 ZINC000464796844 388104404 /nfs/dbraw/zinc/10/44/04/388104404.db2.gz WZNPNQYCBNZSRD-UHFFFAOYSA-N 1 1 237.774 3.614 20 0 BHADMO Cc1cc(C)cc(C[N@H+]2CCC(C)(C)C2)c1 ZINC000464797213 388105130 /nfs/dbraw/zinc/10/51/30/388105130.db2.gz XYAHCFCVGMGLCZ-UHFFFAOYSA-N 1 1 217.356 3.535 20 0 BHADMO Cc1cccc(C)c1C[N@H+]1CCC(C)(C)C1 ZINC000464798019 388104584 /nfs/dbraw/zinc/10/45/84/388104584.db2.gz HQBDRQZEGPQCIU-UHFFFAOYSA-N 1 1 217.356 3.535 20 0 BHADMO C[C@H](c1ccc(F)cc1)[N@H+]1CCC(C)(C)C1 ZINC000464798020 388105028 /nfs/dbraw/zinc/10/50/28/388105028.db2.gz HQIANFNVMHEIPT-LLVKDONJSA-N 1 1 221.319 3.619 20 0 BHADMO C[C@@H](c1ccc(F)cc1)[N@H+]1CCC(C)(C)C1 ZINC000464798022 388104800 /nfs/dbraw/zinc/10/48/00/388104800.db2.gz HQIANFNVMHEIPT-NSHDSACASA-N 1 1 221.319 3.619 20 0 BHADMO Cc1cccc([C@@H](C)[N@H+]2CCC(C)(C)C2)c1 ZINC000464799721 388105042 /nfs/dbraw/zinc/10/50/42/388105042.db2.gz RPCSHAWDEJDIHC-CYBMUJFWSA-N 1 1 217.356 3.788 20 0 BHADMO Cc1cccc([C@H](C)[N@H+]2CCC(C)(C)C2)c1 ZINC000464799722 388105111 /nfs/dbraw/zinc/10/51/11/388105111.db2.gz RPCSHAWDEJDIHC-ZDUSSCGKSA-N 1 1 217.356 3.788 20 0 BHADMO CC1(C)CC[N@H+]([C@H]2CCCc3ccccc32)C1 ZINC000464803380 388104895 /nfs/dbraw/zinc/10/48/95/388104895.db2.gz XQSDNWMIFQRYOD-HNNXBMFYSA-N 1 1 229.367 3.796 20 0 BHADMO CC1(C)CC[N@H+]([C@@H]2CCCc3ccccc32)C1 ZINC000464803381 388102926 /nfs/dbraw/zinc/10/29/26/388102926.db2.gz XQSDNWMIFQRYOD-OAHLLOKOSA-N 1 1 229.367 3.796 20 0 BHADMO C[C@@H](c1c(F)cccc1F)[N@H+]1CCC(C)(C)C1 ZINC000464803460 388104701 /nfs/dbraw/zinc/10/47/01/388104701.db2.gz YQHLTLSXPDYLHH-JTQLQIEISA-N 1 1 239.309 3.758 20 0 BHADMO C[C@H](c1c(F)cccc1F)[N@H+]1CCC(C)(C)C1 ZINC000464803461 388104066 /nfs/dbraw/zinc/10/40/66/388104066.db2.gz YQHLTLSXPDYLHH-SNVBAGLBSA-N 1 1 239.309 3.758 20 0 BHADMO C[C@@H](c1cc(F)ccc1F)[N@H+]1CCC(C)(C)C1 ZINC000464803471 388105003 /nfs/dbraw/zinc/10/50/03/388105003.db2.gz YUGBEWUTAYMVDY-JTQLQIEISA-N 1 1 239.309 3.758 20 0 BHADMO C[C@H](c1cc(F)ccc1F)[N@H+]1CCC(C)(C)C1 ZINC000464803472 388105087 /nfs/dbraw/zinc/10/50/87/388105087.db2.gz YUGBEWUTAYMVDY-SNVBAGLBSA-N 1 1 239.309 3.758 20 0 BHADMO C[C@@H]1CC[C@@H](C)[N@@H+](CCC2CCCC2)C1 ZINC000464811785 388104911 /nfs/dbraw/zinc/10/49/11/388104911.db2.gz DENNNEBSNMLBFW-CHWSQXEVSA-N 1 1 209.377 3.687 20 0 BHADMO C[C@@H]1CC[C@H](C)[N@@H+](CCC2CCCC2)C1 ZINC000464811786 388105025 /nfs/dbraw/zinc/10/50/25/388105025.db2.gz DENNNEBSNMLBFW-OLZOCXBDSA-N 1 1 209.377 3.687 20 0 BHADMO C[C@@H]1CC[C@H](C)C[N@@H+]1CCC1CCCC1 ZINC000464811787 388104205 /nfs/dbraw/zinc/10/42/05/388104205.db2.gz DENNNEBSNMLBFW-QWHCGFSZSA-N 1 1 209.377 3.687 20 0 BHADMO C[C@H]1CC[C@H](C)[N@@H+](CCC2CCCC2)C1 ZINC000464811788 388104200 /nfs/dbraw/zinc/10/42/00/388104200.db2.gz DENNNEBSNMLBFW-STQMWFEESA-N 1 1 209.377 3.687 20 0 BHADMO Cc1cccc(C[N@H+]2C[C@@H](C)CC[C@@H]2C)c1 ZINC000464811797 388105174 /nfs/dbraw/zinc/10/51/74/388105174.db2.gz IMYPYPADLZRKEJ-KBPBESRZSA-N 1 1 217.356 3.615 20 0 BHADMO Cc1cccc(C[N@H+]2C[C@H](C)CC[C@@H]2C)c1 ZINC000464811798 388104234 /nfs/dbraw/zinc/10/42/34/388104234.db2.gz IMYPYPADLZRKEJ-KGLIPLIRSA-N 1 1 217.356 3.615 20 0 BHADMO Cc1cccc(C[N@H+]2C[C@@H](C)CC[C@H]2C)c1 ZINC000464811799 388105182 /nfs/dbraw/zinc/10/51/82/388105182.db2.gz IMYPYPADLZRKEJ-UONOGXRCSA-N 1 1 217.356 3.615 20 0 BHADMO Cc1cccc(C[N@H+]2C[C@H](C)CC[C@H]2C)c1 ZINC000464811800 388104733 /nfs/dbraw/zinc/10/47/33/388104733.db2.gz IMYPYPADLZRKEJ-ZIAGYGMSSA-N 1 1 217.356 3.615 20 0 BHADMO C[C@@H]1CC[C@H](C)[N@@H+](Cc2cccc(Cl)c2)C1 ZINC000464816547 388104866 /nfs/dbraw/zinc/10/48/66/388104866.db2.gz DLLBADPSSRFYLH-NEPJUHHUSA-N 1 1 237.774 3.960 20 0 BHADMO C[C@@H]1CC[C@H](C)C[N@@H+]1Cc1cccc(Cl)c1 ZINC000464816548 388104876 /nfs/dbraw/zinc/10/48/76/388104876.db2.gz DLLBADPSSRFYLH-NWDGAFQWSA-N 1 1 237.774 3.960 20 0 BHADMO C[C@H]1CC[C@H](C)[N@@H+](Cc2cccc(Cl)c2)C1 ZINC000464816549 388105106 /nfs/dbraw/zinc/10/51/06/388105106.db2.gz DLLBADPSSRFYLH-RYUDHWBXSA-N 1 1 237.774 3.960 20 0 BHADMO C[C@@H]1CC[C@@H](C)[N@@H+](Cc2cccc(Cl)c2)C1 ZINC000464816551 388104693 /nfs/dbraw/zinc/10/46/93/388104693.db2.gz DLLBADPSSRFYLH-VXGBXAGGSA-N 1 1 237.774 3.960 20 0 BHADMO Cc1ccccc1C[N@H+]1C[C@@H](C)CC[C@H]1C ZINC000464817738 388105083 /nfs/dbraw/zinc/10/50/83/388105083.db2.gz YIUXWIGJFZCMAG-GXTWGEPZSA-N 1 1 217.356 3.615 20 0 BHADMO Cc1ccccc1C[N@H+]1C[C@@H](C)CC[C@@H]1C ZINC000464817739 388104386 /nfs/dbraw/zinc/10/43/86/388104386.db2.gz YIUXWIGJFZCMAG-JSGCOSHPSA-N 1 1 217.356 3.615 20 0 BHADMO Cc1ccccc1C[N@H+]1C[C@H](C)CC[C@@H]1C ZINC000464817740 388104651 /nfs/dbraw/zinc/10/46/51/388104651.db2.gz YIUXWIGJFZCMAG-OCCSQVGLSA-N 1 1 217.356 3.615 20 0 BHADMO Cc1ccccc1C[N@H+]1C[C@H](C)CC[C@H]1C ZINC000464817741 388104664 /nfs/dbraw/zinc/10/46/64/388104664.db2.gz YIUXWIGJFZCMAG-TZMCWYRMSA-N 1 1 217.356 3.615 20 0 BHADMO C[C@@H]1CC[C@H](C)[N@@H+](CCCOc2ccccc2)C1 ZINC000464817906 388105135 /nfs/dbraw/zinc/10/51/35/388105135.db2.gz ZFWHYJNIHQBQED-CABCVRRESA-N 1 1 247.382 3.576 20 0 BHADMO C[C@H]1CC[C@H](C)[N@@H+](CCCOc2ccccc2)C1 ZINC000464817907 388104611 /nfs/dbraw/zinc/10/46/11/388104611.db2.gz ZFWHYJNIHQBQED-GJZGRUSLSA-N 1 1 247.382 3.576 20 0 BHADMO C[C@@H]1CC[C@@H](C)[N@@H+](CCCOc2ccccc2)C1 ZINC000464817908 388104636 /nfs/dbraw/zinc/10/46/36/388104636.db2.gz ZFWHYJNIHQBQED-HUUCEWRRSA-N 1 1 247.382 3.576 20 0 BHADMO C[C@@H]1CC[C@H](C)C[N@@H+]1CCCOc1ccccc1 ZINC000464817909 388105115 /nfs/dbraw/zinc/10/51/15/388105115.db2.gz ZFWHYJNIHQBQED-LSDHHAIUSA-N 1 1 247.382 3.576 20 0 BHADMO C[C@@H]1CC[C@H](C)[N@@H+](Cc2ccccc2Cl)C1 ZINC000464821810 388105073 /nfs/dbraw/zinc/10/50/73/388105073.db2.gz JCJVOJVIVJJEFF-NEPJUHHUSA-N 1 1 237.774 3.960 20 0 BHADMO C[C@@H]1CC[C@H](C)C[N@@H+]1Cc1ccccc1Cl ZINC000464821811 388105012 /nfs/dbraw/zinc/10/50/12/388105012.db2.gz JCJVOJVIVJJEFF-NWDGAFQWSA-N 1 1 237.774 3.960 20 0 BHADMO C[C@H]1CC[C@H](C)[N@@H+](Cc2ccccc2Cl)C1 ZINC000464821812 388104987 /nfs/dbraw/zinc/10/49/87/388104987.db2.gz JCJVOJVIVJJEFF-RYUDHWBXSA-N 1 1 237.774 3.960 20 0 BHADMO C[C@@H]1CC[C@@H](C)[N@@H+](Cc2ccccc2Cl)C1 ZINC000464821813 388104558 /nfs/dbraw/zinc/10/45/58/388104558.db2.gz JCJVOJVIVJJEFF-VXGBXAGGSA-N 1 1 237.774 3.960 20 0 BHADMO C[C@@H]1CC[C@H](C)[N@@H+](CCCc2ccccc2)C1 ZINC000464822308 388104157 /nfs/dbraw/zinc/10/41/57/388104157.db2.gz LSBAGTHYHRZKSR-CABCVRRESA-N 1 1 231.383 3.740 20 0 BHADMO C[C@H]1CC[C@H](C)[N@@H+](CCCc2ccccc2)C1 ZINC000464822309 388105059 /nfs/dbraw/zinc/10/50/59/388105059.db2.gz LSBAGTHYHRZKSR-GJZGRUSLSA-N 1 1 231.383 3.740 20 0 BHADMO C[C@@H]1CC[C@@H](C)[N@@H+](CCCc2ccccc2)C1 ZINC000464822310 388104861 /nfs/dbraw/zinc/10/48/61/388104861.db2.gz LSBAGTHYHRZKSR-HUUCEWRRSA-N 1 1 231.383 3.740 20 0 BHADMO C[C@@H]1CC[C@H](C)C[N@@H+]1CCCc1ccccc1 ZINC000464822311 388104934 /nfs/dbraw/zinc/10/49/34/388104934.db2.gz LSBAGTHYHRZKSR-LSDHHAIUSA-N 1 1 231.383 3.740 20 0 BHADMO Cc1ccc(C[N@H+]2C[C@@H](C)CC[C@@H]2C)cc1 ZINC000464823416 388104991 /nfs/dbraw/zinc/10/49/91/388104991.db2.gz QCLGDIFIOJHHOY-KBPBESRZSA-N 1 1 217.356 3.615 20 0 BHADMO Cc1ccc(C[N@H+]2C[C@H](C)CC[C@@H]2C)cc1 ZINC000464823417 388104338 /nfs/dbraw/zinc/10/43/38/388104338.db2.gz QCLGDIFIOJHHOY-KGLIPLIRSA-N 1 1 217.356 3.615 20 0 BHADMO Cc1ccc(C[N@H+]2C[C@@H](C)CC[C@H]2C)cc1 ZINC000464823418 388105143 /nfs/dbraw/zinc/10/51/43/388105143.db2.gz QCLGDIFIOJHHOY-UONOGXRCSA-N 1 1 217.356 3.615 20 0 BHADMO Cc1ccc(C[N@H+]2C[C@H](C)CC[C@H]2C)cc1 ZINC000464823419 533963440 /nfs/dbraw/zinc/96/34/40/533963440.db2.gz QCLGDIFIOJHHOY-ZIAGYGMSSA-N 1 1 217.356 3.615 20 0 BHADMO C[C@@H](C[N@H+]1C[C@H](C)CC[C@@H]1C)c1ccccc1 ZINC000464823966 388105139 /nfs/dbraw/zinc/10/51/39/388105139.db2.gz ROURSNCRRPWYIC-ILXRZTDVSA-N 1 1 231.383 3.911 20 0 BHADMO C[C@H](C[N@H+]1C[C@H](C)CC[C@@H]1C)c1ccccc1 ZINC000464823967 388104396 /nfs/dbraw/zinc/10/43/96/388104396.db2.gz ROURSNCRRPWYIC-KFWWJZLASA-N 1 1 231.383 3.911 20 0 BHADMO C[C@@H](C[N@H+]1C[C@H](C)CC[C@H]1C)c1ccccc1 ZINC000464823968 388105179 /nfs/dbraw/zinc/10/51/79/388105179.db2.gz ROURSNCRRPWYIC-QLFBSQMISA-N 1 1 231.383 3.911 20 0 BHADMO C[C@H](C[N@H+]1C[C@H](C)CC[C@H]1C)c1ccccc1 ZINC000464823969 388105186 /nfs/dbraw/zinc/10/51/86/388105186.db2.gz ROURSNCRRPWYIC-RBSFLKMASA-N 1 1 231.383 3.911 20 0 BHADMO C[C@@H]1CC[C@H](C)[N@@H+](Cc2ccc(Cl)cc2)C1 ZINC000464826617 388104456 /nfs/dbraw/zinc/10/44/56/388104456.db2.gz ZVOSNUMOPPSYTB-NEPJUHHUSA-N 1 1 237.774 3.960 20 0 BHADMO C[C@@H]1CC[C@H](C)C[N@@H+]1Cc1ccc(Cl)cc1 ZINC000464826618 388104210 /nfs/dbraw/zinc/10/42/10/388104210.db2.gz ZVOSNUMOPPSYTB-NWDGAFQWSA-N 1 1 237.774 3.960 20 0 BHADMO C[C@H]1CC[C@H](C)[N@@H+](Cc2ccc(Cl)cc2)C1 ZINC000464826619 388104134 /nfs/dbraw/zinc/10/41/34/388104134.db2.gz ZVOSNUMOPPSYTB-RYUDHWBXSA-N 1 1 237.774 3.960 20 0 BHADMO C[C@@H]1CC[C@@H](C)[N@@H+](Cc2ccc(Cl)cc2)C1 ZINC000464826620 388104374 /nfs/dbraw/zinc/10/43/74/388104374.db2.gz ZVOSNUMOPPSYTB-VXGBXAGGSA-N 1 1 237.774 3.960 20 0 BHADMO C[C@@H]1CC[C@@H](C)[N@@H+](C/C=C\c2ccccc2)C1 ZINC000464826948 388104347 /nfs/dbraw/zinc/10/43/47/388104347.db2.gz IDPGIUIBKCXFAM-AJNJCKRNSA-N 1 1 229.367 3.820 20 0 BHADMO C[C@@H]1CC[C@H](C)[N@@H+](C/C=C\c2ccccc2)C1 ZINC000464826949 388104418 /nfs/dbraw/zinc/10/44/18/388104418.db2.gz IDPGIUIBKCXFAM-IIQYJXCPSA-N 1 1 229.367 3.820 20 0 BHADMO C[C@@H]1CC[C@H](C)[N@@H+](C/C=C/c2ccccc2)C1 ZINC000464826950 388104783 /nfs/dbraw/zinc/10/47/83/388104783.db2.gz IDPGIUIBKCXFAM-SIEMXDPISA-N 1 1 229.367 3.820 20 0 BHADMO C[C@@H]1CC[C@@H](C)[N@@H+](C/C=C/c2ccccc2)C1 ZINC000464826951 388104519 /nfs/dbraw/zinc/10/45/19/388104519.db2.gz IDPGIUIBKCXFAM-VOTDVEDPSA-N 1 1 229.367 3.820 20 0 BHADMO C[C@H](c1ccccc1Cl)[N@H+]1CCC[C@H]1C ZINC000464829691 388104439 /nfs/dbraw/zinc/10/44/39/388104439.db2.gz JSAODVMXSIOFNR-GHMZBOCLSA-N 1 1 223.747 3.885 20 0 BHADMO C[C@@H](c1ccccc1Cl)[N@H+]1CCC[C@H]1C ZINC000464829693 388104773 /nfs/dbraw/zinc/10/47/73/388104773.db2.gz JSAODVMXSIOFNR-MNOVXSKESA-N 1 1 223.747 3.885 20 0 BHADMO C[C@@H](c1ccccc1Cl)[N@H+]1CCC[C@@H]1C ZINC000464829694 388104297 /nfs/dbraw/zinc/10/42/97/388104297.db2.gz JSAODVMXSIOFNR-QWRGUYRKSA-N 1 1 223.747 3.885 20 0 BHADMO C[C@H](c1ccccc1Cl)[N@H+]1CCC[C@@H]1C ZINC000464829695 388104814 /nfs/dbraw/zinc/10/48/14/388104814.db2.gz JSAODVMXSIOFNR-WDEREUQCSA-N 1 1 223.747 3.885 20 0 BHADMO C[C@H](c1cccc(Cl)c1)[N@H+]1CCC[C@H]1C ZINC000464829769 388104226 /nfs/dbraw/zinc/10/42/26/388104226.db2.gz KBNSNBROMQDXQL-GHMZBOCLSA-N 1 1 223.747 3.885 20 0 BHADMO C[C@@H](c1cccc(Cl)c1)[N@H+]1CCC[C@H]1C ZINC000464829770 388104942 /nfs/dbraw/zinc/10/49/42/388104942.db2.gz KBNSNBROMQDXQL-MNOVXSKESA-N 1 1 223.747 3.885 20 0 BHADMO C[C@@H](c1cccc(Cl)c1)[N@H+]1CCC[C@@H]1C ZINC000464829772 388105100 /nfs/dbraw/zinc/10/51/00/388105100.db2.gz KBNSNBROMQDXQL-QWRGUYRKSA-N 1 1 223.747 3.885 20 0 BHADMO C[C@H](c1cccc(Cl)c1)[N@H+]1CCC[C@@H]1C ZINC000464829774 388104305 /nfs/dbraw/zinc/10/43/05/388104305.db2.gz KBNSNBROMQDXQL-WDEREUQCSA-N 1 1 223.747 3.885 20 0 BHADMO C[C@@H](c1c(F)cccc1F)[N@H+]1C[C@H](C)[C@H](C)C1 ZINC000464830629 388104546 /nfs/dbraw/zinc/10/45/46/388104546.db2.gz JCHYMEGQITUUPU-AXFHLTTASA-N 1 1 239.309 3.614 20 0 BHADMO C[C@H](c1c(F)cccc1F)[N@H+]1C[C@H](C)[C@H](C)C1 ZINC000464830632 388106291 /nfs/dbraw/zinc/10/62/91/388106291.db2.gz JCHYMEGQITUUPU-OUAUKWLOSA-N 1 1 239.309 3.614 20 0 BHADMO C[C@@H]1CC[C@@H](C)[N@@H+](CC2CCCCC2)C1 ZINC000464833015 388105808 /nfs/dbraw/zinc/10/58/08/388105808.db2.gz UUZFOVWVDWWIFV-CHWSQXEVSA-N 1 1 209.377 3.687 20 0 BHADMO C[C@@H]1CC[C@H](C)[N@@H+](CC2CCCCC2)C1 ZINC000464833016 388106259 /nfs/dbraw/zinc/10/62/59/388106259.db2.gz UUZFOVWVDWWIFV-OLZOCXBDSA-N 1 1 209.377 3.687 20 0 BHADMO C[C@@H]1CC[C@H](C)C[N@@H+]1CC1CCCCC1 ZINC000464833017 388104567 /nfs/dbraw/zinc/10/45/67/388104567.db2.gz UUZFOVWVDWWIFV-QWHCGFSZSA-N 1 1 209.377 3.687 20 0 BHADMO C[C@H]1CC[C@H](C)[N@@H+](CC2CCCCC2)C1 ZINC000464833018 388105167 /nfs/dbraw/zinc/10/51/67/388105167.db2.gz UUZFOVWVDWWIFV-STQMWFEESA-N 1 1 209.377 3.687 20 0 BHADMO CCc1ccc([C@@H]2C[C@@H](C)CC[N@@H+]2CC)o1 ZINC000464833976 388106250 /nfs/dbraw/zinc/10/62/50/388106250.db2.gz OWJAQYWXHHDUME-AAEUAGOBSA-N 1 1 221.344 3.635 20 0 BHADMO CCc1ccc([C@H]2C[C@H](C)CC[N@@H+]2CC)o1 ZINC000464833977 388105672 /nfs/dbraw/zinc/10/56/72/388105672.db2.gz OWJAQYWXHHDUME-DGCLKSJQSA-N 1 1 221.344 3.635 20 0 BHADMO CCc1ccc([C@H]2C[C@@H](C)CC[N@@H+]2CC)o1 ZINC000464833978 388106116 /nfs/dbraw/zinc/10/61/16/388106116.db2.gz OWJAQYWXHHDUME-WCQYABFASA-N 1 1 221.344 3.635 20 0 BHADMO CCc1ccc([C@@H]2C[C@H](C)CC[N@@H+]2CC)o1 ZINC000464833979 388105783 /nfs/dbraw/zinc/10/57/83/388105783.db2.gz OWJAQYWXHHDUME-YPMHNXCESA-N 1 1 221.344 3.635 20 0 BHADMO C[C@H]1CCC[N@H+]1CCc1c(F)cccc1Cl ZINC000464834733 388105615 /nfs/dbraw/zinc/10/56/15/388105615.db2.gz SZXGFHIPNWLTPO-JTQLQIEISA-N 1 1 241.737 3.506 20 0 BHADMO C[C@@H]1CCC[N@H+]1CCc1c(F)cccc1Cl ZINC000464834735 388106278 /nfs/dbraw/zinc/10/62/78/388106278.db2.gz SZXGFHIPNWLTPO-SNVBAGLBSA-N 1 1 241.737 3.506 20 0 BHADMO CCC[C@]1(C)CCC[N@@H+](CCCSC)C1 ZINC000464835566 388106303 /nfs/dbraw/zinc/10/63/03/388106303.db2.gz IVODQFODKGXHOF-CYBMUJFWSA-N 1 1 229.433 3.642 20 0 BHADMO CCC[C@@]1(C)CCC[N@@H+](CCCSC)C1 ZINC000464835568 388106394 /nfs/dbraw/zinc/10/63/94/388106394.db2.gz IVODQFODKGXHOF-ZDUSSCGKSA-N 1 1 229.433 3.642 20 0 BHADMO CC[C@H](c1ccc(F)cc1)[N@H+]1CCC[C@H]1C ZINC000464837911 388105439 /nfs/dbraw/zinc/10/54/39/388105439.db2.gz YXTDKBAIPMQEKG-BXUZGUMPSA-N 1 1 221.319 3.761 20 0 BHADMO CC[C@@H](c1ccc(F)cc1)[N@H+]1CCC[C@@H]1C ZINC000464837913 388106352 /nfs/dbraw/zinc/10/63/52/388106352.db2.gz YXTDKBAIPMQEKG-FZMZJTMJSA-N 1 1 221.319 3.761 20 0 BHADMO CC[C@@H](c1ccc(F)cc1)[N@H+]1CCC[C@H]1C ZINC000464837917 388105875 /nfs/dbraw/zinc/10/58/75/388105875.db2.gz YXTDKBAIPMQEKG-RISCZKNCSA-N 1 1 221.319 3.761 20 0 BHADMO CC[C@H](c1ccc(F)cc1)[N@H+]1CCC[C@@H]1C ZINC000464837919 388106101 /nfs/dbraw/zinc/10/61/01/388106101.db2.gz YXTDKBAIPMQEKG-SMDDNHRTSA-N 1 1 221.319 3.761 20 0 BHADMO CCC[C@@]1(C)CCC[N@@H+](CCOC(C)(C)C)C1 ZINC000464838534 388106163 /nfs/dbraw/zinc/10/61/63/388106163.db2.gz NPKBNITUBXNATI-HNNXBMFYSA-N 1 1 241.419 3.704 20 0 BHADMO CCC[C@]1(C)CCC[N@@H+](CCOC(C)(C)C)C1 ZINC000464838536 388105832 /nfs/dbraw/zinc/10/58/32/388105832.db2.gz NPKBNITUBXNATI-OAHLLOKOSA-N 1 1 241.419 3.704 20 0 BHADMO C[C@@H](c1cc(F)ccc1F)[N@H+]1C[C@H](C)[C@H](C)C1 ZINC000464839367 388105756 /nfs/dbraw/zinc/10/57/56/388105756.db2.gz XZOSFHHDUKLADC-AXFHLTTASA-N 1 1 239.309 3.614 20 0 BHADMO C[C@H](c1cc(F)ccc1F)[N@H+]1C[C@H](C)[C@H](C)C1 ZINC000464839370 388105631 /nfs/dbraw/zinc/10/56/31/388105631.db2.gz XZOSFHHDUKLADC-OUAUKWLOSA-N 1 1 239.309 3.614 20 0 BHADMO CCC[C@]1(C)CCC[N@@H+](CCSCC)C1 ZINC000464839864 388106134 /nfs/dbraw/zinc/10/61/34/388106134.db2.gz RKNIBHQRVNWGBR-CYBMUJFWSA-N 1 1 229.433 3.642 20 0 BHADMO CCC[C@@]1(C)CCC[N@@H+](CCSCC)C1 ZINC000464839865 388105563 /nfs/dbraw/zinc/10/55/63/388105563.db2.gz RKNIBHQRVNWGBR-ZDUSSCGKSA-N 1 1 229.433 3.642 20 0 BHADMO CCC[C@@]1(C)CCC[N@@H+](CC2CCC2)C1 ZINC000464840803 388105967 /nfs/dbraw/zinc/10/59/67/388105967.db2.gz AQQWUAFCBDTGDZ-AWEZNQCLSA-N 1 1 209.377 3.689 20 0 BHADMO CCC[C@]1(C)CCC[N@@H+](CC2CCC2)C1 ZINC000464840804 388105487 /nfs/dbraw/zinc/10/54/87/388105487.db2.gz AQQWUAFCBDTGDZ-CQSZACIVSA-N 1 1 209.377 3.689 20 0 BHADMO C[C@@H]1CCC[N@H+]1CCCc1ccc(Cl)cc1 ZINC000464841698 388106268 /nfs/dbraw/zinc/10/62/68/388106268.db2.gz YQAAWOSJJNLDIQ-GFCCVEGCSA-N 1 1 237.774 3.757 20 0 BHADMO C[C@H]1CCC[N@H+]1CCCc1ccc(Cl)cc1 ZINC000464841699 388105747 /nfs/dbraw/zinc/10/57/47/388105747.db2.gz YQAAWOSJJNLDIQ-LBPRGKRZSA-N 1 1 237.774 3.757 20 0 BHADMO C[C@@H](c1ccc(F)cc1F)[N@H+]1C[C@H](C)[C@H](C)C1 ZINC000464842238 388105919 /nfs/dbraw/zinc/10/59/19/388105919.db2.gz ZUXWHRCLDZRUHY-AXFHLTTASA-N 1 1 239.309 3.614 20 0 BHADMO C[C@H](c1ccc(F)cc1F)[N@H+]1C[C@H](C)[C@H](C)C1 ZINC000464842241 388105850 /nfs/dbraw/zinc/10/58/50/388105850.db2.gz ZUXWHRCLDZRUHY-OUAUKWLOSA-N 1 1 239.309 3.614 20 0 BHADMO C[C@@H](c1ccc(F)c(F)c1)[N@H+]1C[C@H](C)[C@H](C)C1 ZINC000464842645 388104125 /nfs/dbraw/zinc/10/41/25/388104125.db2.gz KAGRFEUOOUENBW-AXFHLTTASA-N 1 1 239.309 3.614 20 0 BHADMO C[C@H](c1ccc(F)c(F)c1)[N@H+]1C[C@H](C)[C@H](C)C1 ZINC000464842648 388105033 /nfs/dbraw/zinc/10/50/33/388105033.db2.gz KAGRFEUOOUENBW-OUAUKWLOSA-N 1 1 239.309 3.614 20 0 BHADMO CCC[C@@]1(C)CCC[N@@H+](CCCOC(C)C)C1 ZINC000464842929 388105705 /nfs/dbraw/zinc/10/57/05/388105705.db2.gz NNFIFQDQQNNTRZ-HNNXBMFYSA-N 1 1 241.419 3.704 20 0 BHADMO CCC[C@]1(C)CCC[N@@H+](CCCOC(C)C)C1 ZINC000464842930 388105463 /nfs/dbraw/zinc/10/54/63/388105463.db2.gz NNFIFQDQQNNTRZ-OAHLLOKOSA-N 1 1 241.419 3.704 20 0 BHADMO Cc1ccc(OCCC[N@@H+]2CCC[C@@H]2C)cc1C ZINC000464843611 388106195 /nfs/dbraw/zinc/10/61/95/388106195.db2.gz WWSRUTIISLCHRK-HNNXBMFYSA-N 1 1 247.382 3.557 20 0 BHADMO Cc1ccc(OCCC[N@@H+]2CCC[C@H]2C)cc1C ZINC000464843612 388105820 /nfs/dbraw/zinc/10/58/20/388105820.db2.gz WWSRUTIISLCHRK-OAHLLOKOSA-N 1 1 247.382 3.557 20 0 BHADMO CCCCC[N@H+]1C[C@@H](C)OC[C@@H]1c1ccccc1 ZINC000464844585 388106215 /nfs/dbraw/zinc/10/62/15/388106215.db2.gz BHYUUOXPYSKHQP-GDBMZVCRSA-N 1 1 247.382 3.639 20 0 BHADMO CCCCC[N@H+]1C[C@H](C)OC[C@@H]1c1ccccc1 ZINC000464844586 388106340 /nfs/dbraw/zinc/10/63/40/388106340.db2.gz BHYUUOXPYSKHQP-GOEBONIOSA-N 1 1 247.382 3.639 20 0 BHADMO CCCCC[N@H+]1C[C@H](C)OC[C@H]1c1ccccc1 ZINC000464844587 388105949 /nfs/dbraw/zinc/10/59/49/388105949.db2.gz BHYUUOXPYSKHQP-HOCLYGCPSA-N 1 1 247.382 3.639 20 0 BHADMO CCCCC[N@H+]1C[C@@H](C)OC[C@H]1c1ccccc1 ZINC000464844588 388106428 /nfs/dbraw/zinc/10/64/28/388106428.db2.gz BHYUUOXPYSKHQP-ZBFHGGJFSA-N 1 1 247.382 3.639 20 0 BHADMO CCC[C@@]1(C)CCC[N@@H+](CCCCCOC)C1 ZINC000464844641 388105890 /nfs/dbraw/zinc/10/58/90/388105890.db2.gz IGZWACQGIMAZGD-HNNXBMFYSA-N 1 1 241.419 3.705 20 0 BHADMO CCC[C@]1(C)CCC[N@@H+](CCCCCOC)C1 ZINC000464844642 388105648 /nfs/dbraw/zinc/10/56/48/388105648.db2.gz IGZWACQGIMAZGD-OAHLLOKOSA-N 1 1 241.419 3.705 20 0 BHADMO CC[C@@H](c1ccccc1)[N@H+]1C[C@H](C)[C@H](C)C1 ZINC000464844734 388106183 /nfs/dbraw/zinc/10/61/83/388106183.db2.gz JMPOVFWTOOXCLQ-GUTXKFCHSA-N 1 1 217.356 3.726 20 0 BHADMO CC[C@H](c1ccccc1)[N@H+]1C[C@H](C)[C@H](C)C1 ZINC000464844737 388105825 /nfs/dbraw/zinc/10/58/25/388105825.db2.gz JMPOVFWTOOXCLQ-VNHYZAJKSA-N 1 1 217.356 3.726 20 0 BHADMO CCC[C@@]1(C)CCC[N@@H+](CCC2CC2)C1 ZINC000464845566 388105715 /nfs/dbraw/zinc/10/57/15/388105715.db2.gz GFUXGNSIKHZGKR-AWEZNQCLSA-N 1 1 209.377 3.689 20 0 BHADMO CCC[C@]1(C)CCC[N@@H+](CCC2CC2)C1 ZINC000464845567 388105654 /nfs/dbraw/zinc/10/56/54/388105654.db2.gz GFUXGNSIKHZGKR-CQSZACIVSA-N 1 1 209.377 3.689 20 0 BHADMO CCC[C@@]1(C)CCC[N@H+]([C@@H]2C=CCCC2)C1 ZINC000464846875 388105501 /nfs/dbraw/zinc/10/55/01/388105501.db2.gz KJRWWUWKKRMUNS-CABCVRRESA-N 1 1 221.388 3.997 20 0 BHADMO CCC[C@@]1(C)CCC[N@H+]([C@H]2C=CCCC2)C1 ZINC000464846902 388106015 /nfs/dbraw/zinc/10/60/15/388106015.db2.gz KJRWWUWKKRMUNS-GJZGRUSLSA-N 1 1 221.388 3.997 20 0 BHADMO CCC[C@]1(C)CCC[N@H+]([C@@H]2C=CCCC2)C1 ZINC000464846903 388106121 /nfs/dbraw/zinc/10/61/21/388106121.db2.gz KJRWWUWKKRMUNS-HUUCEWRRSA-N 1 1 221.388 3.997 20 0 BHADMO CCC[C@]1(C)CCC[N@H+]([C@H]2C=CCCC2)C1 ZINC000464846904 528502674 /nfs/dbraw/zinc/50/26/74/528502674.db2.gz KJRWWUWKKRMUNS-LSDHHAIUSA-N 1 1 221.388 3.997 20 0 BHADMO CC[C@H](c1ccccc1)[N@H+]1C[C@@H]2CCC[C@@H]2C1 ZINC000464850802 388106154 /nfs/dbraw/zinc/10/61/54/388106154.db2.gz LBBBWPSATIFICI-OWCLPIDISA-N 1 1 229.367 3.870 20 0 BHADMO CC[C@@H](c1ccccc1)[N@H+]1C[C@@H]2CCC[C@@H]2C1 ZINC000464850803 388105523 /nfs/dbraw/zinc/10/55/23/388105523.db2.gz LBBBWPSATIFICI-XHSDSOJGSA-N 1 1 229.367 3.870 20 0 BHADMO CCCCC[N@@H+](C)[C@H](C)CCSCC ZINC000464856586 388105607 /nfs/dbraw/zinc/10/56/07/388105607.db2.gz LEVBZEAEKSDVED-GFCCVEGCSA-N 1 1 217.422 3.640 20 0 BHADMO CCCCC[N@@H+](C)[C@@H](C)CCSCC ZINC000464856587 528164574 /nfs/dbraw/zinc/16/45/74/528164574.db2.gz LEVBZEAEKSDVED-LBPRGKRZSA-N 1 1 217.422 3.640 20 0 BHADMO Cc1cccc([C@@H](C)[N@H+]2C[C@H](C)[C@H](C)C2)c1 ZINC000464859561 388107416 /nfs/dbraw/zinc/10/74/16/388107416.db2.gz YGCUGKRGIXCLKL-HZSPNIEDSA-N 1 1 217.356 3.644 20 0 BHADMO Cc1cccc([C@H](C)[N@H+]2C[C@H](C)[C@H](C)C2)c1 ZINC000464859564 388107030 /nfs/dbraw/zinc/10/70/30/388107030.db2.gz YGCUGKRGIXCLKL-MJBXVCDLSA-N 1 1 217.356 3.644 20 0 BHADMO CCCC[N@H+]1CC[C@@H](C)C[C@@H]1c1ccco1 ZINC000464860180 388105906 /nfs/dbraw/zinc/10/59/06/388105906.db2.gz ZFPSYRAATTUYTB-CHWSQXEVSA-N 1 1 221.344 3.853 20 0 BHADMO CCCC[N@H+]1CC[C@@H](C)C[C@H]1c1ccco1 ZINC000464860181 388106412 /nfs/dbraw/zinc/10/64/12/388106412.db2.gz ZFPSYRAATTUYTB-OLZOCXBDSA-N 1 1 221.344 3.853 20 0 BHADMO CCCC[N@H+]1CC[C@H](C)C[C@@H]1c1ccco1 ZINC000464860182 388105414 /nfs/dbraw/zinc/10/54/14/388105414.db2.gz ZFPSYRAATTUYTB-QWHCGFSZSA-N 1 1 221.344 3.853 20 0 BHADMO CCCC[N@H+]1CC[C@H](C)C[C@H]1c1ccco1 ZINC000464860183 388106125 /nfs/dbraw/zinc/10/61/25/388106125.db2.gz ZFPSYRAATTUYTB-STQMWFEESA-N 1 1 221.344 3.853 20 0 BHADMO CCCCC[N@@H+](CCCSC)C(C)C ZINC000464864428 388107281 /nfs/dbraw/zinc/10/72/81/388107281.db2.gz MOMDLOQTSXUKRZ-UHFFFAOYSA-N 1 1 217.422 3.640 20 0 BHADMO CSCCC[N@H+]1CCC[C@@H]1CC(C)(C)C ZINC000464865461 388107165 /nfs/dbraw/zinc/10/71/65/388107165.db2.gz GSNAHYYUCVPIDY-GFCCVEGCSA-N 1 1 229.433 3.640 20 0 BHADMO CSCCC[N@H+]1CCC[C@H]1CC(C)(C)C ZINC000464865462 388107638 /nfs/dbraw/zinc/10/76/38/388107638.db2.gz GSNAHYYUCVPIDY-LBPRGKRZSA-N 1 1 229.433 3.640 20 0 BHADMO CC[C@@H](c1ccccc1)[N@@H+](C)CCCSC ZINC000464865591 388104483 /nfs/dbraw/zinc/10/44/83/388104483.db2.gz IGZNOVLWEQGAOL-AWEZNQCLSA-N 1 1 237.412 3.823 20 0 BHADMO CC[C@H](c1ccccc1)[N@@H+](C)CCCSC ZINC000464865592 388105052 /nfs/dbraw/zinc/10/50/52/388105052.db2.gz IGZNOVLWEQGAOL-CQSZACIVSA-N 1 1 237.412 3.823 20 0 BHADMO CSCCC[N@@H+](C)[C@H]1CCCc2ccccc21 ZINC000464866079 388107608 /nfs/dbraw/zinc/10/76/08/388107608.db2.gz NZVZNAKELALGCU-HNNXBMFYSA-N 1 1 249.423 3.749 20 0 BHADMO CSCCC[N@@H+](C)[C@@H]1CCCc2ccccc21 ZINC000464866080 388106881 /nfs/dbraw/zinc/10/68/81/388106881.db2.gz NZVZNAKELALGCU-OAHLLOKOSA-N 1 1 249.423 3.749 20 0 BHADMO CCC1CCC([N@@H+](C)CCCSC)CC1 ZINC000464866325 388107292 /nfs/dbraw/zinc/10/72/92/388107292.db2.gz DDAQFNXXYYFQKH-UHFFFAOYSA-N 1 1 229.433 3.640 20 0 BHADMO CSCCC[N@H+]1CCC[C@H]1C1CCCCC1 ZINC000464866358 388107559 /nfs/dbraw/zinc/10/75/59/388107559.db2.gz DQYYDXWVABAXAE-AWEZNQCLSA-N 1 1 241.444 3.784 20 0 BHADMO CSCCC[N@H+]1CCC[C@@H]1C1CCCCC1 ZINC000464866359 388107315 /nfs/dbraw/zinc/10/73/15/388107315.db2.gz DQYYDXWVABAXAE-CQSZACIVSA-N 1 1 241.444 3.784 20 0 BHADMO CSCCC[N@@H+](CC1CC1)C1CCCCC1 ZINC000464866733 388107300 /nfs/dbraw/zinc/10/73/00/388107300.db2.gz GBUYDDANYIPOMI-UHFFFAOYSA-N 1 1 241.444 3.784 20 0 BHADMO CSCCC[N@@H+](CC(C)C)C1CCCC1 ZINC000464866829 388107668 /nfs/dbraw/zinc/10/76/68/388107668.db2.gz SPPQGSIMJIRNOW-UHFFFAOYSA-N 1 1 229.433 3.640 20 0 BHADMO c1ccc2c(c1)CCC[C@H]2[N@H+]1C[C@@H]2CCC[C@@H]2C1 ZINC000464869780 388106894 /nfs/dbraw/zinc/10/68/94/388106894.db2.gz ANRIFJTXFBQHBZ-HLLBOEOZSA-N 1 1 241.378 3.796 20 0 BHADMO c1ccc2c(c1)CCC[C@@H]2[N@H+]1C[C@@H]2CCC[C@@H]2C1 ZINC000464869782 388106901 /nfs/dbraw/zinc/10/69/01/388106901.db2.gz ANRIFJTXFBQHBZ-UXLLHSPISA-N 1 1 241.378 3.796 20 0 BHADMO CSCCC[N@H+]1CCCC2(CCCCC2)C1 ZINC000464878337 533564774 /nfs/dbraw/zinc/56/47/74/533564774.db2.gz TYGQJDCUBCRMFH-UHFFFAOYSA-N 1 1 241.444 3.786 20 0 BHADMO CSCCC[N@H+]1C[C@H](c2ccccc2)C[C@@H]1C ZINC000464879507 388107730 /nfs/dbraw/zinc/10/77/30/388107730.db2.gz OBUKIUJAEFJCPF-DZGCQCFKSA-N 1 1 249.423 3.618 20 0 BHADMO CSCCC[N@H+]1C[C@@H](c2ccccc2)C[C@H]1C ZINC000464879508 388107345 /nfs/dbraw/zinc/10/73/45/388107345.db2.gz OBUKIUJAEFJCPF-HIFRSBDPSA-N 1 1 249.423 3.618 20 0 BHADMO CSCCC[N@H+]1C[C@H](c2ccccc2)C[C@H]1C ZINC000464879509 533565618 /nfs/dbraw/zinc/56/56/18/533565618.db2.gz OBUKIUJAEFJCPF-UKRRQHHQSA-N 1 1 249.423 3.618 20 0 BHADMO CSCCC[N@H+]1C[C@@H](c2ccccc2)C[C@@H]1C ZINC000464879510 388107154 /nfs/dbraw/zinc/10/71/54/388107154.db2.gz OBUKIUJAEFJCPF-ZFWWWQNUSA-N 1 1 249.423 3.618 20 0 BHADMO CSCCC[N@H+]1CC[C@@H](c2ccccc2)[C@@H]1C ZINC000464881750 388106836 /nfs/dbraw/zinc/10/68/36/388106836.db2.gz VPOLDOWVIMHEMR-DZGCQCFKSA-N 1 1 249.423 3.618 20 0 BHADMO CSCCC[N@H+]1CC[C@H](c2ccccc2)[C@H]1C ZINC000464881751 388107723 /nfs/dbraw/zinc/10/77/23/388107723.db2.gz VPOLDOWVIMHEMR-HIFRSBDPSA-N 1 1 249.423 3.618 20 0 BHADMO CSCCC[N@H+]1CC[C@@H](c2ccccc2)[C@H]1C ZINC000464881776 388107429 /nfs/dbraw/zinc/10/74/29/388107429.db2.gz VPOLDOWVIMHEMR-UKRRQHHQSA-N 1 1 249.423 3.618 20 0 BHADMO CSCCC[N@H+]1CC[C@H](c2ccccc2)[C@@H]1C ZINC000464881777 388106624 /nfs/dbraw/zinc/10/66/24/388106624.db2.gz VPOLDOWVIMHEMR-ZFWWWQNUSA-N 1 1 249.423 3.618 20 0 BHADMO CC[N@@H+](CCc1cccc(F)c1)C1CCCC1 ZINC000464891298 388107709 /nfs/dbraw/zinc/10/77/09/388107709.db2.gz ZCTMKXCUNLMBEG-UHFFFAOYSA-N 1 1 235.346 3.633 20 0 BHADMO Cc1cccc([C@@H](C)[N@H+]2C[C@@H]3CCC[C@@H]3C2)c1 ZINC000464892990 388107265 /nfs/dbraw/zinc/10/72/65/388107265.db2.gz ZBZWIEYMPXSEHK-BMFZPTHFSA-N 1 1 229.367 3.788 20 0 BHADMO Cc1cccc([C@H](C)[N@H+]2C[C@@H]3CCC[C@@H]3C2)c1 ZINC000464892992 388107305 /nfs/dbraw/zinc/10/73/05/388107305.db2.gz ZBZWIEYMPXSEHK-CWRNSKLLSA-N 1 1 229.367 3.788 20 0 BHADMO C[C@H](C[N@H+]1C[C@@H]2CCC[C@@H]2C1)c1ccccc1 ZINC000464898442 388106846 /nfs/dbraw/zinc/10/68/46/388106846.db2.gz QOEGWFFYOMGLJG-BMFZPTHFSA-N 1 1 229.367 3.522 20 0 BHADMO C[C@@H](C[N@H+]1C[C@@H]2CCC[C@@H]2C1)c1ccccc1 ZINC000464898443 388106612 /nfs/dbraw/zinc/10/66/12/388106612.db2.gz QOEGWFFYOMGLJG-CWRNSKLLSA-N 1 1 229.367 3.522 20 0 BHADMO CC[C@@H](C)[C@H]1CCCC[N@H+]1CCCSC ZINC000464899332 388107109 /nfs/dbraw/zinc/10/71/09/388107109.db2.gz STQJNLQCDXKYQF-CHWSQXEVSA-N 1 1 229.433 3.640 20 0 BHADMO CC[C@@H](C)[C@@H]1CCCC[N@H+]1CCCSC ZINC000464899333 388107581 /nfs/dbraw/zinc/10/75/81/388107581.db2.gz STQJNLQCDXKYQF-OLZOCXBDSA-N 1 1 229.433 3.640 20 0 BHADMO CC[C@H](C)[C@H]1CCCC[N@H+]1CCCSC ZINC000464899334 388107480 /nfs/dbraw/zinc/10/74/80/388107480.db2.gz STQJNLQCDXKYQF-QWHCGFSZSA-N 1 1 229.433 3.640 20 0 BHADMO CC[C@H](C)[C@@H]1CCCC[N@H+]1CCCSC ZINC000464899335 388107588 /nfs/dbraw/zinc/10/75/88/388107588.db2.gz STQJNLQCDXKYQF-STQMWFEESA-N 1 1 229.433 3.640 20 0 BHADMO C[C@@H]1C[C@@H](C)N(c2cc[nH+]c3ccsc32)C1 ZINC000465056600 388109308 /nfs/dbraw/zinc/10/93/08/388109308.db2.gz QLNKZHUYVYQWFI-NXEZZACHSA-N 1 1 232.352 3.531 20 0 BHADMO C[C@H]1C[C@H](C)N(c2cc[nH+]c3ccsc32)C1 ZINC000465056615 388109529 /nfs/dbraw/zinc/10/95/29/388109529.db2.gz QLNKZHUYVYQWFI-UWVGGRQHSA-N 1 1 232.352 3.531 20 0 BHADMO C[C@@H]1C[C@H](C)CN1c1cc[nH+]c2ccsc21 ZINC000465056617 388109432 /nfs/dbraw/zinc/10/94/32/388109432.db2.gz QLNKZHUYVYQWFI-VHSXEESVSA-N 1 1 232.352 3.531 20 0 BHADMO C[C@@H]1C[C@H](C)N(c2cc[nH+]c3ccsc32)C1 ZINC000465056618 388108956 /nfs/dbraw/zinc/10/89/56/388108956.db2.gz QLNKZHUYVYQWFI-ZJUUUORDSA-N 1 1 232.352 3.531 20 0 BHADMO CC/C=C/CC[N@H+](C)[C@@H](C)CCSCC ZINC000466205090 398017740 /nfs/dbraw/zinc/01/77/40/398017740.db2.gz BCAFPUKUCUDZED-GWJCSSMESA-N 1 1 229.433 3.806 20 0 BHADMO CC/C=C\CC[N@H+](C)[C@H](C)CCSCC ZINC000466205099 398018066 /nfs/dbraw/zinc/01/80/66/398018066.db2.gz BCAFPUKUCUDZED-MEJMFZKBSA-N 1 1 229.433 3.806 20 0 BHADMO CC/C=C/CC[N@H+](C)[C@H](C)CCSCC ZINC000466205100 398017771 /nfs/dbraw/zinc/01/77/71/398017771.db2.gz BCAFPUKUCUDZED-SBDDDAINSA-N 1 1 229.433 3.806 20 0 BHADMO CC/C=C\CC[N@H+](C)[C@@H](C)CCSCC ZINC000466205101 398017892 /nfs/dbraw/zinc/01/78/92/398017892.db2.gz BCAFPUKUCUDZED-WSROAFLRSA-N 1 1 229.433 3.806 20 0 BHADMO CC/C=C\CC[N@H+]1CCc2ccc(F)cc2C1 ZINC000466209830 398017809 /nfs/dbraw/zinc/01/78/09/398017809.db2.gz KCBUBCBSQHJNHS-ARJAWSKDSA-N 1 1 233.330 3.540 20 0 BHADMO CC/C=C/CC[N@H+]1CCc2ccc(F)cc2C1 ZINC000466209831 398018142 /nfs/dbraw/zinc/01/81/42/398018142.db2.gz KCBUBCBSQHJNHS-ONEGZZNKSA-N 1 1 233.330 3.540 20 0 BHADMO CC/C=C\CC[N@@H+]1CC=C(C(F)(F)F)CC1 ZINC000466216581 398018199 /nfs/dbraw/zinc/01/81/99/398018199.db2.gz IJRDHINTINJILP-ARJAWSKDSA-N 1 1 233.277 3.537 20 0 BHADMO CC/C=C/CC[N@@H+]1CC=C(C(F)(F)F)CC1 ZINC000466216582 398018045 /nfs/dbraw/zinc/01/80/45/398018045.db2.gz IJRDHINTINJILP-ONEGZZNKSA-N 1 1 233.277 3.537 20 0 BHADMO CC/C=C\CC[N@H+]1CCc2c(F)cccc2C1 ZINC000466220396 398017654 /nfs/dbraw/zinc/01/76/54/398017654.db2.gz RRYUGKWDESXIFV-ARJAWSKDSA-N 1 1 233.330 3.540 20 0 BHADMO CC/C=C/CC[N@H+]1CCc2c(F)cccc2C1 ZINC000466220398 398018174 /nfs/dbraw/zinc/01/81/74/398018174.db2.gz RRYUGKWDESXIFV-ONEGZZNKSA-N 1 1 233.330 3.540 20 0 BHADMO CC/C=C\CC[N@@H+](CC(F)F)CC1CCC1 ZINC000466225806 398018194 /nfs/dbraw/zinc/01/81/94/398018194.db2.gz LLHQSOJTSCWGLW-ARJAWSKDSA-N 1 1 231.330 3.710 20 0 BHADMO CC/C=C\CC[N@H+](CC(F)F)CC1CCC1 ZINC000466225806 398018189 /nfs/dbraw/zinc/01/81/89/398018189.db2.gz LLHQSOJTSCWGLW-ARJAWSKDSA-N 1 1 231.330 3.710 20 0 BHADMO CC/C=C/CC[N@@H+](CC(F)F)CC1CCC1 ZINC000466225807 398018235 /nfs/dbraw/zinc/01/82/35/398018235.db2.gz LLHQSOJTSCWGLW-ONEGZZNKSA-N 1 1 231.330 3.710 20 0 BHADMO CC/C=C/CC[N@H+](CC(F)F)CC1CCC1 ZINC000466225807 398018233 /nfs/dbraw/zinc/01/82/33/398018233.db2.gz LLHQSOJTSCWGLW-ONEGZZNKSA-N 1 1 231.330 3.710 20 0 BHADMO CC/C=C\CC[N@H+]1CCc2cccc(F)c2C1 ZINC000466231792 398017931 /nfs/dbraw/zinc/01/79/31/398017931.db2.gz QXFMJXGHCALHQY-ARJAWSKDSA-N 1 1 233.330 3.540 20 0 BHADMO CC/C=C/CC[N@H+]1CCc2cccc(F)c2C1 ZINC000466231793 398018245 /nfs/dbraw/zinc/01/82/45/398018245.db2.gz QXFMJXGHCALHQY-ONEGZZNKSA-N 1 1 233.330 3.540 20 0 BHADMO CC/C=C\CC[N@H+]1CCc2cc(F)ccc2C1 ZINC000466233070 398017687 /nfs/dbraw/zinc/01/76/87/398017687.db2.gz GHEGWSCJKXKMSJ-ARJAWSKDSA-N 1 1 233.330 3.540 20 0 BHADMO CC/C=C/CC[N@H+]1CCc2cc(F)ccc2C1 ZINC000466233073 398017794 /nfs/dbraw/zinc/01/77/94/398017794.db2.gz GHEGWSCJKXKMSJ-ONEGZZNKSA-N 1 1 233.330 3.540 20 0 BHADMO CCC[C@H]1CCC[N@H+]([C@H]2C=CCCC2)C1 ZINC000466473943 388119210 /nfs/dbraw/zinc/11/92/10/388119210.db2.gz MRRWYLWYRKOYCI-KBPBESRZSA-N 1 1 207.361 3.607 20 0 BHADMO CCC[C@@H]1CCC[N@H+]([C@H]2C=CCCC2)C1 ZINC000466473944 388119094 /nfs/dbraw/zinc/11/90/94/388119094.db2.gz MRRWYLWYRKOYCI-KGLIPLIRSA-N 1 1 207.361 3.607 20 0 BHADMO CCC[C@H]1CCC[N@H+]([C@@H]2C=CCCC2)C1 ZINC000466473945 388119441 /nfs/dbraw/zinc/11/94/41/388119441.db2.gz MRRWYLWYRKOYCI-UONOGXRCSA-N 1 1 207.361 3.607 20 0 BHADMO CCC[C@@H]1CCC[N@H+]([C@@H]2C=CCCC2)C1 ZINC000466473946 388118991 /nfs/dbraw/zinc/11/89/91/388118991.db2.gz MRRWYLWYRKOYCI-ZIAGYGMSSA-N 1 1 207.361 3.607 20 0 BHADMO CCC(C)(C)CC[N@@H+](C)CCC1CCOCC1 ZINC000466492043 388119142 /nfs/dbraw/zinc/11/91/42/388119142.db2.gz AIGYMYCCLZKXOY-UHFFFAOYSA-N 1 1 241.419 3.561 20 0 BHADMO C[C@@H]1CC[C@H](C)[N@@H+]1CCc1ccccc1Cl ZINC000466663974 388120250 /nfs/dbraw/zinc/12/02/50/388120250.db2.gz JBTRKVWLJCXZFM-TXEJJXNPSA-N 1 1 237.774 3.755 20 0 BHADMO C[C@H](C[N@@H+]1[C@H](C)CC[C@@H]1C)c1ccccc1 ZINC000466667190 224999109 /nfs/dbraw/zinc/99/91/09/224999109.db2.gz OLPBMKVDTXRGSU-MCIONIFRSA-N 1 1 217.356 3.663 20 0 BHADMO C[C@@H](C[N@@H+]1[C@H](C)CC[C@@H]1C)c1ccccc1 ZINC000466667192 388120760 /nfs/dbraw/zinc/12/07/60/388120760.db2.gz OLPBMKVDTXRGSU-MELADBBJSA-N 1 1 217.356 3.663 20 0 BHADMO CSCCC[N@H+]1CCCC[C@@H]1CC(C)C ZINC000466668653 388120276 /nfs/dbraw/zinc/12/02/76/388120276.db2.gz DKMTULHDMWMIKG-CYBMUJFWSA-N 1 1 229.433 3.640 20 0 BHADMO CSCCC[N@H+]1CCCC[C@H]1CC(C)C ZINC000466668654 388120229 /nfs/dbraw/zinc/12/02/29/388120229.db2.gz DKMTULHDMWMIKG-ZDUSSCGKSA-N 1 1 229.433 3.640 20 0 BHADMO COc1cccc(CCC[N@@H+]2[C@H](C)CC[C@@H]2C)c1 ZINC000466673555 388120723 /nfs/dbraw/zinc/12/07/23/388120723.db2.gz STGBAKPCWLDYDJ-OKILXGFUSA-N 1 1 247.382 3.501 20 0 BHADMO C[C@@H]1CC[C@H](C)[N@@H+]1CCCCOc1ccccc1 ZINC000466673558 534227352 /nfs/dbraw/zinc/22/73/52/534227352.db2.gz STWYDUJYOFOGFT-GASCZTMLSA-N 1 1 247.382 3.718 20 0 BHADMO C[C@@H]1CC[C@H](C)[N@@H+]1CCOC1CCCCCC1 ZINC000466675584 538549721 /nfs/dbraw/zinc/54/97/21/538549721.db2.gz IFYWOJHCQHHQDK-OKILXGFUSA-N 1 1 239.403 3.599 20 0 BHADMO COCCCCC[N@H+]1CCCC[C@H]1CC(C)C ZINC000466686789 388120692 /nfs/dbraw/zinc/12/06/92/388120692.db2.gz PVQWJRSFDNMPMD-HNNXBMFYSA-N 1 1 241.419 3.704 20 0 BHADMO COCCCCC[N@H+]1CCCC[C@@H]1CC(C)C ZINC000466686790 225000131 /nfs/dbraw/zinc/00/01/31/225000131.db2.gz PVQWJRSFDNMPMD-OAHLLOKOSA-N 1 1 241.419 3.704 20 0 BHADMO CC(C)C[C@@H]1CCCC[N@H+]1CCCOC(C)C ZINC000466687399 388120306 /nfs/dbraw/zinc/12/03/06/388120306.db2.gz WQQLMSUOQSYRNT-HNNXBMFYSA-N 1 1 241.419 3.702 20 0 BHADMO CC(C)C[C@H]1CCCC[N@H+]1CCCOC(C)C ZINC000466687400 388120752 /nfs/dbraw/zinc/12/07/52/388120752.db2.gz WQQLMSUOQSYRNT-OAHLLOKOSA-N 1 1 241.419 3.702 20 0 BHADMO CC(C)C[C@@H]1CC[N@@H+](CC2CCCC2)C1 ZINC000466705914 528388059 /nfs/dbraw/zinc/38/80/59/528388059.db2.gz BCFFQAKAXYYIID-AWEZNQCLSA-N 1 1 209.377 3.545 20 0 BHADMO CC(C)C[C@H]1CC[N@@H+](CC2CCCC2)C1 ZINC000466705915 388120973 /nfs/dbraw/zinc/12/09/73/388120973.db2.gz BCFFQAKAXYYIID-CQSZACIVSA-N 1 1 209.377 3.545 20 0 BHADMO CC(C)C[C@@H]1CC[N@@H+](Cc2ccc(F)cc2)C1 ZINC000466706170 388121455 /nfs/dbraw/zinc/12/14/55/388121455.db2.gz BRZKCYIVMPIUCM-AWEZNQCLSA-N 1 1 235.346 3.694 20 0 BHADMO CC(C)C[C@H]1CC[N@@H+](Cc2ccc(F)cc2)C1 ZINC000466706209 388121008 /nfs/dbraw/zinc/12/10/08/388121008.db2.gz BRZKCYIVMPIUCM-CQSZACIVSA-N 1 1 235.346 3.694 20 0 BHADMO CC(C)C[C@@H]1CC[N@@H+](Cc2cccc(F)c2)C1 ZINC000466723244 528388839 /nfs/dbraw/zinc/38/88/39/528388839.db2.gz RQEUPEJRJAOKHN-AWEZNQCLSA-N 1 1 235.346 3.694 20 0 BHADMO CC(C)C[C@H]1CC[N@@H+](Cc2cccc(F)c2)C1 ZINC000466723245 528596242 /nfs/dbraw/zinc/59/62/42/528596242.db2.gz RQEUPEJRJAOKHN-CQSZACIVSA-N 1 1 235.346 3.694 20 0 BHADMO CC(C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000466728276 528388926 /nfs/dbraw/zinc/38/89/26/528388926.db2.gz NENICMYTCLIUKW-HNNXBMFYSA-N 1 1 217.356 3.555 20 0 BHADMO CC(C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000466728277 528596329 /nfs/dbraw/zinc/59/63/29/528596329.db2.gz NENICMYTCLIUKW-OAHLLOKOSA-N 1 1 217.356 3.555 20 0 BHADMO CC(C)C[C@H]1CC[N@@H+](Cc2ccccc2F)C1 ZINC000466731429 528595770 /nfs/dbraw/zinc/59/57/70/528595770.db2.gz NQAFYIWZPFDZAO-CYBMUJFWSA-N 1 1 235.346 3.694 20 0 BHADMO CC(C)C[C@@H]1CC[N@@H+](Cc2ccccc2F)C1 ZINC000466731430 528388900 /nfs/dbraw/zinc/38/89/00/528388900.db2.gz NQAFYIWZPFDZAO-ZDUSSCGKSA-N 1 1 235.346 3.694 20 0 BHADMO COc1cccc(C[N@H+]2CC[C@@H](CC(C)C)C2)c1 ZINC000466732524 533483294 /nfs/dbraw/zinc/48/32/94/533483294.db2.gz FMMKCRNWKMHZAP-HNNXBMFYSA-N 1 1 247.382 3.563 20 0 BHADMO COc1cccc(C[N@H+]2CC[C@H](CC(C)C)C2)c1 ZINC000466732525 388121031 /nfs/dbraw/zinc/12/10/31/388121031.db2.gz FMMKCRNWKMHZAP-OAHLLOKOSA-N 1 1 247.382 3.563 20 0 BHADMO CC/C=C\CC[N@@H+](C)[C@H](C)Cc1ccc(O)cc1 ZINC000466801387 528787299 /nfs/dbraw/zinc/78/72/99/528787299.db2.gz LOOGNIPCNIVPMD-GEXIGZQTSA-N 1 1 247.382 3.611 20 0 BHADMO CC/C=C\CC[N@@H+](C)[C@@H](C)Cc1ccc(O)cc1 ZINC000466801588 528787730 /nfs/dbraw/zinc/78/77/30/528787730.db2.gz LOOGNIPCNIVPMD-GXMNPTEKSA-N 1 1 247.382 3.611 20 0 BHADMO CC/C=C\CC[N@H+]1CCS[C@@H]2CCCC[C@H]21 ZINC000466801983 528789157 /nfs/dbraw/zinc/78/91/57/528789157.db2.gz NKJPNOQKUFSDGM-JHZNUDOXSA-N 1 1 239.428 3.703 20 0 BHADMO CC/C=C\CC[N@H+]1CCS[C@@H]2CCCC[C@@H]21 ZINC000466801984 528789189 /nfs/dbraw/zinc/78/91/89/528789189.db2.gz NKJPNOQKUFSDGM-KBIGUFJUSA-N 1 1 239.428 3.703 20 0 BHADMO CC/C=C/CC[N@H+]1CCS[C@@H]2CCCC[C@H]21 ZINC000466801985 528771787 /nfs/dbraw/zinc/77/17/87/528771787.db2.gz NKJPNOQKUFSDGM-LSMGEYOZSA-N 1 1 239.428 3.703 20 0 BHADMO CC/C=C/CC[N@H+]1CCS[C@@H]2CCCC[C@@H]21 ZINC000466801986 528772020 /nfs/dbraw/zinc/77/20/20/528772020.db2.gz NKJPNOQKUFSDGM-PUWCWTCHSA-N 1 1 239.428 3.703 20 0 BHADMO CC/C=C/CC[N@H+](C)[C@@H]1CC[C@H](SCC)C1 ZINC000466802022 528770223 /nfs/dbraw/zinc/77/02/23/528770223.db2.gz OMBQLWROWAZAGK-AFJNRPGYSA-N 1 1 241.444 3.949 20 0 BHADMO CC/C=C/CC[N@H+](C)[C@@H]1CC[C@@H](SCC)C1 ZINC000466802023 528768737 /nfs/dbraw/zinc/76/87/37/528768737.db2.gz OMBQLWROWAZAGK-JLVOYYQZSA-N 1 1 241.444 3.949 20 0 BHADMO CC/C=C\CC[N@H+](C)[C@@H]1CC[C@H](SCC)C1 ZINC000466802024 528788095 /nfs/dbraw/zinc/78/80/95/528788095.db2.gz OMBQLWROWAZAGK-WJDZFGBRSA-N 1 1 241.444 3.949 20 0 BHADMO CC/C=C\CC[N@H+](C)[C@@H]1CC[C@@H](SCC)C1 ZINC000466802025 384802751 /nfs/dbraw/zinc/80/27/51/384802751.db2.gz OMBQLWROWAZAGK-YOIVVXPQSA-N 1 1 241.444 3.949 20 0 BHADMO CC/C=C\CC[N@H+]1CCC[C@@H]2CCC[C@H]21 ZINC000466802652 528789409 /nfs/dbraw/zinc/78/94/09/528789409.db2.gz QEMFASRAZKTEDQ-KBIGUFJUSA-N 1 1 207.361 3.607 20 0 BHADMO CC/C=C\CC[N@H+]1CCC[C@@H]2CCC[C@@H]21 ZINC000466802653 528789713 /nfs/dbraw/zinc/78/97/13/528789713.db2.gz QEMFASRAZKTEDQ-NMEQGOOXSA-N 1 1 207.361 3.607 20 0 BHADMO CC/C=C/CC[N@H+]1CCC[C@@H]2CCC[C@@H]21 ZINC000466802654 528770593 /nfs/dbraw/zinc/77/05/93/528770593.db2.gz QEMFASRAZKTEDQ-NVFZZLLCSA-N 1 1 207.361 3.607 20 0 BHADMO CC/C=C/CC[N@H+]1CCC[C@@H]2CCC[C@H]21 ZINC000466802655 528770020 /nfs/dbraw/zinc/77/00/20/528770020.db2.gz QEMFASRAZKTEDQ-PUWCWTCHSA-N 1 1 207.361 3.607 20 0 BHADMO CC/C=C/CC[N@@H+](C)CCc1ccccc1OC ZINC000466803056 528768660 /nfs/dbraw/zinc/76/86/60/528768660.db2.gz AIHDRAFMSJYNRN-AATRIKPKSA-N 1 1 247.382 3.526 20 0 BHADMO CC/C=C\CC[N@@H+](C)CCc1ccccc1OC ZINC000466803058 528787999 /nfs/dbraw/zinc/78/79/99/528787999.db2.gz AIHDRAFMSJYNRN-WAYWQWQTSA-N 1 1 247.382 3.526 20 0 BHADMO CC/C=C/CC[N@@H+](C(C)C)C1CCCC1 ZINC000466804205 528768167 /nfs/dbraw/zinc/76/81/67/528768167.db2.gz VACBHPUNAPXHKC-AATRIKPKSA-N 1 1 209.377 3.996 20 0 BHADMO CC/C=C\CC[N@@H+](C(C)C)C1CCCC1 ZINC000466804206 528787802 /nfs/dbraw/zinc/78/78/02/528787802.db2.gz VACBHPUNAPXHKC-WAYWQWQTSA-N 1 1 209.377 3.996 20 0 BHADMO CC/C=C/CC[N@@H+](C)Cc1ccc(C)s1 ZINC000466808952 528769112 /nfs/dbraw/zinc/76/91/12/528769112.db2.gz JVVNJHHGTWACBN-AATRIKPKSA-N 1 1 223.385 3.845 20 0 BHADMO CC/C=C\CC[N@@H+](C)Cc1ccc(C)s1 ZINC000466808953 528788149 /nfs/dbraw/zinc/78/81/49/528788149.db2.gz JVVNJHHGTWACBN-WAYWQWQTSA-N 1 1 223.385 3.845 20 0 BHADMO CC/C=C\CC[N@H+]1CC[C@@H]1c1ccccc1 ZINC000466812970 528789843 /nfs/dbraw/zinc/78/98/43/528789843.db2.gz BZEZYHJCBZCIJQ-ABCZVMIZSA-N 1 1 215.340 3.790 20 0 BHADMO CC/C=C/CC[N@H+]1CC[C@H]1c1ccccc1 ZINC000466812971 528771326 /nfs/dbraw/zinc/77/13/26/528771326.db2.gz BZEZYHJCBZCIJQ-BWPKMQGJSA-N 1 1 215.340 3.790 20 0 BHADMO CC/C=C\CC[N@H+]1CC[C@H]1c1ccccc1 ZINC000466812972 528790303 /nfs/dbraw/zinc/79/03/03/528790303.db2.gz BZEZYHJCBZCIJQ-JZIMQPMSSA-N 1 1 215.340 3.790 20 0 BHADMO CC/C=C/CC[N@H+]1CC[C@@H]1c1ccccc1 ZINC000466812973 528772000 /nfs/dbraw/zinc/77/20/00/528772000.db2.gz BZEZYHJCBZCIJQ-NHZBNJEXSA-N 1 1 215.340 3.790 20 0 BHADMO CC/C=C/CC[N@H+]1CCCC[C@H]1c1cccn1C ZINC000466822339 528769871 /nfs/dbraw/zinc/76/98/71/528769871.db2.gz BPNVIOFETLGEIK-APHBUQMISA-N 1 1 246.398 3.908 20 0 BHADMO CC/C=C\CC[N@H+]1CCCC[C@H]1c1cccn1C ZINC000466822340 528789338 /nfs/dbraw/zinc/78/93/38/528789338.db2.gz BPNVIOFETLGEIK-AWFCHZOYSA-N 1 1 246.398 3.908 20 0 BHADMO CC/C=C/CC[N@H+]1CCCC[C@@H]1c1cccn1C ZINC000466822342 528769794 /nfs/dbraw/zinc/76/97/94/528769794.db2.gz BPNVIOFETLGEIK-DWTRPJMMSA-N 1 1 246.398 3.908 20 0 BHADMO CC/C=C\CC[N@H+]1CCCC[C@@H]1c1cccn1C ZINC000466822344 528789112 /nfs/dbraw/zinc/78/91/12/528789112.db2.gz BPNVIOFETLGEIK-YIEVGGLXSA-N 1 1 246.398 3.908 20 0 BHADMO CC/C=C\CC[N@H+](CCC)C[C@H]1CCCCO1 ZINC000466822930 528789854 /nfs/dbraw/zinc/78/98/54/528789854.db2.gz NXHDSJPRMFPVOQ-IYKSTZQJSA-N 1 1 239.403 3.624 20 0 BHADMO CC/C=C/CC[N@H+](CCC)C[C@H]1CCCCO1 ZINC000466822931 528770043 /nfs/dbraw/zinc/77/00/43/528770043.db2.gz NXHDSJPRMFPVOQ-LLYBFZRZSA-N 1 1 239.403 3.624 20 0 BHADMO CC/C=C/CC[N@H+](CCC)C[C@@H]1CCCCO1 ZINC000466822933 528770742 /nfs/dbraw/zinc/77/07/42/528770742.db2.gz NXHDSJPRMFPVOQ-NFAHFFEMSA-N 1 1 239.403 3.624 20 0 BHADMO CC/C=C\CC[N@H+](CCC)C[C@@H]1CCCCO1 ZINC000466822934 528789833 /nfs/dbraw/zinc/78/98/33/528789833.db2.gz NXHDSJPRMFPVOQ-YVACAVLKSA-N 1 1 239.403 3.624 20 0 BHADMO CC/C=C\CC[N@H+]1Cc2ccccc2[C@H]1C ZINC000466823504 528790267 /nfs/dbraw/zinc/79/02/67/528790267.db2.gz GGZIHXZPWQQJAA-DSYXLKISSA-N 1 1 215.340 3.920 20 0 BHADMO CC/C=C/CC[N@H+]1Cc2ccccc2[C@H]1C ZINC000466823507 528771524 /nfs/dbraw/zinc/77/15/24/528771524.db2.gz GGZIHXZPWQQJAA-MUBLQREKSA-N 1 1 215.340 3.920 20 0 BHADMO CC/C=C\CC[N@@H+](C)CCc1cccs1 ZINC000466826683 528788012 /nfs/dbraw/zinc/78/80/12/528788012.db2.gz SEAAHBHGQARTTF-PLNGDYQASA-N 1 1 223.385 3.579 20 0 BHADMO CC/C=C/CC[N@H+]1CC[C@H](Nc2ccccc2)C1 ZINC000466826807 528772519 /nfs/dbraw/zinc/77/25/19/528772519.db2.gz RHWOTBZLBWYQMR-CWDCEQMOSA-N 1 1 244.382 3.529 20 0 BHADMO CC/C=C\CC[N@H+]1CC[C@@H](Nc2ccccc2)C1 ZINC000466826808 528789218 /nfs/dbraw/zinc/78/92/18/528789218.db2.gz RHWOTBZLBWYQMR-MJSXRHKHSA-N 1 1 244.382 3.529 20 0 BHADMO CC/C=C/CC[N@H+]1CC[C@@H](Nc2ccccc2)C1 ZINC000466826809 528771559 /nfs/dbraw/zinc/77/15/59/528771559.db2.gz RHWOTBZLBWYQMR-QDLOVBKTSA-N 1 1 244.382 3.529 20 0 BHADMO CC/C=C\CC[N@H+]1CC[C@H](Nc2ccccc2)C1 ZINC000466826810 528789090 /nfs/dbraw/zinc/78/90/90/528789090.db2.gz RHWOTBZLBWYQMR-QGZUEGPWSA-N 1 1 244.382 3.529 20 0 BHADMO CC/C=C\CC[N@@H+](C)Cc1ccc(F)c(F)c1 ZINC000466828841 528787318 /nfs/dbraw/zinc/78/73/18/528787318.db2.gz LNZTWXGZEXRROI-PLNGDYQASA-N 1 1 239.309 3.753 20 0 BHADMO CC/C=C/CC[N@@H+](C)Cc1ccc(F)c(F)c1 ZINC000466828842 528768570 /nfs/dbraw/zinc/76/85/70/528768570.db2.gz LNZTWXGZEXRROI-SNAWJCMRSA-N 1 1 239.309 3.753 20 0 BHADMO CC/C=C\CC[N@@H+](C)Cc1ccc(F)cc1F ZINC000466829219 528788034 /nfs/dbraw/zinc/78/80/34/528788034.db2.gz QGGGUONOYLDXSJ-PLNGDYQASA-N 1 1 239.309 3.753 20 0 BHADMO CC/C=C/CC[N@@H+](C)Cc1ccc(F)cc1F ZINC000466829220 528768685 /nfs/dbraw/zinc/76/86/85/528768685.db2.gz QGGGUONOYLDXSJ-SNAWJCMRSA-N 1 1 239.309 3.753 20 0 BHADMO CC/C=C/CC[N@@H+]([C@@H](C)C1CC1)C1CC1 ZINC000466829939 528770153 /nfs/dbraw/zinc/77/01/53/528770153.db2.gz AGIMXUREUVYMAW-ITKZLYELSA-N 1 1 207.361 3.606 20 0 BHADMO CC/C=C\CC[N@@H+]([C@H](C)C1CC1)C1CC1 ZINC000466829940 528788894 /nfs/dbraw/zinc/78/88/94/528788894.db2.gz AGIMXUREUVYMAW-QMAVJUDZSA-N 1 1 207.361 3.606 20 0 BHADMO CC/C=C\CC[N@@H+]([C@@H](C)C1CC1)C1CC1 ZINC000466829941 528789432 /nfs/dbraw/zinc/78/94/32/528789432.db2.gz AGIMXUREUVYMAW-RXNFCKPNSA-N 1 1 207.361 3.606 20 0 BHADMO CC/C=C/CC[N@@H+]([C@H](C)C1CC1)C1CC1 ZINC000466829942 528769554 /nfs/dbraw/zinc/76/95/54/528769554.db2.gz AGIMXUREUVYMAW-ZYOFXKKJSA-N 1 1 207.361 3.606 20 0 BHADMO CC/C=C\CC[N@@H+](C)CCc1ccccc1 ZINC000466830720 528787653 /nfs/dbraw/zinc/78/76/53/528787653.db2.gz ICPRWLJDKLSCMA-PLNGDYQASA-N 1 1 217.356 3.517 20 0 BHADMO CC/C=C/CC[N@@H+](C)CCc1ccccc1 ZINC000466830721 528768501 /nfs/dbraw/zinc/76/85/01/528768501.db2.gz ICPRWLJDKLSCMA-SNAWJCMRSA-N 1 1 217.356 3.517 20 0 BHADMO CC/C=C\CC[N@@H+](C)Cc1ccccc1F ZINC000466830928 528788320 /nfs/dbraw/zinc/78/83/20/528788320.db2.gz JIMODVLECCSTTH-PLNGDYQASA-N 1 1 221.319 3.614 20 0 BHADMO CC/C=C/CC[N@@H+](C)Cc1ccccc1F ZINC000466830929 528768341 /nfs/dbraw/zinc/76/83/41/528768341.db2.gz JIMODVLECCSTTH-SNAWJCMRSA-N 1 1 221.319 3.614 20 0 BHADMO CC/C=C\CC[N@H+]1CCC[C@H](C(F)(F)F)C1 ZINC000466831268 528788990 /nfs/dbraw/zinc/78/89/90/528788990.db2.gz LXJOUUREGIKMKE-BYCRGOAPSA-N 1 1 235.293 3.617 20 0 BHADMO CC/C=C\CC[N@H+]1CCC[C@@H](C(F)(F)F)C1 ZINC000466831269 528789857 /nfs/dbraw/zinc/78/98/57/528789857.db2.gz LXJOUUREGIKMKE-DLRQAJBASA-N 1 1 235.293 3.617 20 0 BHADMO CC/C=C\CC[N@@H+](C)CCc1ccc(F)cc1 ZINC000466834981 528787906 /nfs/dbraw/zinc/78/79/06/528787906.db2.gz MDEWXYURHSMJEZ-PLNGDYQASA-N 1 1 235.346 3.656 20 0 BHADMO CC/C=C/CC[N@@H+](C)CCc1ccc(F)cc1 ZINC000466834982 528768717 /nfs/dbraw/zinc/76/87/17/528768717.db2.gz MDEWXYURHSMJEZ-SNAWJCMRSA-N 1 1 235.346 3.656 20 0 BHADMO CC/C=C/CC[N@@H+](C)Cc1sccc1C ZINC000466836096 528768376 /nfs/dbraw/zinc/76/83/76/528768376.db2.gz RTXJPWBTMCMSOW-AATRIKPKSA-N 1 1 223.385 3.845 20 0 BHADMO CC/C=C\CC[N@@H+](C)Cc1sccc1C ZINC000466836097 528787593 /nfs/dbraw/zinc/78/75/93/528787593.db2.gz RTXJPWBTMCMSOW-WAYWQWQTSA-N 1 1 223.385 3.845 20 0 BHADMO CC/C=C/CC[N@@H+](CC)Cc1cccs1 ZINC000466838649 528770124 /nfs/dbraw/zinc/77/01/24/528770124.db2.gz RWHKOLYQHGVBKK-AATRIKPKSA-N 1 1 223.385 3.926 20 0 BHADMO CC/C=C\CC[N@@H+](CC)Cc1cccs1 ZINC000466838650 528787917 /nfs/dbraw/zinc/78/79/17/528787917.db2.gz RWHKOLYQHGVBKK-WAYWQWQTSA-N 1 1 223.385 3.926 20 0 BHADMO CC/C=C\CC[N@@H+](C)Cc1ccc(F)cc1 ZINC000466841209 528788237 /nfs/dbraw/zinc/78/82/37/528788237.db2.gz MFLSNXWNZMVKBQ-PLNGDYQASA-N 1 1 221.319 3.614 20 0 BHADMO CC/C=C/CC[N@@H+](C)Cc1ccc(F)cc1 ZINC000466841210 528768799 /nfs/dbraw/zinc/76/87/99/528768799.db2.gz MFLSNXWNZMVKBQ-SNAWJCMRSA-N 1 1 221.319 3.614 20 0 BHADMO CC/C=C/CC[N@@H+](CC)CCc1cccs1 ZINC000466841681 528770056 /nfs/dbraw/zinc/77/00/56/528770056.db2.gz NGNPVCDNAZMDPH-AATRIKPKSA-N 1 1 237.412 3.969 20 0 BHADMO CC/C=C\CC[N@@H+](CC)CCc1cccs1 ZINC000466841682 528787338 /nfs/dbraw/zinc/78/73/38/528787338.db2.gz NGNPVCDNAZMDPH-WAYWQWQTSA-N 1 1 237.412 3.969 20 0 BHADMO CC/C=C\CC[N@@H+](C)Cc1cccc(F)c1 ZINC000466845411 528788331 /nfs/dbraw/zinc/78/83/31/528788331.db2.gz ZDMSPGFXDNITIF-PLNGDYQASA-N 1 1 221.319 3.614 20 0 BHADMO CC/C=C/CC[N@@H+](C)Cc1cccc(F)c1 ZINC000466845412 528768872 /nfs/dbraw/zinc/76/88/72/528768872.db2.gz ZDMSPGFXDNITIF-SNAWJCMRSA-N 1 1 221.319 3.614 20 0 BHADMO CC[C@@H]1C[C@@H](C)C[N@H+]1C/C=C/c1ccccc1 ZINC000466910656 529422760 /nfs/dbraw/zinc/42/27/60/529422760.db2.gz IWUQPHOYOSOONR-GZSUAUOCSA-N 1 1 229.367 3.820 20 0 BHADMO CC[C@@H]1C[C@H](C)C[N@H+]1C/C=C/c1ccccc1 ZINC000466910657 529439250 /nfs/dbraw/zinc/43/92/50/529439250.db2.gz IWUQPHOYOSOONR-IZBMSUHZSA-N 1 1 229.367 3.820 20 0 BHADMO CC[C@@H]1C[C@@H](C)C[N@H+]1C/C=C\c1ccccc1 ZINC000466910658 529422810 /nfs/dbraw/zinc/42/28/10/529422810.db2.gz IWUQPHOYOSOONR-RBWKAQPHSA-N 1 1 229.367 3.820 20 0 BHADMO CC[C@@H]1C[C@H](C)C[N@H+]1C/C=C\c1ccccc1 ZINC000466910659 529439493 /nfs/dbraw/zinc/43/94/93/529439493.db2.gz IWUQPHOYOSOONR-UUMOCBLWSA-N 1 1 229.367 3.820 20 0 BHADMO CC[C@@H]1C[C@@H](C)C[N@H+]1Cc1cccc(Cl)c1 ZINC000466912741 529423228 /nfs/dbraw/zinc/42/32/28/529423228.db2.gz NBZVFYCKPRSVSA-BXUZGUMPSA-N 1 1 237.774 3.960 20 0 BHADMO CC[C@H]1C[C@H](C)C[N@H+]1Cc1cccc(Cl)c1 ZINC000466912742 529325696 /nfs/dbraw/zinc/32/56/96/529325696.db2.gz NBZVFYCKPRSVSA-FZMZJTMJSA-N 1 1 237.774 3.960 20 0 BHADMO CC[C@H]1C[C@@H](C)C[N@H+]1Cc1cccc(Cl)c1 ZINC000466912743 529316473 /nfs/dbraw/zinc/31/64/73/529316473.db2.gz NBZVFYCKPRSVSA-RISCZKNCSA-N 1 1 237.774 3.960 20 0 BHADMO CC[C@@H]1C[C@H](C)C[N@H+]1Cc1cccc(Cl)c1 ZINC000466912744 529439945 /nfs/dbraw/zinc/43/99/45/529439945.db2.gz NBZVFYCKPRSVSA-SMDDNHRTSA-N 1 1 237.774 3.960 20 0 BHADMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCCOc1ccccc1 ZINC000466915123 533828417 /nfs/dbraw/zinc/82/84/17/533828417.db2.gz GDGBAEZVISSWBD-GASCZTMLSA-N 1 1 247.382 3.718 20 0 BHADMO CC[C@H]1C[C@H](C)C[N@H+]1Cc1cc(C)sc1C ZINC000466915832 529325711 /nfs/dbraw/zinc/32/57/11/529325711.db2.gz MWWMFNRYMJSXDI-HZMBPMFUSA-N 1 1 237.412 3.985 20 0 BHADMO CC[C@@H]1C[C@H](C)C[N@H+]1Cc1cc(C)sc1C ZINC000466915833 529439577 /nfs/dbraw/zinc/43/95/77/529439577.db2.gz MWWMFNRYMJSXDI-IINYFYTJSA-N 1 1 237.412 3.985 20 0 BHADMO CC[C@@H]1C[C@@H](C)C[N@H+]1Cc1cc(C)sc1C ZINC000466915834 529423386 /nfs/dbraw/zinc/42/33/86/529423386.db2.gz MWWMFNRYMJSXDI-QMTHXVAHSA-N 1 1 237.412 3.985 20 0 BHADMO CC[C@H]1C[C@@H](C)C[N@H+]1Cc1cc(C)sc1C ZINC000466915835 529316341 /nfs/dbraw/zinc/31/63/41/529316341.db2.gz MWWMFNRYMJSXDI-YGRLFVJLSA-N 1 1 237.412 3.985 20 0 BHADMO CC[C@H]1C[C@@H](C)C[N@H+]1CCCOc1ccccc1 ZINC000466916226 529316444 /nfs/dbraw/zinc/31/64/44/529316444.db2.gz QGRGKMHFXHYEDF-CABCVRRESA-N 1 1 247.382 3.576 20 0 BHADMO CC[C@H]1C[C@H](C)C[N@H+]1CCCOc1ccccc1 ZINC000466916227 529325484 /nfs/dbraw/zinc/32/54/84/529325484.db2.gz QGRGKMHFXHYEDF-GJZGRUSLSA-N 1 1 247.382 3.576 20 0 BHADMO CC[C@@H]1C[C@@H](C)C[N@H+]1CCCOc1ccccc1 ZINC000466916228 529423362 /nfs/dbraw/zinc/42/33/62/529423362.db2.gz QGRGKMHFXHYEDF-HUUCEWRRSA-N 1 1 247.382 3.576 20 0 BHADMO CC[C@@H]1C[C@H](C)C[N@H+]1CCCOc1ccccc1 ZINC000466916229 529439269 /nfs/dbraw/zinc/43/92/69/529439269.db2.gz QGRGKMHFXHYEDF-LSDHHAIUSA-N 1 1 247.382 3.576 20 0 BHADMO C[C@@H]1CCC[C@H](C)[N@@H+]1CC1CCCCC1 ZINC000466916612 225003923 /nfs/dbraw/zinc/00/39/23/225003923.db2.gz JVNCFTDWRARJFM-BETUJISGSA-N 1 1 209.377 3.830 20 0 BHADMO CC[C@H]1C[C@@H](C)C[N@H+]1Cc1ccccc1C ZINC000466920632 529316411 /nfs/dbraw/zinc/31/64/11/529316411.db2.gz RHIOMDUMTWPDNA-DOMZBBRYSA-N 1 1 217.356 3.615 20 0 BHADMO CC[C@@H]1C[C@@H](C)C[N@H+]1Cc1ccccc1C ZINC000466920633 529423556 /nfs/dbraw/zinc/42/35/56/529423556.db2.gz RHIOMDUMTWPDNA-IUODEOHRSA-N 1 1 217.356 3.615 20 0 BHADMO CC[C@@H]1C[C@H](C)C[N@H+]1Cc1ccccc1C ZINC000466920634 529439821 /nfs/dbraw/zinc/43/98/21/529439821.db2.gz RHIOMDUMTWPDNA-SWLSCSKDSA-N 1 1 217.356 3.615 20 0 BHADMO CC[C@H]1C[C@H](C)C[N@H+]1Cc1ccccc1C ZINC000466920635 529325652 /nfs/dbraw/zinc/32/56/52/529325652.db2.gz RHIOMDUMTWPDNA-WFASDCNBSA-N 1 1 217.356 3.615 20 0 BHADMO CC[C@@H]1C[C@H](C)C[N@H+]1Cc1ccc(C)cc1 ZINC000466922215 529439517 /nfs/dbraw/zinc/43/95/17/529439517.db2.gz VQKDIMCZSCIERR-DZGCQCFKSA-N 1 1 217.356 3.615 20 0 BHADMO CC[C@H]1C[C@@H](C)C[N@H+]1Cc1ccc(C)cc1 ZINC000466922216 529316384 /nfs/dbraw/zinc/31/63/84/529316384.db2.gz VQKDIMCZSCIERR-HIFRSBDPSA-N 1 1 217.356 3.615 20 0 BHADMO CC[C@@H]1C[C@@H](C)C[N@H+]1Cc1ccc(C)cc1 ZINC000466922217 529423243 /nfs/dbraw/zinc/42/32/43/529423243.db2.gz VQKDIMCZSCIERR-UKRRQHHQSA-N 1 1 217.356 3.615 20 0 BHADMO CC[C@H]1C[C@H](C)C[N@H+]1Cc1ccc(C)cc1 ZINC000466922218 529325418 /nfs/dbraw/zinc/32/54/18/529325418.db2.gz VQKDIMCZSCIERR-ZFWWWQNUSA-N 1 1 217.356 3.615 20 0 BHADMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCC1CCCC1 ZINC000466924244 533827244 /nfs/dbraw/zinc/82/72/44/533827244.db2.gz PGWXMIQBSKTYNU-BETUJISGSA-N 1 1 209.377 3.830 20 0 BHADMO CC[C@@H]1C[C@@H](C)C[N@H+]1CCCc1ccccc1 ZINC000466926715 529423530 /nfs/dbraw/zinc/42/35/30/529423530.db2.gz MGSBCXLFPCRRME-GDBMZVCRSA-N 1 1 231.383 3.740 20 0 BHADMO CC[C@@H]1C[C@H](C)C[N@H+]1CCCc1ccccc1 ZINC000466926716 529439420 /nfs/dbraw/zinc/43/94/20/529439420.db2.gz MGSBCXLFPCRRME-GOEBONIOSA-N 1 1 231.383 3.740 20 0 BHADMO CC[C@H]1C[C@H](C)C[N@H+]1CCCc1ccccc1 ZINC000466926717 529325548 /nfs/dbraw/zinc/32/55/48/529325548.db2.gz MGSBCXLFPCRRME-HOCLYGCPSA-N 1 1 231.383 3.740 20 0 BHADMO CC[C@H]1C[C@@H](C)C[N@H+]1CCCc1ccccc1 ZINC000466926718 529316166 /nfs/dbraw/zinc/31/61/66/529316166.db2.gz MGSBCXLFPCRRME-ZBFHGGJFSA-N 1 1 231.383 3.740 20 0 BHADMO CC[C@@H]1C[C@@H](C)C[N@H+]1Cc1ccc(Cl)cc1 ZINC000466927024 529423435 /nfs/dbraw/zinc/42/34/35/529423435.db2.gz WXLKINJWLYYUCP-BXUZGUMPSA-N 1 1 237.774 3.960 20 0 BHADMO CC[C@H]1C[C@H](C)C[N@H+]1Cc1ccc(Cl)cc1 ZINC000466927025 529325520 /nfs/dbraw/zinc/32/55/20/529325520.db2.gz WXLKINJWLYYUCP-FZMZJTMJSA-N 1 1 237.774 3.960 20 0 BHADMO CC[C@H]1C[C@@H](C)C[N@H+]1Cc1ccc(Cl)cc1 ZINC000466927026 529316549 /nfs/dbraw/zinc/31/65/49/529316549.db2.gz WXLKINJWLYYUCP-RISCZKNCSA-N 1 1 237.774 3.960 20 0 BHADMO CC[C@@H]1C[C@H](C)C[N@H+]1Cc1ccc(Cl)cc1 ZINC000466927027 529439395 /nfs/dbraw/zinc/43/93/95/529439395.db2.gz WXLKINJWLYYUCP-SMDDNHRTSA-N 1 1 237.774 3.960 20 0 BHADMO C[C@@H]1CCC[C@H](C)[N@@H+]1C/C=C\c1ccccc1 ZINC000466927603 225004363 /nfs/dbraw/zinc/00/43/63/225004363.db2.gz RXFRIYRYYAKGFV-MCDRHDKESA-N 1 1 229.367 3.963 20 0 BHADMO C[C@@H]1CCC[C@H](C)[N@@H+]1C/C=C/c1ccccc1 ZINC000466927604 225004274 /nfs/dbraw/zinc/00/42/74/225004274.db2.gz RXFRIYRYYAKGFV-QVHFTPCNSA-N 1 1 229.367 3.963 20 0 BHADMO CC[C@@H]1C[C@H](C)C[N@H+]1Cc1cccc(C)c1 ZINC000466928689 529439746 /nfs/dbraw/zinc/43/97/46/529439746.db2.gz HIYFIYSVSVZKEI-DZGCQCFKSA-N 1 1 217.356 3.615 20 0 BHADMO CC[C@H]1C[C@@H](C)C[N@H+]1Cc1cccc(C)c1 ZINC000466928690 529316142 /nfs/dbraw/zinc/31/61/42/529316142.db2.gz HIYFIYSVSVZKEI-HIFRSBDPSA-N 1 1 217.356 3.615 20 0 BHADMO CC[C@@H]1C[C@@H](C)C[N@H+]1Cc1cccc(C)c1 ZINC000466928691 529423431 /nfs/dbraw/zinc/42/34/31/529423431.db2.gz HIYFIYSVSVZKEI-UKRRQHHQSA-N 1 1 217.356 3.615 20 0 BHADMO CC[C@H]1C[C@H](C)C[N@H+]1Cc1cccc(C)c1 ZINC000466928692 529325598 /nfs/dbraw/zinc/32/55/98/529325598.db2.gz HIYFIYSVSVZKEI-ZFWWWQNUSA-N 1 1 217.356 3.615 20 0 BHADMO CC[C@@H]1C[C@H](C)C[N@H+]1CC1CCCCC1 ZINC000466930113 529439413 /nfs/dbraw/zinc/43/94/13/529439413.db2.gz FYFOBDNJFYBJCS-GXTWGEPZSA-N 1 1 209.377 3.687 20 0 BHADMO CC[C@H]1C[C@H](C)C[N@H+]1CC1CCCCC1 ZINC000466930114 529325794 /nfs/dbraw/zinc/32/57/94/529325794.db2.gz FYFOBDNJFYBJCS-JSGCOSHPSA-N 1 1 209.377 3.687 20 0 BHADMO CC[C@H]1C[C@@H](C)C[N@H+]1CC1CCCCC1 ZINC000466930115 529316371 /nfs/dbraw/zinc/31/63/71/529316371.db2.gz FYFOBDNJFYBJCS-OCCSQVGLSA-N 1 1 209.377 3.687 20 0 BHADMO CC[C@@H]1C[C@@H](C)C[N@H+]1CC1CCCCC1 ZINC000466930116 529422855 /nfs/dbraw/zinc/42/28/55/529422855.db2.gz FYFOBDNJFYBJCS-TZMCWYRMSA-N 1 1 209.377 3.687 20 0 BHADMO CC[C@H]1C[C@H](C)C[N@H+]1CCSc1ccccc1 ZINC000466930899 529325666 /nfs/dbraw/zinc/32/56/66/529325666.db2.gz MMQXKTXHBUIIPS-KBPBESRZSA-N 1 1 249.423 3.899 20 0 BHADMO CC[C@H]1C[C@@H](C)C[N@H+]1CCSc1ccccc1 ZINC000466930900 529316566 /nfs/dbraw/zinc/31/65/66/529316566.db2.gz MMQXKTXHBUIIPS-KGLIPLIRSA-N 1 1 249.423 3.899 20 0 BHADMO CC[C@@H]1C[C@H](C)C[N@H+]1CCSc1ccccc1 ZINC000466930901 529439478 /nfs/dbraw/zinc/43/94/78/529439478.db2.gz MMQXKTXHBUIIPS-UONOGXRCSA-N 1 1 249.423 3.899 20 0 BHADMO CC[C@@H]1C[C@@H](C)C[N@H+]1CCSc1ccccc1 ZINC000466930902 529423540 /nfs/dbraw/zinc/42/35/40/529423540.db2.gz MMQXKTXHBUIIPS-ZIAGYGMSSA-N 1 1 249.423 3.899 20 0 BHADMO CC[C@@H]1C[C@@H](C)C[N@H+]1C[C@@H](C)c1ccccc1 ZINC000466933531 529423206 /nfs/dbraw/zinc/42/32/06/529423206.db2.gz QZPKGXLAULJRCZ-IIAWOOMASA-N 1 1 231.383 3.911 20 0 BHADMO CC[C@@H]1C[C@@H](C)C[N@H+]1C[C@H](C)c1ccccc1 ZINC000466933532 529423354 /nfs/dbraw/zinc/42/33/54/529423354.db2.gz QZPKGXLAULJRCZ-IJEWVQPXSA-N 1 1 231.383 3.911 20 0 BHADMO CC[C@@H]1C[C@H](C)C[N@H+]1C[C@H](C)c1ccccc1 ZINC000466933533 529439591 /nfs/dbraw/zinc/43/95/91/529439591.db2.gz QZPKGXLAULJRCZ-OFQRWUPVSA-N 1 1 231.383 3.911 20 0 BHADMO CC[C@@H]1C[C@H](C)C[N@H+]1C[C@@H](C)c1ccccc1 ZINC000466933534 529439628 /nfs/dbraw/zinc/43/96/28/529439628.db2.gz QZPKGXLAULJRCZ-SQWLQELKSA-N 1 1 231.383 3.911 20 0 BHADMO CCSCC[N@H+]1Cc2ccccc2C[C@@H]1CC ZINC000466935189 529180033 /nfs/dbraw/zinc/18/00/33/529180033.db2.gz SIDRKETVAHIBCX-HNNXBMFYSA-N 1 1 249.423 3.576 20 0 BHADMO CCSCC[N@H+]1Cc2ccccc2C[C@H]1CC ZINC000466935190 529180062 /nfs/dbraw/zinc/18/00/62/529180062.db2.gz SIDRKETVAHIBCX-OAHLLOKOSA-N 1 1 249.423 3.576 20 0 BHADMO Cc1cccc(OCC[N@@H+]2[C@H](C)CCC[C@@H]2C)c1 ZINC000466935339 225003519 /nfs/dbraw/zinc/00/35/19/225003519.db2.gz IXKQPRTVXXQEHC-GASCZTMLSA-N 1 1 247.382 3.637 20 0 BHADMO CC[C@H]1C[C@H](C)C[N@H+]1Cc1ccccc1Cl ZINC000466935987 529325775 /nfs/dbraw/zinc/32/57/75/529325775.db2.gz ZDKUGWYPVNLGKU-AAEUAGOBSA-N 1 1 237.774 3.960 20 0 BHADMO CC[C@@H]1C[C@@H](C)C[N@H+]1Cc1ccccc1Cl ZINC000466935988 529423470 /nfs/dbraw/zinc/42/34/70/529423470.db2.gz ZDKUGWYPVNLGKU-DGCLKSJQSA-N 1 1 237.774 3.960 20 0 BHADMO CC[C@@H]1C[C@H](C)C[N@H+]1Cc1ccccc1Cl ZINC000466935989 529439816 /nfs/dbraw/zinc/43/98/16/529439816.db2.gz ZDKUGWYPVNLGKU-WCQYABFASA-N 1 1 237.774 3.960 20 0 BHADMO CC[C@H]1C[C@@H](C)C[N@H+]1Cc1ccccc1Cl ZINC000466935990 529316276 /nfs/dbraw/zinc/31/62/76/529316276.db2.gz ZDKUGWYPVNLGKU-YPMHNXCESA-N 1 1 237.774 3.960 20 0 BHADMO CC[C@@H]1C[C@H](C)C[N@H+]1CCC1CCCC1 ZINC000466936422 529439401 /nfs/dbraw/zinc/43/94/01/529439401.db2.gz RLQBEKIIHNFIBJ-GXTWGEPZSA-N 1 1 209.377 3.687 20 0 BHADMO CC[C@H]1C[C@H](C)C[N@H+]1CCC1CCCC1 ZINC000466936423 529325613 /nfs/dbraw/zinc/32/56/13/529325613.db2.gz RLQBEKIIHNFIBJ-JSGCOSHPSA-N 1 1 209.377 3.687 20 0 BHADMO CC[C@H]1C[C@@H](C)C[N@H+]1CCC1CCCC1 ZINC000466936424 529316438 /nfs/dbraw/zinc/31/64/38/529316438.db2.gz RLQBEKIIHNFIBJ-OCCSQVGLSA-N 1 1 209.377 3.687 20 0 BHADMO CC[C@@H]1C[C@@H](C)C[N@H+]1CCC1CCCC1 ZINC000466936425 529422972 /nfs/dbraw/zinc/42/29/72/529422972.db2.gz RLQBEKIIHNFIBJ-TZMCWYRMSA-N 1 1 209.377 3.687 20 0 BHADMO CC[N@@H+](CCC1CCCCC1)Cc1ccccn1 ZINC000466944521 528429620 /nfs/dbraw/zinc/42/96/20/528429620.db2.gz PAMUWPFGLGBZIB-UHFFFAOYSA-N 1 1 246.398 3.874 20 0 BHADMO CCC(C)(C)CC[N@H+]1CCCC[C@H](COC)C1 ZINC000467118512 528502952 /nfs/dbraw/zinc/50/29/52/528502952.db2.gz IFGLOCZZSNPVLL-AWEZNQCLSA-N 1 1 241.419 3.561 20 0 BHADMO CCC(C)(C)CC[N@H+]1CCCC[C@@H](COC)C1 ZINC000467118513 528502900 /nfs/dbraw/zinc/50/29/00/528502900.db2.gz IFGLOCZZSNPVLL-CQSZACIVSA-N 1 1 241.419 3.561 20 0 BHADMO C(C1CCCCC1)[N@H+]1CCC[C@H]2CCC[C@@H]21 ZINC000467149695 527474855 /nfs/dbraw/zinc/47/48/55/527474855.db2.gz QBGUGORMBGKYAY-CABCVRRESA-N 1 1 221.388 3.831 20 0 BHADMO C(C1CCCCC1)[N@H+]1CCC[C@@H]2CCC[C@@H]21 ZINC000467149696 527474977 /nfs/dbraw/zinc/47/49/77/527474977.db2.gz QBGUGORMBGKYAY-GJZGRUSLSA-N 1 1 221.388 3.831 20 0 BHADMO C(C1CCCCC1)[N@H+]1CCC[C@H]2CCC[C@H]21 ZINC000467149697 527475253 /nfs/dbraw/zinc/47/52/53/527475253.db2.gz QBGUGORMBGKYAY-HUUCEWRRSA-N 1 1 221.388 3.831 20 0 BHADMO C(C1CCCCC1)[N@H+]1CCC[C@@H]2CCC[C@H]21 ZINC000467149698 527475183 /nfs/dbraw/zinc/47/51/83/527475183.db2.gz QBGUGORMBGKYAY-LSDHHAIUSA-N 1 1 221.388 3.831 20 0 BHADMO Cc1cccc(C[N@H+]2[C@H](C)C[C@H]3CCCC[C@@H]32)n1 ZINC000467149825 225006609 /nfs/dbraw/zinc/00/66/09/225006609.db2.gz GZWANIIMABJJFA-FMKPAKJESA-N 1 1 244.382 3.543 20 0 BHADMO Cc1cccc(C[N@H+]2[C@H](C)C[C@H]3CCCC[C@H]32)n1 ZINC000467149826 225007802 /nfs/dbraw/zinc/00/78/02/225007802.db2.gz GZWANIIMABJJFA-IIAWOOMASA-N 1 1 244.382 3.543 20 0 BHADMO Cc1cccc(C[N@H+]2[C@H](C)C[C@@H]3CCCC[C@H]32)n1 ZINC000467149827 225007594 /nfs/dbraw/zinc/00/75/94/225007594.db2.gz GZWANIIMABJJFA-IJEWVQPXSA-N 1 1 244.382 3.543 20 0 BHADMO Cc1cccc(C[N@H+]2[C@H](C)C[C@@H]3CCCC[C@@H]32)n1 ZINC000467149828 225007581 /nfs/dbraw/zinc/00/75/81/225007581.db2.gz GZWANIIMABJJFA-YCPHGPKFSA-N 1 1 244.382 3.543 20 0 BHADMO Cc1cccc([C@@H](C)[N@@H+](C)CCC(F)(F)F)c1 ZINC000467182817 225006901 /nfs/dbraw/zinc/00/69/01/225006901.db2.gz PMFXGQBKLWULLX-LLVKDONJSA-N 1 1 245.288 3.940 20 0 BHADMO Cc1cccc([C@H](C)[N@@H+](C)CCC(F)(F)F)c1 ZINC000467182822 225007463 /nfs/dbraw/zinc/00/74/63/225007463.db2.gz PMFXGQBKLWULLX-NSHDSACASA-N 1 1 245.288 3.940 20 0 BHADMO Cc1cccc([C@@H](C)[N@@H+](C)C[C@H]2CCCCO2)c1 ZINC000467191725 225006649 /nfs/dbraw/zinc/00/66/49/225006649.db2.gz QKYUCCZNOJOJID-GDBMZVCRSA-N 1 1 247.382 3.557 20 0 BHADMO Cc1cccc([C@H](C)[N@@H+](C)C[C@H]2CCCCO2)c1 ZINC000467191726 225006835 /nfs/dbraw/zinc/00/68/35/225006835.db2.gz QKYUCCZNOJOJID-GOEBONIOSA-N 1 1 247.382 3.557 20 0 BHADMO Cc1cccc([C@H](C)[N@@H+](C)C[C@@H]2CCCCO2)c1 ZINC000467191727 225007406 /nfs/dbraw/zinc/00/74/06/225007406.db2.gz QKYUCCZNOJOJID-HOCLYGCPSA-N 1 1 247.382 3.557 20 0 BHADMO Cc1cccc([C@@H](C)[N@@H+](C)C[C@@H]2CCCCO2)c1 ZINC000467191728 225007363 /nfs/dbraw/zinc/00/73/63/225007363.db2.gz QKYUCCZNOJOJID-ZBFHGGJFSA-N 1 1 247.382 3.557 20 0 BHADMO CCC[N@@H+](CC)Cc1cccc(Cl)c1F ZINC000467194883 528003435 /nfs/dbraw/zinc/00/34/35/528003435.db2.gz FAQRFVPLRJUTBL-UHFFFAOYSA-N 1 1 229.726 3.711 20 0 BHADMO CC/C=C/CC[N@@H+](C)C[C@@H]1CC=CCC1 ZINC000467197047 528769091 /nfs/dbraw/zinc/76/90/91/528769091.db2.gz RTHBJNDGSBQIJC-ISZGNANSSA-N 1 1 207.361 3.631 20 0 BHADMO CC/C=C/CC[N@@H+](C)C[C@H]1CC=CCC1 ZINC000467197048 528768420 /nfs/dbraw/zinc/76/84/20/528768420.db2.gz RTHBJNDGSBQIJC-NNTXTVRGSA-N 1 1 207.361 3.631 20 0 BHADMO CC/C=C\CC[N@@H+](C)C[C@H]1CC=CCC1 ZINC000467197049 528787675 /nfs/dbraw/zinc/78/76/75/528787675.db2.gz RTHBJNDGSBQIJC-WSNITJDQSA-N 1 1 207.361 3.631 20 0 BHADMO CC/C=C\CC[N@@H+](C)C[C@@H]1CC=CCC1 ZINC000467197050 528787275 /nfs/dbraw/zinc/78/72/75/528787275.db2.gz RTHBJNDGSBQIJC-ZRUQZJFASA-N 1 1 207.361 3.631 20 0 BHADMO CC/C=C/CC[N@H+]1Cc2ccccc2OC[C@H]1C ZINC000467197606 528772073 /nfs/dbraw/zinc/77/20/73/528772073.db2.gz OWXDOTBQTFDJIN-ISZGNANSSA-N 1 1 245.366 3.626 20 0 BHADMO CC/C=C/CC[N@H+]1Cc2ccccc2OC[C@@H]1C ZINC000467197607 528772710 /nfs/dbraw/zinc/77/27/10/528772710.db2.gz OWXDOTBQTFDJIN-NNTXTVRGSA-N 1 1 245.366 3.626 20 0 BHADMO CC/C=C\CC[N@H+]1Cc2ccccc2OC[C@@H]1C ZINC000467197608 528790349 /nfs/dbraw/zinc/79/03/49/528790349.db2.gz OWXDOTBQTFDJIN-WSNITJDQSA-N 1 1 245.366 3.626 20 0 BHADMO CC/C=C\CC[N@H+]1Cc2ccccc2OC[C@H]1C ZINC000467197609 528790622 /nfs/dbraw/zinc/79/06/22/528790622.db2.gz OWXDOTBQTFDJIN-ZRUQZJFASA-N 1 1 245.366 3.626 20 0 BHADMO c1ccc2c(c1)C[N@H+](CC1CCCC1)CC21CC1 ZINC000467203014 225006819 /nfs/dbraw/zinc/00/68/19/225006819.db2.gz VSXFXWQTJXDAKR-UHFFFAOYSA-N 1 1 241.378 3.724 20 0 BHADMO C[N@H+](Cc1cccc(Cl)c1F)CC1CCC1 ZINC000467204418 529994194 /nfs/dbraw/zinc/99/41/94/529994194.db2.gz DFYQUSMHRDDNIW-UHFFFAOYSA-N 1 1 241.737 3.711 20 0 BHADMO COc1cccc([C@@H](C)[N@H+]2CCCC(C)(C)C2)c1 ZINC000467283315 533700788 /nfs/dbraw/zinc/70/07/88/533700788.db2.gz IHIRHQOOMGETAQ-CYBMUJFWSA-N 1 1 247.382 3.878 20 0 BHADMO COc1cccc([C@H](C)[N@H+]2CCCC(C)(C)C2)c1 ZINC000467283316 533767694 /nfs/dbraw/zinc/76/76/94/533767694.db2.gz IHIRHQOOMGETAQ-ZDUSSCGKSA-N 1 1 247.382 3.878 20 0 BHADMO CC[C@@]1(C)CCN(c2cc[nH+]c3ccsc32)C1 ZINC000467450226 529527809 /nfs/dbraw/zinc/52/78/09/529527809.db2.gz NTERULJRKXOENW-AWEZNQCLSA-N 1 1 246.379 3.923 20 0 BHADMO CC[C@]1(C)CCN(c2cc[nH+]c3ccsc32)C1 ZINC000467450227 529400895 /nfs/dbraw/zinc/40/08/95/529400895.db2.gz NTERULJRKXOENW-CQSZACIVSA-N 1 1 246.379 3.923 20 0 BHADMO C[C@@H]1C[C@@H]1C[N@H+]1CCCC[C@H]1c1ccccc1 ZINC000467549252 538624591 /nfs/dbraw/zinc/62/45/91/538624591.db2.gz XLAGEGZCSARWMF-BMFZPTHFSA-N 1 1 229.367 3.870 20 0 BHADMO C[C@@H]1C[C@@H]1C[N@H+]1CCCC[C@@H]1c1ccccc1 ZINC000467549253 538624353 /nfs/dbraw/zinc/62/43/53/538624353.db2.gz XLAGEGZCSARWMF-FVQBIDKESA-N 1 1 229.367 3.870 20 0 BHADMO C[C@@H]1C[C@H]1C[N@H+]1CCCC[C@H]1c1ccccc1 ZINC000467549254 538624455 /nfs/dbraw/zinc/62/44/55/538624455.db2.gz XLAGEGZCSARWMF-KBMXLJTQSA-N 1 1 229.367 3.870 20 0 BHADMO C[C@@H]1C[C@H]1C[N@H+]1CCCC[C@@H]1c1ccccc1 ZINC000467549255 538624622 /nfs/dbraw/zinc/62/46/22/538624622.db2.gz XLAGEGZCSARWMF-VNQPRFMTSA-N 1 1 229.367 3.870 20 0 BHADMO CSCCC[N@@H+](C)C/C(C)=C\c1ccccc1 ZINC000467551162 533562253 /nfs/dbraw/zinc/56/22/53/533562253.db2.gz AKAFJIQTEGAPON-OWBHPGMISA-N 1 1 249.423 3.775 20 0 BHADMO CSCCC[N@@H+](C)C/C(C)=C/c1ccccc1 ZINC000467551163 533562358 /nfs/dbraw/zinc/56/23/58/533562358.db2.gz AKAFJIQTEGAPON-WYMLVPIESA-N 1 1 249.423 3.775 20 0 BHADMO CC(C)CCC[N@H+]1CCC[C@@H](C(F)(F)F)C1 ZINC000467553856 527703372 /nfs/dbraw/zinc/70/33/72/527703372.db2.gz MIBVHQKETYRTDY-LLVKDONJSA-N 1 1 237.309 3.697 20 0 BHADMO CC(C)CCC[N@H+]1CCC[C@H](C(F)(F)F)C1 ZINC000467553857 527703571 /nfs/dbraw/zinc/70/35/71/527703571.db2.gz MIBVHQKETYRTDY-NSHDSACASA-N 1 1 237.309 3.697 20 0 BHADMO C[C@H]1C[C@@H](c2ccccc2)CC[N@H+]1CC1CC1 ZINC000467555836 225015352 /nfs/dbraw/zinc/01/53/52/225015352.db2.gz WKQLUVMUKBZUMC-BBRMVZONSA-N 1 1 229.367 3.665 20 0 BHADMO C[C@@H]1C[C@@H](c2ccccc2)CC[N@H+]1CC1CC1 ZINC000467555837 225014870 /nfs/dbraw/zinc/01/48/70/225014870.db2.gz WKQLUVMUKBZUMC-CJNGLKHVSA-N 1 1 229.367 3.665 20 0 BHADMO C[C@@H]1C[C@H](c2ccccc2)CC[N@H+]1CC1CC1 ZINC000467555838 533993462 /nfs/dbraw/zinc/99/34/62/533993462.db2.gz WKQLUVMUKBZUMC-CZUORRHYSA-N 1 1 229.367 3.665 20 0 BHADMO C[C@H]1C[C@H](c2ccccc2)CC[N@H+]1CC1CC1 ZINC000467555839 225014586 /nfs/dbraw/zinc/01/45/86/225014586.db2.gz WKQLUVMUKBZUMC-XJKSGUPXSA-N 1 1 229.367 3.665 20 0 BHADMO CC[C@@]1(C)CC[N@H+]([C@@H](C)c2cccc(OC)c2)C1 ZINC000468109550 529527947 /nfs/dbraw/zinc/52/79/47/529527947.db2.gz JPLDHRIDHYGPNK-BBRMVZONSA-N 1 1 247.382 3.878 20 0 BHADMO CC[C@@]1(C)CC[N@H+]([C@H](C)c2cccc(OC)c2)C1 ZINC000468109551 529527864 /nfs/dbraw/zinc/52/78/64/529527864.db2.gz JPLDHRIDHYGPNK-CJNGLKHVSA-N 1 1 247.382 3.878 20 0 BHADMO CC[C@]1(C)CC[N@H+]([C@H](C)c2cccc(OC)c2)C1 ZINC000468109552 529400920 /nfs/dbraw/zinc/40/09/20/529400920.db2.gz JPLDHRIDHYGPNK-CZUORRHYSA-N 1 1 247.382 3.878 20 0 BHADMO CC[C@]1(C)CC[N@H+]([C@@H](C)c2cccc(OC)c2)C1 ZINC000468109553 529400958 /nfs/dbraw/zinc/40/09/58/529400958.db2.gz JPLDHRIDHYGPNK-XJKSGUPXSA-N 1 1 247.382 3.878 20 0 BHADMO CC[C@]1(C)CC[N@H+]([C@@H](C)c2ccccc2)C1 ZINC000468116443 529400909 /nfs/dbraw/zinc/40/09/09/529400909.db2.gz YILLOCMXKSAWBY-DZGCQCFKSA-N 1 1 217.356 3.870 20 0 BHADMO CC[C@@]1(C)CC[N@H+]([C@H](C)c2ccccc2)C1 ZINC000468116444 529528071 /nfs/dbraw/zinc/52/80/71/529528071.db2.gz YILLOCMXKSAWBY-HIFRSBDPSA-N 1 1 217.356 3.870 20 0 BHADMO CC[C@]1(C)CC[N@H+]([C@H](C)c2ccccc2)C1 ZINC000468116445 529401198 /nfs/dbraw/zinc/40/11/98/529401198.db2.gz YILLOCMXKSAWBY-UKRRQHHQSA-N 1 1 217.356 3.870 20 0 BHADMO CC[C@@]1(C)CC[N@H+]([C@@H](C)c2ccccc2)C1 ZINC000468116446 529527720 /nfs/dbraw/zinc/52/77/20/529527720.db2.gz YILLOCMXKSAWBY-ZFWWWQNUSA-N 1 1 217.356 3.870 20 0 BHADMO CCCC[N@H+]1CCc2c(F)cc(F)cc2[C@@H]1C ZINC000468121666 528486474 /nfs/dbraw/zinc/48/64/74/528486474.db2.gz TVZXWEVHRPCXBW-JTQLQIEISA-N 1 1 239.309 3.684 20 0 BHADMO CCCC[N@H+]1CCc2c(F)cc(F)cc2[C@H]1C ZINC000468121667 528487029 /nfs/dbraw/zinc/48/70/29/528487029.db2.gz TVZXWEVHRPCXBW-SNVBAGLBSA-N 1 1 239.309 3.684 20 0 BHADMO Cc1cccc([C@H](C)[N@H+]2CCC3(CCC3)C2)c1 ZINC000468128313 225020817 /nfs/dbraw/zinc/02/08/17/225020817.db2.gz YKOKNMVWEYMSSW-AWEZNQCLSA-N 1 1 229.367 3.932 20 0 BHADMO Cc1cccc([C@@H](C)[N@H+]2CCC3(CCC3)C2)c1 ZINC000468128314 225020940 /nfs/dbraw/zinc/02/09/40/225020940.db2.gz YKOKNMVWEYMSSW-CQSZACIVSA-N 1 1 229.367 3.932 20 0 BHADMO c1ccc2c(c1)CCC[C@@H]2[N@H+]1CCC2(CCC2)C1 ZINC000468129838 225021338 /nfs/dbraw/zinc/02/13/38/225021338.db2.gz MFPIIZHWQLJNNH-INIZCTEOSA-N 1 1 241.378 3.940 20 0 BHADMO c1ccc2c(c1)CCC[C@H]2[N@H+]1CCC2(CCC2)C1 ZINC000468129843 225021431 /nfs/dbraw/zinc/02/14/31/225021431.db2.gz MFPIIZHWQLJNNH-MRXNPFEDSA-N 1 1 241.378 3.940 20 0 BHADMO COc1cccc([C@H](C)[N@H+]2CCC[C@H](C)CC2)c1 ZINC000468144806 533769883 /nfs/dbraw/zinc/76/98/83/533769883.db2.gz KWVKSYKJQUDLIG-KBPBESRZSA-N 1 1 247.382 3.878 20 0 BHADMO COc1cccc([C@H](C)[N@H+]2CCC[C@@H](C)CC2)c1 ZINC000468144807 533770243 /nfs/dbraw/zinc/77/02/43/533770243.db2.gz KWVKSYKJQUDLIG-KGLIPLIRSA-N 1 1 247.382 3.878 20 0 BHADMO COc1cccc([C@@H](C)[N@H+]2CCC[C@H](C)CC2)c1 ZINC000468144808 533703635 /nfs/dbraw/zinc/70/36/35/533703635.db2.gz KWVKSYKJQUDLIG-UONOGXRCSA-N 1 1 247.382 3.878 20 0 BHADMO COc1cccc([C@@H](C)[N@H+]2CCC[C@@H](C)CC2)c1 ZINC000468144809 533701353 /nfs/dbraw/zinc/70/13/53/533701353.db2.gz KWVKSYKJQUDLIG-ZIAGYGMSSA-N 1 1 247.382 3.878 20 0 BHADMO C[C@@H](C[N@H+]1CCC2(CCC2)C1)c1ccccc1 ZINC000468149648 533807394 /nfs/dbraw/zinc/80/73/94/533807394.db2.gz ZFAUDZMNJVGGPA-AWEZNQCLSA-N 1 1 229.367 3.666 20 0 BHADMO C[C@H](C[N@H+]1CCC2(CCC2)C1)c1ccccc1 ZINC000468149649 225020887 /nfs/dbraw/zinc/02/08/87/225020887.db2.gz ZFAUDZMNJVGGPA-CQSZACIVSA-N 1 1 229.367 3.666 20 0 BHADMO COCC[C@@H]1CCCC[N@H+]([C@H](C)CC(C)C)C1 ZINC000468231143 225023351 /nfs/dbraw/zinc/02/33/51/225023351.db2.gz POCUALPEUGBADS-CABCVRRESA-N 1 1 241.419 3.560 20 0 BHADMO COCC[C@@H]1CCCC[N@H+]([C@@H](C)CC(C)C)C1 ZINC000468231144 225023060 /nfs/dbraw/zinc/02/30/60/225023060.db2.gz POCUALPEUGBADS-GJZGRUSLSA-N 1 1 241.419 3.560 20 0 BHADMO COCC[C@H]1CCCC[N@H+]([C@H](C)CC(C)C)C1 ZINC000468231145 225022156 /nfs/dbraw/zinc/02/21/56/225022156.db2.gz POCUALPEUGBADS-HUUCEWRRSA-N 1 1 241.419 3.560 20 0 BHADMO COCC[C@H]1CCCC[N@H+]([C@@H](C)CC(C)C)C1 ZINC000468231146 225023190 /nfs/dbraw/zinc/02/31/90/225023190.db2.gz POCUALPEUGBADS-LSDHHAIUSA-N 1 1 241.419 3.560 20 0 BHADMO COc1cccc([C@H](C)[N@H+]2CCCC[C@H](C)C2)c1 ZINC000468261550 533770983 /nfs/dbraw/zinc/77/09/83/533770983.db2.gz VMGBXRUDDXNOFX-KBPBESRZSA-N 1 1 247.382 3.878 20 0 BHADMO COc1cccc([C@H](C)[N@H+]2CCCC[C@@H](C)C2)c1 ZINC000468261551 533770171 /nfs/dbraw/zinc/77/01/71/533770171.db2.gz VMGBXRUDDXNOFX-KGLIPLIRSA-N 1 1 247.382 3.878 20 0 BHADMO COc1cccc([C@@H](C)[N@H+]2CCCC[C@H](C)C2)c1 ZINC000468261552 533701090 /nfs/dbraw/zinc/70/10/90/533701090.db2.gz VMGBXRUDDXNOFX-UONOGXRCSA-N 1 1 247.382 3.878 20 0 BHADMO COc1cccc([C@@H](C)[N@H+]2CCCC[C@@H](C)C2)c1 ZINC000468261553 533702018 /nfs/dbraw/zinc/70/20/18/533702018.db2.gz VMGBXRUDDXNOFX-ZIAGYGMSSA-N 1 1 247.382 3.878 20 0 BHADMO Cc1cc(OCC2CC2)c2c(C)cccc2[nH+]1 ZINC000468320774 225023764 /nfs/dbraw/zinc/02/37/64/225023764.db2.gz APCFEKGYRBUCGL-UHFFFAOYSA-N 1 1 227.307 3.640 20 0 BHADMO Cc1ccc2c(c1)[nH+]c(C)cc2OCC1CC1 ZINC000468331668 225024637 /nfs/dbraw/zinc/02/46/37/225024637.db2.gz LESVAHKDONGTGN-UHFFFAOYSA-N 1 1 227.307 3.640 20 0 BHADMO Cc1cc(Cl)ccc1C[N@H+]1CC[C@@](C)(F)C1 ZINC000468391003 533779260 /nfs/dbraw/zinc/77/92/60/533779260.db2.gz ARXIRMZAXXQKBS-CYBMUJFWSA-N 1 1 241.737 3.582 20 0 BHADMO Cc1cc(Cl)ccc1C[N@@H+]1CC[C@@](C)(F)C1 ZINC000468391003 533779254 /nfs/dbraw/zinc/77/92/54/533779254.db2.gz ARXIRMZAXXQKBS-CYBMUJFWSA-N 1 1 241.737 3.582 20 0 BHADMO Cc1cc(Cl)ccc1C[N@H+]1CC[C@](C)(F)C1 ZINC000468391004 533780149 /nfs/dbraw/zinc/78/01/49/533780149.db2.gz ARXIRMZAXXQKBS-ZDUSSCGKSA-N 1 1 241.737 3.582 20 0 BHADMO Cc1cc(Cl)ccc1C[N@@H+]1CC[C@](C)(F)C1 ZINC000468391004 533780141 /nfs/dbraw/zinc/78/01/41/533780141.db2.gz ARXIRMZAXXQKBS-ZDUSSCGKSA-N 1 1 241.737 3.582 20 0 BHADMO C[C@H]1CC[N@@H+](CC2CCC(C(F)(F)F)CC2)C1 ZINC000468396262 225025681 /nfs/dbraw/zinc/02/56/81/225025681.db2.gz BYTHDLYYKANYHE-UNXYVOJBSA-N 1 1 249.320 3.697 20 0 BHADMO C[C@@H]1CC[N@@H+](CC2CCC(C(F)(F)F)CC2)C1 ZINC000468396263 534028733 /nfs/dbraw/zinc/02/87/33/534028733.db2.gz BYTHDLYYKANYHE-VOMCLLRMSA-N 1 1 249.320 3.697 20 0 BHADMO CCc1[nH+]ccn1C/C=C\c1ccc(Cl)cc1 ZINC000468397567 529759468 /nfs/dbraw/zinc/75/94/68/529759468.db2.gz NTNCHCDKHZMVFX-ARJAWSKDSA-N 1 1 246.741 3.812 20 0 BHADMO Cc1cc(Cl)ccc1C[N@@H+]1CCC[C@H]1C ZINC000468398286 533780464 /nfs/dbraw/zinc/78/04/64/533780464.db2.gz AVXAJLJEBOMVJQ-LLVKDONJSA-N 1 1 223.747 3.633 20 0 BHADMO Cc1cc(Cl)ccc1C[N@@H+]1CCC[C@@H]1C ZINC000468398287 533780294 /nfs/dbraw/zinc/78/02/94/533780294.db2.gz AVXAJLJEBOMVJQ-NSHDSACASA-N 1 1 223.747 3.633 20 0 BHADMO CCCCOc1ccccc1C[N@@H+](C)CC1CC1 ZINC000468402733 528700328 /nfs/dbraw/zinc/70/03/28/528700328.db2.gz LPSQXFNLHFBTSM-UHFFFAOYSA-N 1 1 247.382 3.707 20 0 BHADMO CCCCOc1ccccc1C[N@@H+](C)C1CCC1 ZINC000468405474 528700604 /nfs/dbraw/zinc/70/06/04/528700604.db2.gz MTZGLHDDKURQFW-UHFFFAOYSA-N 1 1 247.382 3.850 20 0 BHADMO Cc1cc(Cl)ccc1C[N@H+](C)[C@H](C)C1CC1 ZINC000468406032 533779021 /nfs/dbraw/zinc/77/90/21/533779021.db2.gz SHEYPDIIONTWMP-LLVKDONJSA-N 1 1 237.774 3.879 20 0 BHADMO Cc1cc(Cl)ccc1C[N@H+](C)[C@@H](C)C1CC1 ZINC000468406033 533779412 /nfs/dbraw/zinc/77/94/12/533779412.db2.gz SHEYPDIIONTWMP-NSHDSACASA-N 1 1 237.774 3.879 20 0 BHADMO CC[N@@H+](Cc1ccc(Cl)cc1C)C1CC1 ZINC000468406544 528783911 /nfs/dbraw/zinc/78/39/11/528783911.db2.gz CJAVLURAWXZWKQ-UHFFFAOYSA-N 1 1 223.747 3.633 20 0 BHADMO Cc1cc(Cl)ccc1C[N@H+]1CCC12CCC2 ZINC000468408114 533778446 /nfs/dbraw/zinc/77/84/46/533778446.db2.gz LGDTWMPBVAIHBV-UHFFFAOYSA-N 1 1 235.758 3.777 20 0 BHADMO CCCCOc1ccccc1C[N@@H+](C)C(C)C ZINC000468412210 386159920 /nfs/dbraw/zinc/15/99/20/386159920.db2.gz MLNAHJBKSSGMML-UHFFFAOYSA-N 1 1 235.371 3.706 20 0 BHADMO CCC[C@@H](C)C[N@H+]1CCCC[C@@H](CCOC)C1 ZINC000468695406 528877349 /nfs/dbraw/zinc/87/73/49/528877349.db2.gz SKQFALYXFLNAGQ-CABCVRRESA-N 1 1 241.419 3.561 20 0 BHADMO CCC[C@H](C)C[N@H+]1CCCC[C@@H](CCOC)C1 ZINC000468695407 528032898 /nfs/dbraw/zinc/03/28/98/528032898.db2.gz SKQFALYXFLNAGQ-GJZGRUSLSA-N 1 1 241.419 3.561 20 0 BHADMO CCC[C@@H](C)C[N@H+]1CCCC[C@H](CCOC)C1 ZINC000468695408 528876545 /nfs/dbraw/zinc/87/65/45/528876545.db2.gz SKQFALYXFLNAGQ-HUUCEWRRSA-N 1 1 241.419 3.561 20 0 BHADMO CCC[C@H](C)C[N@H+]1CCCC[C@H](CCOC)C1 ZINC000468695409 528033022 /nfs/dbraw/zinc/03/30/22/528033022.db2.gz SKQFALYXFLNAGQ-LSDHHAIUSA-N 1 1 241.419 3.561 20 0 BHADMO CCC(CC)C[N@H+]1CCCC[C@@H](CCOC)C1 ZINC000468699315 528751550 /nfs/dbraw/zinc/75/15/50/528751550.db2.gz TWZFDRHFRFOQMF-HNNXBMFYSA-N 1 1 241.419 3.561 20 0 BHADMO CCC(CC)C[N@H+]1CCCC[C@H](CCOC)C1 ZINC000468699316 528752630 /nfs/dbraw/zinc/75/26/30/528752630.db2.gz TWZFDRHFRFOQMF-OAHLLOKOSA-N 1 1 241.419 3.561 20 0 BHADMO COc1cccc2c(NC3CCC3)c(C)c[nH+]c12 ZINC000468710146 533909067 /nfs/dbraw/zinc/90/90/67/533909067.db2.gz CUVHLMMMXRRROG-UHFFFAOYSA-N 1 1 242.322 3.516 20 0 BHADMO CCC[N@@H+](CCC(C)(C)OC)Cc1ccccc1 ZINC000468770636 528033617 /nfs/dbraw/zinc/03/36/17/528033617.db2.gz BGOBCQOSQZOUIQ-UHFFFAOYSA-N 1 1 249.398 3.714 20 0 BHADMO CCc1cccc(C[N@@H+](C)C2CCCC2)c1 ZINC000468810648 529168116 /nfs/dbraw/zinc/16/81/16/529168116.db2.gz DADMEYRMFNKFEZ-UHFFFAOYSA-N 1 1 217.356 3.623 20 0 BHADMO CC(C)[N@@H+](CCc1ccccc1F)C1CCC1 ZINC000468833435 528913369 /nfs/dbraw/zinc/91/33/69/528913369.db2.gz DPXXZLIJHDMINP-UHFFFAOYSA-N 1 1 235.346 3.631 20 0 BHADMO COC(C)(C)CC[N@@H+](C)[C@@H](C)c1ccccc1C ZINC000468848461 532950341 /nfs/dbraw/zinc/95/03/41/532950341.db2.gz GISKQVLCFXZOFT-AWEZNQCLSA-N 1 1 249.398 3.803 20 0 BHADMO CCc1cccc(C[N@@H+](C(C)C)C2CC2)c1 ZINC000468874657 529168045 /nfs/dbraw/zinc/16/80/45/529168045.db2.gz HRPFVVOWAHGYEQ-UHFFFAOYSA-N 1 1 217.356 3.622 20 0 BHADMO CC[C@H]1CCCC[N@H+]1CCc1ccccc1F ZINC000468903180 529202123 /nfs/dbraw/zinc/20/21/23/529202123.db2.gz IJKFLCAORJPFPR-AWEZNQCLSA-N 1 1 235.346 3.633 20 0 BHADMO CC[C@@H]1CCCC[N@H+]1CCc1ccccc1F ZINC000468903454 529274138 /nfs/dbraw/zinc/27/41/38/529274138.db2.gz IJKFLCAORJPFPR-CQSZACIVSA-N 1 1 235.346 3.633 20 0 BHADMO CCC(CC)C[N@@H+](CC)CCC(C)(C)OC ZINC000468933587 528743759 /nfs/dbraw/zinc/74/37/59/528743759.db2.gz KRQLWUCPENGFRD-UHFFFAOYSA-N 1 1 229.408 3.560 20 0 BHADMO CCc1cccc(C[N@@H+](C)Cc2ccc(C)o2)c1 ZINC000469011609 529168536 /nfs/dbraw/zinc/16/85/36/529168536.db2.gz PRXOETJFDIAOPS-UHFFFAOYSA-N 1 1 243.350 3.782 20 0 BHADMO COC(C)(C)CC[N@@H+](C)[C@@H](C)c1ccc(C)cc1 ZINC000469034394 532950201 /nfs/dbraw/zinc/95/02/01/532950201.db2.gz RTDBFPIPOYCSSF-AWEZNQCLSA-N 1 1 249.398 3.803 20 0 BHADMO COC(C)(C)CC[N@@H+](C)[C@H](C)c1ccc(C)cc1 ZINC000469034542 532950490 /nfs/dbraw/zinc/95/04/90/532950490.db2.gz RTDBFPIPOYCSSF-CQSZACIVSA-N 1 1 249.398 3.803 20 0 BHADMO CCc1cccc(C[N@@H+](C)Cc2cccs2)c1 ZINC000469036768 529168529 /nfs/dbraw/zinc/16/85/29/529168529.db2.gz SWDARRIWNOMGJR-UHFFFAOYSA-N 1 1 245.391 3.943 20 0 BHADMO CCCC[N@@H+](CCc1ccccc1F)C1CC1 ZINC000469047008 528439701 /nfs/dbraw/zinc/43/97/01/528439701.db2.gz PFAZKZQRSWIBMR-UHFFFAOYSA-N 1 1 235.346 3.633 20 0 BHADMO CC(C)C[C@@H]1CCC[N@@H+](CCCOC(C)C)C1 ZINC000469054102 528377048 /nfs/dbraw/zinc/37/70/48/528377048.db2.gz SOHUHNFCIYJFMZ-HNNXBMFYSA-N 1 1 241.419 3.560 20 0 BHADMO CC(C)C[C@H]1CCC[N@@H+](CCCOC(C)C)C1 ZINC000469054241 528587810 /nfs/dbraw/zinc/58/78/10/528587810.db2.gz SOHUHNFCIYJFMZ-OAHLLOKOSA-N 1 1 241.419 3.560 20 0 BHADMO COCCCCC[N@H+]1CCC[C@@H](CC(C)C)C1 ZINC000469078597 225036064 /nfs/dbraw/zinc/03/60/64/225036064.db2.gz UNWSQPQLTVQSMA-HNNXBMFYSA-N 1 1 241.419 3.561 20 0 BHADMO COCCCCC[N@H+]1CCC[C@H](CC(C)C)C1 ZINC000469078767 225035526 /nfs/dbraw/zinc/03/55/26/225035526.db2.gz UNWSQPQLTVQSMA-OAHLLOKOSA-N 1 1 241.419 3.561 20 0 BHADMO CC(C)c1ccc(CC[N@@H+](C)C2CCC2)cc1 ZINC000469104147 528086172 /nfs/dbraw/zinc/08/61/72/528086172.db2.gz RRDMCXPCUYTCQG-UHFFFAOYSA-N 1 1 231.383 3.837 20 0 BHADMO CC[N@@H+](CCC(C)(C)OC)Cc1ccccc1C ZINC000469134595 528406375 /nfs/dbraw/zinc/40/63/75/528406375.db2.gz ZGUJLCWYOFSORQ-UHFFFAOYSA-N 1 1 249.398 3.632 20 0 BHADMO Fc1ccccc1CC[N@H+]1CCC[C@H]1C1CCC1 ZINC000469139448 225037455 /nfs/dbraw/zinc/03/74/55/225037455.db2.gz UDYGKNWBGAPPPT-INIZCTEOSA-N 1 1 247.357 3.633 20 0 BHADMO Fc1ccccc1CC[N@H+]1CCC[C@@H]1C1CCC1 ZINC000469139528 225036876 /nfs/dbraw/zinc/03/68/76/225036876.db2.gz UDYGKNWBGAPPPT-MRXNPFEDSA-N 1 1 247.357 3.633 20 0 BHADMO C[C@H](C1CC1)[N@@H+](CCc1ccccc1F)C1CC1 ZINC000469142442 225037410 /nfs/dbraw/zinc/03/74/10/225037410.db2.gz KQNQKJHQSHIDLJ-GFCCVEGCSA-N 1 1 247.357 3.631 20 0 BHADMO C[C@@H](C1CC1)[N@@H+](CCc1ccccc1F)C1CC1 ZINC000469142587 225036827 /nfs/dbraw/zinc/03/68/27/225036827.db2.gz KQNQKJHQSHIDLJ-LBPRGKRZSA-N 1 1 247.357 3.631 20 0 BHADMO CCCCC[N@@H+](CCC(C)(C)OC)C(C)C ZINC000469166945 528167314 /nfs/dbraw/zinc/16/73/14/528167314.db2.gz PSRQKWXIBYPMQQ-UHFFFAOYSA-N 1 1 229.408 3.702 20 0 BHADMO Fc1ccccc1CC[N@H+]1CCC[C@H]2CCC[C@H]21 ZINC000469168014 225036714 /nfs/dbraw/zinc/03/67/14/225036714.db2.gz VFQSTYOYRXFMGS-GDBMZVCRSA-N 1 1 247.357 3.633 20 0 BHADMO Fc1ccccc1CC[N@H+]1CCC[C@@H]2CCC[C@H]21 ZINC000469168042 225036743 /nfs/dbraw/zinc/03/67/43/225036743.db2.gz VFQSTYOYRXFMGS-GOEBONIOSA-N 1 1 247.357 3.633 20 0 BHADMO Fc1ccccc1CC[N@H+]1CCC[C@@H]2CCC[C@@H]21 ZINC000469168074 225036945 /nfs/dbraw/zinc/03/69/45/225036945.db2.gz VFQSTYOYRXFMGS-HOCLYGCPSA-N 1 1 247.357 3.633 20 0 BHADMO Fc1ccccc1CC[N@H+]1CCC[C@H]2CCC[C@@H]21 ZINC000469168104 225037420 /nfs/dbraw/zinc/03/74/20/225037420.db2.gz VFQSTYOYRXFMGS-ZBFHGGJFSA-N 1 1 247.357 3.633 20 0 BHADMO CCCCC[N@@H+](Cc1ccc(F)cn1)C(C)C ZINC000469211870 528181396 /nfs/dbraw/zinc/18/13/96/528181396.db2.gz XIRRAHSEMDKHBG-UHFFFAOYSA-N 1 1 238.350 3.621 20 0 BHADMO COCC[N@@H+](Cc1ccccc1)[C@@H](C)C(C)(C)C ZINC000469444210 225042538 /nfs/dbraw/zinc/04/25/38/225042538.db2.gz IDAFXGVBZXNKHQ-AWEZNQCLSA-N 1 1 249.398 3.570 20 0 BHADMO COCC[N@@H+](Cc1ccccc1)[C@H](C)C(C)(C)C ZINC000469444211 225042328 /nfs/dbraw/zinc/04/23/28/225042328.db2.gz IDAFXGVBZXNKHQ-CQSZACIVSA-N 1 1 249.398 3.570 20 0 BHADMO CCCC[N@H+]1CC[C@@H](c2c(F)cccc2F)C1 ZINC000469450569 528486202 /nfs/dbraw/zinc/48/62/02/528486202.db2.gz QUGROPQYRCTIPH-LLVKDONJSA-N 1 1 239.309 3.554 20 0 BHADMO CCCC[N@H+]1CC[C@H](c2c(F)cccc2F)C1 ZINC000469450570 528485850 /nfs/dbraw/zinc/48/58/50/528485850.db2.gz QUGROPQYRCTIPH-NSHDSACASA-N 1 1 239.309 3.554 20 0 BHADMO CC[C@H](C)[C@@H]1CCCC[N@H+]1CCC(C)(C)OC ZINC000469594819 529229087 /nfs/dbraw/zinc/22/90/87/529229087.db2.gz LTRDKIHIPUZOST-KBPBESRZSA-N 1 1 241.419 3.702 20 0 BHADMO CC[C@@H](C)[C@@H]1CCCC[N@H+]1CCC(C)(C)OC ZINC000469594820 529406771 /nfs/dbraw/zinc/40/67/71/529406771.db2.gz LTRDKIHIPUZOST-KGLIPLIRSA-N 1 1 241.419 3.702 20 0 BHADMO CC[C@H](C)[C@H]1CCCC[N@H+]1CCC(C)(C)OC ZINC000469594821 529267390 /nfs/dbraw/zinc/26/73/90/529267390.db2.gz LTRDKIHIPUZOST-UONOGXRCSA-N 1 1 241.419 3.702 20 0 BHADMO CC[C@@H](C)[C@H]1CCCC[N@H+]1CCC(C)(C)OC ZINC000469594822 529425842 /nfs/dbraw/zinc/42/58/42/529425842.db2.gz LTRDKIHIPUZOST-ZIAGYGMSSA-N 1 1 241.419 3.702 20 0 BHADMO COC(C)(C)CC[N@@H+](CC(C)C)C1CCCC1 ZINC000469597313 532949767 /nfs/dbraw/zinc/94/97/67/532949767.db2.gz SCJPIUILKWWEEB-UHFFFAOYSA-N 1 1 241.419 3.702 20 0 BHADMO CCc1cccc(C[N@H+](CC)C2CCC2)c1 ZINC000469599341 529167998 /nfs/dbraw/zinc/16/79/98/529167998.db2.gz SPPMGTNXISDBOC-UHFFFAOYSA-N 1 1 217.356 3.623 20 0 BHADMO CC[C@@H](C)[C@@H](C)[N@@H+](CCC(C)(C)OC)C1CC1 ZINC000469604629 529391507 /nfs/dbraw/zinc/39/15/07/529391507.db2.gz KBBRKCPVRJPHAS-CHWSQXEVSA-N 1 1 241.419 3.701 20 0 BHADMO CC[C@@H](C)[C@H](C)[N@@H+](CCC(C)(C)OC)C1CC1 ZINC000469604630 529411646 /nfs/dbraw/zinc/41/16/46/529411646.db2.gz KBBRKCPVRJPHAS-OLZOCXBDSA-N 1 1 241.419 3.701 20 0 BHADMO CC[C@H](C)[C@@H](C)[N@@H+](CCC(C)(C)OC)C1CC1 ZINC000469604631 529202778 /nfs/dbraw/zinc/20/27/78/529202778.db2.gz KBBRKCPVRJPHAS-QWHCGFSZSA-N 1 1 241.419 3.701 20 0 BHADMO CC[C@H](C)[C@H](C)[N@@H+](CCC(C)(C)OC)C1CC1 ZINC000469604632 529238391 /nfs/dbraw/zinc/23/83/91/529238391.db2.gz KBBRKCPVRJPHAS-STQMWFEESA-N 1 1 241.419 3.701 20 0 BHADMO COC(C)(C)CC[N@H+]1CCC[C@H](C(C)C)CC1 ZINC000469610472 532950280 /nfs/dbraw/zinc/95/02/80/532950280.db2.gz BTZOXTKJBPOEOP-AWEZNQCLSA-N 1 1 241.419 3.560 20 0 BHADMO COC(C)(C)CC[N@H+]1CCC[C@@H](C(C)C)CC1 ZINC000469610473 532950136 /nfs/dbraw/zinc/95/01/36/532950136.db2.gz BTZOXTKJBPOEOP-CQSZACIVSA-N 1 1 241.419 3.560 20 0 BHADMO COC(C)(C)CC[N@H+]1CCC[C@@H]1CC(C)(C)C ZINC000469611916 532949908 /nfs/dbraw/zinc/94/99/08/532949908.db2.gz SZAPRFWQILQHHK-CYBMUJFWSA-N 1 1 241.419 3.702 20 0 BHADMO COC(C)(C)CC[N@H+]1CCC[C@H]1CC(C)(C)C ZINC000469611917 532949922 /nfs/dbraw/zinc/94/99/22/532949922.db2.gz SZAPRFWQILQHHK-ZDUSSCGKSA-N 1 1 241.419 3.702 20 0 BHADMO CCc1cccc(C[N@@H+](C)CCC(F)(F)F)c1 ZINC000469612902 529168174 /nfs/dbraw/zinc/16/81/74/529168174.db2.gz GHKYWLSAJHBWMJ-UHFFFAOYSA-N 1 1 245.288 3.633 20 0 BHADMO CCC[C@@]1(C)CCC[N@@H+](CCC(C)(C)OC)C1 ZINC000469614321 527934387 /nfs/dbraw/zinc/93/43/87/527934387.db2.gz YNDFJLFFABOKPP-HNNXBMFYSA-N 1 1 241.419 3.704 20 0 BHADMO CCC[C@]1(C)CCC[N@@H+](CCC(C)(C)OC)C1 ZINC000469614322 528501433 /nfs/dbraw/zinc/50/14/33/528501433.db2.gz YNDFJLFFABOKPP-OAHLLOKOSA-N 1 1 241.419 3.704 20 0 BHADMO COC(C)(C)CC[N@@H+](C(C)C)C1CCCCC1 ZINC000469715108 532950285 /nfs/dbraw/zinc/95/02/85/532950285.db2.gz JZYIDLDHGKJRQS-UHFFFAOYSA-N 1 1 241.419 3.845 20 0 BHADMO CCC[C@H]1[C@@H](C)CCC[N@H+]1CCC(C)(C)OC ZINC000469719234 528442417 /nfs/dbraw/zinc/44/24/17/528442417.db2.gz YGRPAKVPHIIZDQ-KBPBESRZSA-N 1 1 241.419 3.702 20 0 BHADMO CCC[C@H]1[C@H](C)CCC[N@H+]1CCC(C)(C)OC ZINC000469719235 528444359 /nfs/dbraw/zinc/44/43/59/528444359.db2.gz YGRPAKVPHIIZDQ-KGLIPLIRSA-N 1 1 241.419 3.702 20 0 BHADMO CCC[C@@H]1[C@@H](C)CCC[N@H+]1CCC(C)(C)OC ZINC000469719236 527875979 /nfs/dbraw/zinc/87/59/79/527875979.db2.gz YGRPAKVPHIIZDQ-UONOGXRCSA-N 1 1 241.419 3.702 20 0 BHADMO CCC[C@@H]1[C@H](C)CCC[N@H+]1CCC(C)(C)OC ZINC000469719237 527878029 /nfs/dbraw/zinc/87/80/29/527878029.db2.gz YGRPAKVPHIIZDQ-ZIAGYGMSSA-N 1 1 241.419 3.702 20 0 BHADMO COC(C)(C)CC[N@H+]1CCCC[C@H]1CC(C)C ZINC000469719303 532950074 /nfs/dbraw/zinc/95/00/74/532950074.db2.gz DFKXJKCQCBCDHI-AWEZNQCLSA-N 1 1 241.419 3.702 20 0 BHADMO COC(C)(C)CC[N@H+]1CCCC[C@@H]1CC(C)C ZINC000469719304 532949916 /nfs/dbraw/zinc/94/99/16/532949916.db2.gz DFKXJKCQCBCDHI-CQSZACIVSA-N 1 1 241.419 3.702 20 0 BHADMO COC(C)(C)CC[N@H+]1CCCC12CCCCC2 ZINC000469723074 532950147 /nfs/dbraw/zinc/95/01/47/532950147.db2.gz MDNUAJDBZZTNCR-UHFFFAOYSA-N 1 1 239.403 3.600 20 0 BHADMO CCC1CCC([N@@H+](C)CCC(C)(C)OC)CC1 ZINC000469726292 527841052 /nfs/dbraw/zinc/84/10/52/527841052.db2.gz SIDOGLJWKNYNDJ-UHFFFAOYSA-N 1 1 241.419 3.702 20 0 BHADMO CCC[C@H](C)[C@@H]1CCC[N@H+]1CCC(C)(C)OC ZINC000469728770 528074762 /nfs/dbraw/zinc/07/47/62/528074762.db2.gz NBGBTWANRNFCRZ-KBPBESRZSA-N 1 1 241.419 3.702 20 0 BHADMO CCC[C@@H](C)[C@@H]1CCC[N@H+]1CCC(C)(C)OC ZINC000469728771 528903851 /nfs/dbraw/zinc/90/38/51/528903851.db2.gz NBGBTWANRNFCRZ-KGLIPLIRSA-N 1 1 241.419 3.702 20 0 BHADMO CCC[C@H](C)[C@H]1CCC[N@H+]1CCC(C)(C)OC ZINC000469728772 528080756 /nfs/dbraw/zinc/08/07/56/528080756.db2.gz NBGBTWANRNFCRZ-UONOGXRCSA-N 1 1 241.419 3.702 20 0 BHADMO CCC[C@@H](C)[C@H]1CCC[N@H+]1CCC(C)(C)OC ZINC000469728773 528906247 /nfs/dbraw/zinc/90/62/47/528906247.db2.gz NBGBTWANRNFCRZ-ZIAGYGMSSA-N 1 1 241.419 3.702 20 0 BHADMO CCCCC[C@H]1CCC[N@H+]1CCC(C)(C)OC ZINC000469729763 528275358 /nfs/dbraw/zinc/27/53/58/528275358.db2.gz UZGIBLBENFFJGL-AWEZNQCLSA-N 1 1 241.419 3.846 20 0 BHADMO CCCCC[C@@H]1CCC[N@H+]1CCC(C)(C)OC ZINC000469729764 528262797 /nfs/dbraw/zinc/26/27/97/528262797.db2.gz UZGIBLBENFFJGL-CQSZACIVSA-N 1 1 241.419 3.846 20 0 BHADMO COC(C)(C)CC[N@H+]1CCC[C@H]1CCC(C)C ZINC000469729786 532949958 /nfs/dbraw/zinc/94/99/58/532949958.db2.gz VOCGOMAHUBJNBT-AWEZNQCLSA-N 1 1 241.419 3.702 20 0 BHADMO COC(C)(C)CC[N@H+]1CCC[C@@H]1CCC(C)C ZINC000469729787 532949901 /nfs/dbraw/zinc/94/99/01/532949901.db2.gz VOCGOMAHUBJNBT-CQSZACIVSA-N 1 1 241.419 3.702 20 0 BHADMO CCc1cccc(C[N@H+]2CCC[C@H]2CSC)c1 ZINC000469729840 529168497 /nfs/dbraw/zinc/16/84/97/529168497.db2.gz TVTXZYMCHLGLHC-HNNXBMFYSA-N 1 1 249.423 3.576 20 0 BHADMO CCc1cccc(C[N@H+]2CCC[C@@H]2CSC)c1 ZINC000469729841 529168688 /nfs/dbraw/zinc/16/86/88/529168688.db2.gz TVTXZYMCHLGLHC-OAHLLOKOSA-N 1 1 249.423 3.576 20 0 BHADMO CCC(C)(C)[C@H]1CCC[N@H+]1CCC(C)(C)OC ZINC000469731604 528599770 /nfs/dbraw/zinc/59/97/70/528599770.db2.gz QGRTZYVWKACPNC-CYBMUJFWSA-N 1 1 241.419 3.702 20 0 BHADMO CCC(C)(C)[C@@H]1CCC[N@H+]1CCC(C)(C)OC ZINC000469731605 528598727 /nfs/dbraw/zinc/59/87/27/528598727.db2.gz QGRTZYVWKACPNC-ZDUSSCGKSA-N 1 1 241.419 3.702 20 0 BHADMO COC(C)(C)CC[N@H+]1CCC[C@@H](CC(C)C)C1 ZINC000469736885 532950235 /nfs/dbraw/zinc/95/02/35/532950235.db2.gz YCWNMKZIRBJYEC-AWEZNQCLSA-N 1 1 241.419 3.560 20 0 BHADMO COC(C)(C)CC[N@H+]1CCC[C@H](CC(C)C)C1 ZINC000469736886 532950243 /nfs/dbraw/zinc/95/02/43/532950243.db2.gz YCWNMKZIRBJYEC-CQSZACIVSA-N 1 1 241.419 3.560 20 0 BHADMO C[C@H](CCC1CC1)Nc1ccc2c(c1)[nH+]cn2C ZINC000469796794 225048588 /nfs/dbraw/zinc/04/85/88/225048588.db2.gz MYRJZENXUXNZKL-LLVKDONJSA-N 1 1 243.354 3.564 20 0 BHADMO C[C@@H](CCC1CC1)Nc1ccc2c(c1)[nH+]cn2C ZINC000469796807 225048261 /nfs/dbraw/zinc/04/82/61/225048261.db2.gz MYRJZENXUXNZKL-NSHDSACASA-N 1 1 243.354 3.564 20 0 BHADMO c1ccc(CC[N@H+]2CC[C@H]2c2ccccc2)cc1 ZINC000469835292 225049521 /nfs/dbraw/zinc/04/95/21/225049521.db2.gz DMSLONHYLKXEGD-KRWDZBQOSA-N 1 1 237.346 3.676 20 0 BHADMO c1ccc(CC[N@H+]2CC[C@@H]2c2ccccc2)cc1 ZINC000469835293 534488245 /nfs/dbraw/zinc/48/82/45/534488245.db2.gz DMSLONHYLKXEGD-QGZVFWFLSA-N 1 1 237.346 3.676 20 0 BHADMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCc1ccccc1F ZINC000469840097 533827638 /nfs/dbraw/zinc/82/76/38/533827638.db2.gz GFBAZGXPPLNISH-BETUJISGSA-N 1 1 235.346 3.631 20 0 BHADMO FCCC[N@H+]1CCCC2(CCCCC2)CC1 ZINC000469844605 534429304 /nfs/dbraw/zinc/42/93/04/534429304.db2.gz ZQQNPVAYIUUGMO-UHFFFAOYSA-N 1 1 227.367 3.782 20 0 BHADMO CC(C)C[N@@H+](CCCC1CCOCC1)C(C)C ZINC000469895888 527939445 /nfs/dbraw/zinc/93/94/45/527939445.db2.gz DVQIFPHJQZOZHV-UHFFFAOYSA-N 1 1 241.419 3.560 20 0 BHADMO CCC[N@@H+](CCCC1CCOCC1)CC(C)C ZINC000469909974 528063938 /nfs/dbraw/zinc/06/39/38/528063938.db2.gz ULPPOSFBUCRQQM-UHFFFAOYSA-N 1 1 241.419 3.561 20 0 BHADMO CC[N@@H+](CCC(C)(C)OC)[C@H]1CCCC[C@@H]1C ZINC000469981535 528405405 /nfs/dbraw/zinc/40/54/05/528405405.db2.gz KDZCHSMFNSZNMZ-KBPBESRZSA-N 1 1 241.419 3.702 20 0 BHADMO CC[N@@H+](CCC(C)(C)OC)[C@H]1CCCC[C@H]1C ZINC000469981536 528406059 /nfs/dbraw/zinc/40/60/59/528406059.db2.gz KDZCHSMFNSZNMZ-KGLIPLIRSA-N 1 1 241.419 3.702 20 0 BHADMO CC[N@@H+](CCC(C)(C)OC)[C@@H]1CCCC[C@@H]1C ZINC000469981537 528406643 /nfs/dbraw/zinc/40/66/43/528406643.db2.gz KDZCHSMFNSZNMZ-UONOGXRCSA-N 1 1 241.419 3.702 20 0 BHADMO CC[N@@H+](CCC(C)(C)OC)[C@@H]1CCCC[C@H]1C ZINC000469981538 528406431 /nfs/dbraw/zinc/40/64/31/528406431.db2.gz KDZCHSMFNSZNMZ-ZIAGYGMSSA-N 1 1 241.419 3.702 20 0 BHADMO CC[C@H]1CCCC[C@@H]1[N@@H+](C)CCC(C)(C)OC ZINC000469985947 529205875 /nfs/dbraw/zinc/20/58/75/529205875.db2.gz ZFKLSYGSKAWIFQ-KBPBESRZSA-N 1 1 241.419 3.702 20 0 BHADMO CC[C@@H]1CCCC[C@@H]1[N@@H+](C)CCC(C)(C)OC ZINC000469985948 529280132 /nfs/dbraw/zinc/28/01/32/529280132.db2.gz ZFKLSYGSKAWIFQ-KGLIPLIRSA-N 1 1 241.419 3.702 20 0 BHADMO CC[C@H]1CCCC[C@H]1[N@@H+](C)CCC(C)(C)OC ZINC000469985949 529209923 /nfs/dbraw/zinc/20/99/23/529209923.db2.gz ZFKLSYGSKAWIFQ-UONOGXRCSA-N 1 1 241.419 3.702 20 0 BHADMO CC[C@@H]1CCCC[C@H]1[N@@H+](C)CCC(C)(C)OC ZINC000469985950 529288661 /nfs/dbraw/zinc/28/86/61/529288661.db2.gz ZFKLSYGSKAWIFQ-ZIAGYGMSSA-N 1 1 241.419 3.702 20 0 BHADMO CC1(C)[C@H](C(F)(F)F)CC[N@H+]1[C@@H]1C=CCCC1 ZINC000469992759 527852780 /nfs/dbraw/zinc/85/27/80/527852780.db2.gz QOILUPITCIPHLB-GHMZBOCLSA-N 1 1 247.304 3.758 20 0 BHADMO CC1(C)[C@@H](C(F)(F)F)CC[N@H+]1[C@@H]1C=CCCC1 ZINC000469992760 527823240 /nfs/dbraw/zinc/82/32/40/527823240.db2.gz QOILUPITCIPHLB-MNOVXSKESA-N 1 1 247.304 3.758 20 0 BHADMO CC1(C)[C@@H](C(F)(F)F)CC[N@H+]1[C@H]1C=CCCC1 ZINC000469992761 527822588 /nfs/dbraw/zinc/82/25/88/527822588.db2.gz QOILUPITCIPHLB-QWRGUYRKSA-N 1 1 247.304 3.758 20 0 BHADMO CC1(C)[C@H](C(F)(F)F)CC[N@H+]1[C@H]1C=CCCC1 ZINC000469992762 527853088 /nfs/dbraw/zinc/85/30/88/527853088.db2.gz QOILUPITCIPHLB-WDEREUQCSA-N 1 1 247.304 3.758 20 0 BHADMO CCCCC[N@H+]1CC[C@H](C(F)(F)F)C1(C)C ZINC000469993194 528186831 /nfs/dbraw/zinc/18/68/31/528186831.db2.gz SLASSJYUNGNTPU-JTQLQIEISA-N 1 1 237.309 3.839 20 0 BHADMO CCCCC[N@H+]1CC[C@@H](C(F)(F)F)C1(C)C ZINC000469993195 528185697 /nfs/dbraw/zinc/18/56/97/528185697.db2.gz SLASSJYUNGNTPU-SNVBAGLBSA-N 1 1 237.309 3.839 20 0 BHADMO CC1(C)[C@H](C(F)(F)F)CC[N@H+]1CC1CCCC1 ZINC000469994397 527852097 /nfs/dbraw/zinc/85/20/97/527852097.db2.gz WPZQBNROKHAANF-LLVKDONJSA-N 1 1 249.320 3.839 20 0 BHADMO CC1(C)[C@@H](C(F)(F)F)CC[N@H+]1CC1CCCC1 ZINC000469994407 527822233 /nfs/dbraw/zinc/82/22/33/527822233.db2.gz WPZQBNROKHAANF-NSHDSACASA-N 1 1 249.320 3.839 20 0 BHADMO CC(C)CC[N@H+]1CC[C@H](C(F)(F)F)C1(C)C ZINC000469994424 527726896 /nfs/dbraw/zinc/72/68/96/527726896.db2.gz XMKMWZBUYLXAQS-JTQLQIEISA-N 1 1 237.309 3.695 20 0 BHADMO CC(C)CC[N@H+]1CC[C@@H](C(F)(F)F)C1(C)C ZINC000469994425 527727059 /nfs/dbraw/zinc/72/70/59/527727059.db2.gz XMKMWZBUYLXAQS-SNVBAGLBSA-N 1 1 237.309 3.695 20 0 BHADMO Cc1cc[nH+]c(N2CCC(C(C)(C)C)CC2)c1 ZINC000470501746 225057700 /nfs/dbraw/zinc/05/77/00/225057700.db2.gz AUDOZFMFHLDTPY-UHFFFAOYSA-N 1 1 232.371 3.653 20 0 BHADMO Cc1cc[nH+]c(N[C@H](C)Cc2ccccc2F)c1 ZINC000470505332 225058737 /nfs/dbraw/zinc/05/87/37/225058737.db2.gz STPWJDKULYLZBQ-GFCCVEGCSA-N 1 1 244.313 3.572 20 0 BHADMO Cc1cc[nH+]c(N[C@@H](C)Cc2ccccc2F)c1 ZINC000470505333 534403879 /nfs/dbraw/zinc/40/38/79/534403879.db2.gz STPWJDKULYLZBQ-LBPRGKRZSA-N 1 1 244.313 3.572 20 0 BHADMO Cc1cc[nH+]c(N(C)C[C@H](C)c2ccccc2)c1 ZINC000470517017 534395394 /nfs/dbraw/zinc/39/53/94/534395394.db2.gz VGRYKAIOUYHLBX-AWEZNQCLSA-N 1 1 240.350 3.630 20 0 BHADMO Cc1cc[nH+]c(N(C)C[C@@H](C)c2ccccc2)c1 ZINC000470517018 534395249 /nfs/dbraw/zinc/39/52/49/534395249.db2.gz VGRYKAIOUYHLBX-CQSZACIVSA-N 1 1 240.350 3.630 20 0 BHADMO CCC[N@@H+](CC)Cc1cccc(C(F)F)c1 ZINC000470717938 528003470 /nfs/dbraw/zinc/00/34/70/528003470.db2.gz NTSBNCDTDYVXKG-UHFFFAOYSA-N 1 1 227.298 3.856 20 0 BHADMO C[N@@H+](Cc1cccc(C(F)F)c1)C1CCCC1 ZINC000470718835 529993612 /nfs/dbraw/zinc/99/36/12/529993612.db2.gz YESMTQKEPHYCDD-UHFFFAOYSA-N 1 1 239.309 3.999 20 0 BHADMO CCCC[N@@H+](C)Cc1cccc(C(F)F)c1 ZINC000470727008 528359513 /nfs/dbraw/zinc/35/95/13/528359513.db2.gz QEDKDGMZBNHOAP-UHFFFAOYSA-N 1 1 227.298 3.856 20 0 BHADMO C[C@H]1C[N@@H+](Cc2cccc(C(F)F)c2)C[C@H]1C ZINC000470758205 225059836 /nfs/dbraw/zinc/05/98/36/225059836.db2.gz WTLCDOOGHKPMOX-PHIMTYICSA-N 1 1 239.309 3.712 20 0 BHADMO CCC[N@@H+](Cc1cccc(C(F)F)c1)C1CC1 ZINC000470758212 528141187 /nfs/dbraw/zinc/14/11/87/528141187.db2.gz WWAHUHJIFJACIU-UHFFFAOYSA-N 1 1 239.309 3.999 20 0 BHADMO CC[C@@H]1CCC[N@H+]1Cc1cccc(C(F)F)c1 ZINC000470759193 529302135 /nfs/dbraw/zinc/30/21/35/529302135.db2.gz CGOOQDPKVFLMKB-CYBMUJFWSA-N 1 1 239.309 3.999 20 0 BHADMO CC[C@H]1CCC[N@H+]1Cc1cccc(C(F)F)c1 ZINC000470759194 529220213 /nfs/dbraw/zinc/22/02/13/529220213.db2.gz CGOOQDPKVFLMKB-ZDUSSCGKSA-N 1 1 239.309 3.999 20 0 BHADMO CC[C@@H]1CC[N@@H+](Cc2cccc(C(F)F)c2)C1 ZINC000470762819 529327323 /nfs/dbraw/zinc/32/73/23/529327323.db2.gz YYNLCVNFTOFWAC-LLVKDONJSA-N 1 1 239.309 3.856 20 0 BHADMO CC[C@H]1CC[N@@H+](Cc2cccc(C(F)F)c2)C1 ZINC000470762820 529238949 /nfs/dbraw/zinc/23/89/49/529238949.db2.gz YYNLCVNFTOFWAC-NSHDSACASA-N 1 1 239.309 3.856 20 0 BHADMO CC[N@H+](Cc1cccc(C(F)F)c1)CC1CC1 ZINC000470766038 528803380 /nfs/dbraw/zinc/80/33/80/528803380.db2.gz OAZXECROJXOICM-UHFFFAOYSA-N 1 1 239.309 3.856 20 0 BHADMO C[C@@H]1C[C@@H](C)[N@@H+](Cc2cccc(C(F)F)c2)C1 ZINC000470769616 225059808 /nfs/dbraw/zinc/05/98/08/225059808.db2.gz QAKOORBDTPMMOA-GHMZBOCLSA-N 1 1 239.309 3.855 20 0 BHADMO C[C@@H]1C[C@H](C)[N@@H+](Cc2cccc(C(F)F)c2)C1 ZINC000470769617 225060314 /nfs/dbraw/zinc/06/03/14/225060314.db2.gz QAKOORBDTPMMOA-MNOVXSKESA-N 1 1 239.309 3.855 20 0 BHADMO C[C@H]1C[C@H](C)[N@@H+](Cc2cccc(C(F)F)c2)C1 ZINC000470769618 225060418 /nfs/dbraw/zinc/06/04/18/225060418.db2.gz QAKOORBDTPMMOA-QWRGUYRKSA-N 1 1 239.309 3.855 20 0 BHADMO C[C@@H]1C[C@H](C)C[N@@H+]1Cc1cccc(C(F)F)c1 ZINC000470769619 533805194 /nfs/dbraw/zinc/80/51/94/533805194.db2.gz QAKOORBDTPMMOA-WDEREUQCSA-N 1 1 239.309 3.855 20 0 BHADMO CC1(C)CC[N@@H+](Cc2cccc(C(F)F)c2)C1 ZINC000470774931 529009930 /nfs/dbraw/zinc/00/99/30/529009930.db2.gz VJLIIDVLMLMFSU-UHFFFAOYSA-N 1 1 239.309 3.856 20 0 BHADMO C(=C/c1ccccc1)\C[N@H+]1CCCC2(CCC2)C1 ZINC000470872723 527466921 /nfs/dbraw/zinc/46/69/21/527466921.db2.gz KPCQDFGGHJIZJW-RUDMXATFSA-N 1 1 241.378 3.966 20 0 BHADMO C(=C\c1ccccc1)\C[N@H+]1CCCC2(CCC2)C1 ZINC000470872739 527471044 /nfs/dbraw/zinc/47/10/44/527471044.db2.gz KPCQDFGGHJIZJW-WTKPLQERSA-N 1 1 241.378 3.966 20 0 BHADMO CC[C@H](c1ccccc1)[N@H+]1CCC[C@](C)(OC)C1 ZINC000470905487 529182558 /nfs/dbraw/zinc/18/25/58/529182558.db2.gz GNKUNTIHLPRHQW-CVEARBPZSA-N 1 1 247.382 3.639 20 0 BHADMO CC[C@@H](c1ccccc1)[N@H+]1CCC[C@](C)(OC)C1 ZINC000470905488 529256990 /nfs/dbraw/zinc/25/69/90/529256990.db2.gz GNKUNTIHLPRHQW-HOTGVXAUSA-N 1 1 247.382 3.639 20 0 BHADMO CC[C@H](c1ccccc1)[N@H+]1CCC[C@@](C)(OC)C1 ZINC000470905489 529182397 /nfs/dbraw/zinc/18/23/97/529182397.db2.gz GNKUNTIHLPRHQW-HZPDHXFCSA-N 1 1 247.382 3.639 20 0 BHADMO CC[C@@H](c1ccccc1)[N@H+]1CCC[C@@](C)(OC)C1 ZINC000470905490 529257250 /nfs/dbraw/zinc/25/72/50/529257250.db2.gz GNKUNTIHLPRHQW-JKSUJKDBSA-N 1 1 247.382 3.639 20 0 BHADMO CO[C@]1(C)CCC[N@H+]([C@H](C)c2cccc(C)c2)C1 ZINC000470908865 533371797 /nfs/dbraw/zinc/37/17/97/533371797.db2.gz KFFQZROCHBRCAU-GDBMZVCRSA-N 1 1 247.382 3.557 20 0 BHADMO CO[C@]1(C)CCC[N@H+]([C@@H](C)c2cccc(C)c2)C1 ZINC000470908866 533370731 /nfs/dbraw/zinc/37/07/31/533370731.db2.gz KFFQZROCHBRCAU-GOEBONIOSA-N 1 1 247.382 3.557 20 0 BHADMO CO[C@@]1(C)CCC[N@H+]([C@@H](C)c2cccc(C)c2)C1 ZINC000470908867 533025654 /nfs/dbraw/zinc/02/56/54/533025654.db2.gz KFFQZROCHBRCAU-HOCLYGCPSA-N 1 1 247.382 3.557 20 0 BHADMO CO[C@@]1(C)CCC[N@H+]([C@H](C)c2cccc(C)c2)C1 ZINC000470908868 533025190 /nfs/dbraw/zinc/02/51/90/533025190.db2.gz KFFQZROCHBRCAU-ZBFHGGJFSA-N 1 1 247.382 3.557 20 0 BHADMO CO[C@]1(C)CCC[N@H+]([C@H](C)c2ccccc2C)C1 ZINC000470912207 533371587 /nfs/dbraw/zinc/37/15/87/533371587.db2.gz DCYCHBGIYHSMNM-GDBMZVCRSA-N 1 1 247.382 3.557 20 0 BHADMO CO[C@]1(C)CCC[N@H+]([C@@H](C)c2ccccc2C)C1 ZINC000470912208 533371057 /nfs/dbraw/zinc/37/10/57/533371057.db2.gz DCYCHBGIYHSMNM-GOEBONIOSA-N 1 1 247.382 3.557 20 0 BHADMO CO[C@@]1(C)CCC[N@H+]([C@@H](C)c2ccccc2C)C1 ZINC000470912209 533026908 /nfs/dbraw/zinc/02/69/08/533026908.db2.gz DCYCHBGIYHSMNM-HOCLYGCPSA-N 1 1 247.382 3.557 20 0 BHADMO CO[C@@]1(C)CCC[N@H+]([C@H](C)c2ccccc2C)C1 ZINC000470912210 533026082 /nfs/dbraw/zinc/02/60/82/533026082.db2.gz DCYCHBGIYHSMNM-ZBFHGGJFSA-N 1 1 247.382 3.557 20 0 BHADMO CC/C=C\CC[N@H+]1CC[C@H](C(F)(F)F)[C@H]1C ZINC000470939751 528789295 /nfs/dbraw/zinc/78/92/95/528789295.db2.gz HXMXRHVDGAFOCS-KWKBKKAHSA-N 1 1 235.293 3.615 20 0 BHADMO CC/C=C/CC[N@H+]1CC[C@H](C(F)(F)F)[C@@H]1C ZINC000470939752 528772475 /nfs/dbraw/zinc/77/24/75/528772475.db2.gz HXMXRHVDGAFOCS-NNOMMRTBSA-N 1 1 235.293 3.615 20 0 BHADMO CC/C=C\CC[N@H+]1CC[C@H](C(F)(F)F)[C@@H]1C ZINC000470939753 528789065 /nfs/dbraw/zinc/78/90/65/528789065.db2.gz HXMXRHVDGAFOCS-XXJOZFEBSA-N 1 1 235.293 3.615 20 0 BHADMO CC/C=C/CC[N@H+]1CC[C@H](C(F)(F)F)[C@H]1C ZINC000470939754 528772797 /nfs/dbraw/zinc/77/27/97/528772797.db2.gz HXMXRHVDGAFOCS-ZJRFNNFUSA-N 1 1 235.293 3.615 20 0 BHADMO CC(C)CCC[N@H+]1CC[C@@H](C(F)(F)F)[C@H]1C ZINC000470942394 527703441 /nfs/dbraw/zinc/70/34/41/527703441.db2.gz AFXJILPGQYWJJR-GHMZBOCLSA-N 1 1 237.309 3.695 20 0 BHADMO CC(C)CCC[N@H+]1CC[C@H](C(F)(F)F)[C@H]1C ZINC000470942395 527703516 /nfs/dbraw/zinc/70/35/16/527703516.db2.gz AFXJILPGQYWJJR-MNOVXSKESA-N 1 1 237.309 3.695 20 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249.320 3.839 20 0 BHADMO C[C@H]1[C@H](C(F)(F)F)CC[N@H+]1CCC1CCCC1 ZINC000470954957 225061966 /nfs/dbraw/zinc/06/19/66/225061966.db2.gz FHUZLLLDNYEPKM-CMPLNLGQSA-N 1 1 249.320 3.839 20 0 BHADMO C[C@H]1[C@@H](C(F)(F)F)CC[N@H+]1CCC1CCCC1 ZINC000470954958 225061403 /nfs/dbraw/zinc/06/14/03/225061403.db2.gz FHUZLLLDNYEPKM-JQWIXIFHSA-N 1 1 249.320 3.839 20 0 BHADMO C[C@@H]1[C@@H](C(F)(F)F)CC[N@H+]1CCC1CCCC1 ZINC000470954959 534228810 /nfs/dbraw/zinc/22/88/10/534228810.db2.gz FHUZLLLDNYEPKM-PWSUYJOCSA-N 1 1 249.320 3.839 20 0 BHADMO C[C@@H]1[C@H](C(F)(F)F)CC[N@H+]1CCC1CCCC1 ZINC000470954960 225060991 /nfs/dbraw/zinc/06/09/91/225060991.db2.gz FHUZLLLDNYEPKM-ZYHUDNBSSA-N 1 1 249.320 3.839 20 0 BHADMO COc1cccc([C@@H](C)[N@@H+]2C[C@H](C)C[C@H](C)C2)c1 ZINC000470958855 225060842 /nfs/dbraw/zinc/06/08/42/225060842.db2.gz LQRZQSBSRSAMGN-HZSPNIEDSA-N 1 1 247.382 3.734 20 0 BHADMO COc1cccc([C@H](C)[N@@H+]2C[C@H](C)C[C@H](C)C2)c1 ZINC000470958860 225061701 /nfs/dbraw/zinc/06/17/01/225061701.db2.gz LQRZQSBSRSAMGN-MJBXVCDLSA-N 1 1 247.382 3.734 20 0 BHADMO Cc1ccc([C@H]2CC[N@@H+](CC3CC3)C2)c(C)c1 ZINC000470993528 225063231 /nfs/dbraw/zinc/06/32/31/225063231.db2.gz CSCIPXQZQUUCOG-HNNXBMFYSA-N 1 1 229.367 3.503 20 0 BHADMO Cc1ccc([C@@H]2CC[N@@H+](CC3CC3)C2)c(C)c1 ZINC000470993529 225063120 /nfs/dbraw/zinc/06/31/20/225063120.db2.gz CSCIPXQZQUUCOG-OAHLLOKOSA-N 1 1 229.367 3.503 20 0 BHADMO Cc1ccc([C@H]2CC[N@H+](C(C)C)C2)c(C)c1 ZINC000470996008 225063626 /nfs/dbraw/zinc/06/36/26/225063626.db2.gz JVAXRIQCCDWPSP-AWEZNQCLSA-N 1 1 217.356 3.501 20 0 BHADMO Cc1ccc([C@@H]2CC[N@H+](C(C)C)C2)c(C)c1 ZINC000470996009 225063312 /nfs/dbraw/zinc/06/33/12/225063312.db2.gz JVAXRIQCCDWPSP-CQSZACIVSA-N 1 1 217.356 3.501 20 0 BHADMO CCC[N@H+]1CC[C@H](c2ccc(C)cc2C)C1 ZINC000471001452 528261879 /nfs/dbraw/zinc/26/18/79/528261879.db2.gz PIQNYHVNZCABOZ-AWEZNQCLSA-N 1 1 217.356 3.503 20 0 BHADMO CCC[N@H+]1CC[C@@H](c2ccc(C)cc2C)C1 ZINC000471001453 528253880 /nfs/dbraw/zinc/25/38/80/528253880.db2.gz PIQNYHVNZCABOZ-CQSZACIVSA-N 1 1 217.356 3.503 20 0 BHADMO CCC(C)(C)[N@@H+](C)CCc1ccc(F)c(F)c1 ZINC000471002430 528538593 /nfs/dbraw/zinc/53/85/93/528538593.db2.gz ZEQAEHZCUYUPFW-UHFFFAOYSA-N 1 1 241.325 3.628 20 0 BHADMO CCC(C)(C)[N@@H+](C)Cc1ccn(C2CCCC2)n1 ZINC000471011318 528540119 /nfs/dbraw/zinc/54/01/19/528540119.db2.gz ZEUAUQPXMPJLAS-UHFFFAOYSA-N 1 1 249.402 3.619 20 0 BHADMO CSc1ccccc1C[N@@H+](C)[C@H]1C=CCCC1 ZINC000471018411 533040328 /nfs/dbraw/zinc/04/03/28/533040328.db2.gz KGIMCKJLBXENEY-AWEZNQCLSA-N 1 1 247.407 3.949 20 0 BHADMO CSc1ccccc1C[N@@H+](C)[C@@H]1C=CCCC1 ZINC000471018412 533039389 /nfs/dbraw/zinc/03/93/89/533039389.db2.gz KGIMCKJLBXENEY-CQSZACIVSA-N 1 1 247.407 3.949 20 0 BHADMO CCC(C)(C)[N@@H+](C)CCCCOC(C)(C)C ZINC000471026009 528538150 /nfs/dbraw/zinc/53/81/50/528538150.db2.gz SASJJAMKGDYSTF-UHFFFAOYSA-N 1 1 229.408 3.702 20 0 BHADMO CC(C)CC[N@H+]1C[C@H](C)[C@@H]1c1ccccc1 ZINC000471026751 527727204 /nfs/dbraw/zinc/72/72/04/527727204.db2.gz ACEZMDZOJSWGCB-DZGCQCFKSA-N 1 1 217.356 3.726 20 0 BHADMO CC(C)CC[N@H+]1C[C@@H](C)[C@H]1c1ccccc1 ZINC000471026752 527726733 /nfs/dbraw/zinc/72/67/33/527726733.db2.gz ACEZMDZOJSWGCB-HIFRSBDPSA-N 1 1 217.356 3.726 20 0 BHADMO CC(C)CC[N@H+]1C[C@@H](C)[C@@H]1c1ccccc1 ZINC000471026753 527727730 /nfs/dbraw/zinc/72/77/30/527727730.db2.gz ACEZMDZOJSWGCB-UKRRQHHQSA-N 1 1 217.356 3.726 20 0 BHADMO CC(C)CC[N@H+]1C[C@H](C)[C@H]1c1ccccc1 ZINC000471026754 527728809 /nfs/dbraw/zinc/72/88/09/527728809.db2.gz ACEZMDZOJSWGCB-ZFWWWQNUSA-N 1 1 217.356 3.726 20 0 BHADMO Clc1ccc(CCC[N@H+]2CCC23CCC3)cc1 ZINC000471037700 534639031 /nfs/dbraw/zinc/63/90/31/534639031.db2.gz LQRSGVANVIRDQK-UHFFFAOYSA-N 1 1 249.785 3.901 20 0 BHADMO CCC(C)(C)[N@@H+](C)CCCCC(F)(F)F ZINC000471067174 528538195 /nfs/dbraw/zinc/53/81/95/528538195.db2.gz VOMSFCSAGZQTLT-UHFFFAOYSA-N 1 1 225.298 3.839 20 0 BHADMO Fc1cccc(C[N@H+]2CC[C@H]2c2ccccc2)c1 ZINC000471171178 534518466 /nfs/dbraw/zinc/51/84/66/534518466.db2.gz UYCXSGOIELPNET-INIZCTEOSA-N 1 1 241.309 3.773 20 0 BHADMO Fc1cccc(C[N@H+]2CC[C@@H]2c2ccccc2)c1 ZINC000471171179 534518122 /nfs/dbraw/zinc/51/81/22/534518122.db2.gz UYCXSGOIELPNET-MRXNPFEDSA-N 1 1 241.309 3.773 20 0 BHADMO Cc1ccccc1C[N@H+]1CC[C@H]1c1ccccc1 ZINC000471174065 225065212 /nfs/dbraw/zinc/06/52/12/225065212.db2.gz WVYZWYFUXLWAPP-KRWDZBQOSA-N 1 1 237.346 3.942 20 0 BHADMO Cc1ccccc1C[N@H+]1CC[C@@H]1c1ccccc1 ZINC000471174066 225064585 /nfs/dbraw/zinc/06/45/85/225064585.db2.gz WVYZWYFUXLWAPP-QGZVFWFLSA-N 1 1 237.346 3.942 20 0 BHADMO Fc1ccccc1C[N@H+]1CC[C@H]1c1ccccc1 ZINC000471179501 225065531 /nfs/dbraw/zinc/06/55/31/225065531.db2.gz UKSLAGFMROTZDL-INIZCTEOSA-N 1 1 241.309 3.773 20 0 BHADMO Fc1ccccc1C[N@H+]1CC[C@@H]1c1ccccc1 ZINC000471179503 225064794 /nfs/dbraw/zinc/06/47/94/225064794.db2.gz UKSLAGFMROTZDL-MRXNPFEDSA-N 1 1 241.309 3.773 20 0 BHADMO CC[N@@H+](CCC(C)C)[C@H](C)c1cccc(O)c1 ZINC000471187354 528406704 /nfs/dbraw/zinc/40/67/04/528406704.db2.gz PSGAFATVTCEROM-CYBMUJFWSA-N 1 1 235.371 3.821 20 0 BHADMO CC[N@@H+](CCC(C)C)[C@@H](C)c1cccc(O)c1 ZINC000471187355 528405954 /nfs/dbraw/zinc/40/59/54/528405954.db2.gz PSGAFATVTCEROM-ZDUSSCGKSA-N 1 1 235.371 3.821 20 0 BHADMO Cc1ccc(C[N@H+]2CC[C@H]2c2ccccc2)cc1 ZINC000471188127 533955883 /nfs/dbraw/zinc/95/58/83/533955883.db2.gz USUMUNFSVINPFM-KRWDZBQOSA-N 1 1 237.346 3.942 20 0 BHADMO Cc1ccc(C[N@H+]2CC[C@@H]2c2ccccc2)cc1 ZINC000471188128 533949604 /nfs/dbraw/zinc/94/96/04/533949604.db2.gz USUMUNFSVINPFM-QGZVFWFLSA-N 1 1 237.346 3.942 20 0 BHADMO CC[C@H]1C[N@@H+](CC)CC[C@H]1c1ccccc1 ZINC000472235247 529291430 /nfs/dbraw/zinc/29/14/30/529291430.db2.gz XKSXKNNRLWDOFG-DZGCQCFKSA-N 1 1 217.356 3.522 20 0 BHADMO CC[C@@H]1C[N@@H+](CC)CC[C@@H]1c1ccccc1 ZINC000472235248 529389486 /nfs/dbraw/zinc/38/94/86/529389486.db2.gz XKSXKNNRLWDOFG-HIFRSBDPSA-N 1 1 217.356 3.522 20 0 BHADMO CC[C@@H]1C[N@@H+](CC)CC[C@H]1c1ccccc1 ZINC000472235249 529389522 /nfs/dbraw/zinc/38/95/22/529389522.db2.gz XKSXKNNRLWDOFG-UKRRQHHQSA-N 1 1 217.356 3.522 20 0 BHADMO CC[C@H]1C[N@@H+](CC)CC[C@@H]1c1ccccc1 ZINC000472235250 529291314 /nfs/dbraw/zinc/29/13/14/529291314.db2.gz XKSXKNNRLWDOFG-ZFWWWQNUSA-N 1 1 217.356 3.522 20 0 BHADMO CCC[N@@H+](CC)Cc1cc2ccccc2o1 ZINC000472270900 528001290 /nfs/dbraw/zinc/00/12/90/528001290.db2.gz AMDGIOUSUOEAQL-UHFFFAOYSA-N 1 1 217.312 3.665 20 0 BHADMO C[N@@H+](Cc1cc2ccccc2o1)[C@H]1C=CCCC1 ZINC000472278770 529981265 /nfs/dbraw/zinc/98/12/65/529981265.db2.gz OOXKBIVQWJFDSE-AWEZNQCLSA-N 1 1 241.334 3.973 20 0 BHADMO C[N@@H+](Cc1cc2ccccc2o1)[C@@H]1C=CCCC1 ZINC000472278772 529980880 /nfs/dbraw/zinc/98/08/80/529980880.db2.gz OOXKBIVQWJFDSE-CQSZACIVSA-N 1 1 241.334 3.973 20 0 BHADMO CCCCC[N@H+]1CCCC[C@H]1c1cccn1C ZINC000472343196 528185002 /nfs/dbraw/zinc/18/50/02/528185002.db2.gz AMUJEOGBLWDBNE-HNNXBMFYSA-N 1 1 234.387 3.742 20 0 BHADMO CCCCC[N@H+]1CCCC[C@@H]1c1cccn1C ZINC000472343198 528184169 /nfs/dbraw/zinc/18/41/69/528184169.db2.gz AMUJEOGBLWDBNE-OAHLLOKOSA-N 1 1 234.387 3.742 20 0 BHADMO CCC[N@H+]1CC[C@@H](C)[C@@H]1c1cccc(F)c1 ZINC000472363365 528248853 /nfs/dbraw/zinc/24/88/53/528248853.db2.gz ZVCWXZIOAVABTP-BXUZGUMPSA-N 1 1 221.319 3.619 20 0 BHADMO CCC[N@H+]1CC[C@H](C)[C@H]1c1cccc(F)c1 ZINC000472363366 528254906 /nfs/dbraw/zinc/25/49/06/528254906.db2.gz ZVCWXZIOAVABTP-FZMZJTMJSA-N 1 1 221.319 3.619 20 0 BHADMO CCC[N@H+]1CC[C@@H](C)[C@H]1c1cccc(F)c1 ZINC000472363367 528248870 /nfs/dbraw/zinc/24/88/70/528248870.db2.gz ZVCWXZIOAVABTP-RISCZKNCSA-N 1 1 221.319 3.619 20 0 BHADMO CCC[N@H+]1CC[C@H](C)[C@@H]1c1cccc(F)c1 ZINC000472363368 528255095 /nfs/dbraw/zinc/25/50/95/528255095.db2.gz ZVCWXZIOAVABTP-SMDDNHRTSA-N 1 1 221.319 3.619 20 0 BHADMO Cc1cccc(N2CCC(C(C)(C)C)CC2)[nH+]1 ZINC000472430714 225096667 /nfs/dbraw/zinc/09/66/67/225096667.db2.gz JEUMLNZOOPSJLT-UHFFFAOYSA-N 1 1 232.371 3.653 20 0 BHADMO CSC[C@H]1CCC[N@H+]1C[C@H](C)c1ccccc1 ZINC000472570934 533816684 /nfs/dbraw/zinc/81/66/84/533816684.db2.gz QVZYJQCXFWLVLX-DZGCQCFKSA-N 1 1 249.423 3.618 20 0 BHADMO CSC[C@@H]1CCC[N@H+]1C[C@@H](C)c1ccccc1 ZINC000472570935 533749636 /nfs/dbraw/zinc/74/96/36/533749636.db2.gz QVZYJQCXFWLVLX-HIFRSBDPSA-N 1 1 249.423 3.618 20 0 BHADMO CSC[C@H]1CCC[N@H+]1C[C@@H](C)c1ccccc1 ZINC000472570936 533816592 /nfs/dbraw/zinc/81/65/92/533816592.db2.gz QVZYJQCXFWLVLX-UKRRQHHQSA-N 1 1 249.423 3.618 20 0 BHADMO CSC[C@@H]1CCC[N@H+]1C[C@H](C)c1ccccc1 ZINC000472570937 533748978 /nfs/dbraw/zinc/74/89/78/533748978.db2.gz QVZYJQCXFWLVLX-ZFWWWQNUSA-N 1 1 249.423 3.618 20 0 BHADMO C[C@@H]1C[C@@H]1C[N@H+]1CCCCC[C@H]1c1ccncc1 ZINC000472580222 533716735 /nfs/dbraw/zinc/71/67/35/533716735.db2.gz CNRLKSNPZANBQB-BMFZPTHFSA-N 1 1 244.382 3.655 20 0 BHADMO C[C@@H]1C[C@@H]1C[N@H+]1CCCCC[C@@H]1c1ccncc1 ZINC000472580236 533716606 /nfs/dbraw/zinc/71/66/06/533716606.db2.gz CNRLKSNPZANBQB-FVQBIDKESA-N 1 1 244.382 3.655 20 0 BHADMO C[C@@H]1C[C@H]1C[N@H+]1CCCCC[C@H]1c1ccncc1 ZINC000472580237 534021164 /nfs/dbraw/zinc/02/11/64/534021164.db2.gz CNRLKSNPZANBQB-KBMXLJTQSA-N 1 1 244.382 3.655 20 0 BHADMO C[C@@H]1C[C@H]1C[N@H+]1CCCCC[C@@H]1c1ccncc1 ZINC000472580238 534020532 /nfs/dbraw/zinc/02/05/32/534020532.db2.gz CNRLKSNPZANBQB-VNQPRFMTSA-N 1 1 244.382 3.655 20 0 BHADMO CC(C)COc1ccccc1C[N@@H+](C)C(C)C ZINC000472584274 528180728 /nfs/dbraw/zinc/18/07/28/528180728.db2.gz HJKOIAHUOLZMME-UHFFFAOYSA-N 1 1 235.371 3.562 20 0 BHADMO CCCC[N@@H+](C)[C@H](C)c1cccc(C)c1 ZINC000472849919 528368726 /nfs/dbraw/zinc/36/87/26/528368726.db2.gz JTFBPSICOCSWLR-CYBMUJFWSA-N 1 1 205.345 3.788 20 0 BHADMO CCCC[N@@H+](C)[C@@H](C)c1cccc(C)c1 ZINC000472849950 528368255 /nfs/dbraw/zinc/36/82/55/528368255.db2.gz JTFBPSICOCSWLR-ZDUSSCGKSA-N 1 1 205.345 3.788 20 0 BHADMO C(=C\c1ccccc1)\C[N@H+]1CCCC2(CC2)C1 ZINC000473070097 527470429 /nfs/dbraw/zinc/47/04/29/527470429.db2.gz FFPORNAPMMLUFK-YWEYNIOJSA-N 1 1 227.351 3.576 20 0 BHADMO C/C(=C\c1ccccc1)C[N@H+]1CCCC2(CC2)C1 ZINC000473070958 527532390 /nfs/dbraw/zinc/53/23/90/527532390.db2.gz GSEGWJXYXCWXJP-NTCAYCPXSA-N 1 1 241.378 3.966 20 0 BHADMO C/C(=C/c1ccccc1)C[N@H+]1CCCC2(CC2)C1 ZINC000473070961 527507275 /nfs/dbraw/zinc/50/72/75/527507275.db2.gz GSEGWJXYXCWXJP-QINSGFPZSA-N 1 1 241.378 3.966 20 0 BHADMO Fc1ccc(/C=C/C[N@H+]2CCCC3(CC3)C2)cc1 ZINC000473079584 534460387 /nfs/dbraw/zinc/46/03/87/534460387.db2.gz UJRIMANMRNUVJY-HNQUOIGGSA-N 1 1 245.341 3.715 20 0 BHADMO Fc1ccc(/C=C\C[N@H+]2CCCC3(CC3)C2)cc1 ZINC000473079591 225102986 /nfs/dbraw/zinc/10/29/86/225102986.db2.gz UJRIMANMRNUVJY-IWQZZHSRSA-N 1 1 245.341 3.715 20 0 BHADMO CC[C@H](C[N@H+]1CCC=C(F)C1)c1ccccc1 ZINC000473117080 529335043 /nfs/dbraw/zinc/33/50/43/529335043.db2.gz AEOSIURKJJHHIS-CYBMUJFWSA-N 1 1 233.330 3.739 20 0 BHADMO CC[C@@H](C[N@H+]1CCC=C(F)C1)c1ccccc1 ZINC000473117096 529473289 /nfs/dbraw/zinc/47/32/89/529473289.db2.gz AEOSIURKJJHHIS-ZDUSSCGKSA-N 1 1 233.330 3.739 20 0 BHADMO CC[N@@H+](Cc1cc2c(ccc(C)c2C)[nH]1)C1CC1 ZINC000473133002 528768132 /nfs/dbraw/zinc/76/81/32/528768132.db2.gz ONPMLYYJGVAHMF-UHFFFAOYSA-N 1 1 242.366 3.769 20 0 BHADMO Cc1ccc2[nH]c(C[N@@H+]3CCC[C@H]3C)cc2c1C ZINC000473136867 534352901 /nfs/dbraw/zinc/35/29/01/534352901.db2.gz BEMIICQNNOYPTA-GFCCVEGCSA-N 1 1 242.366 3.769 20 0 BHADMO Cc1ccc2[nH]c(C[N@@H+]3CCC[C@@H]3C)cc2c1C ZINC000473136868 534353341 /nfs/dbraw/zinc/35/33/41/534353341.db2.gz BEMIICQNNOYPTA-LBPRGKRZSA-N 1 1 242.366 3.769 20 0 BHADMO CCSc1cccc(C[N@@H+]2CC=C(C)CC2)c1 ZINC000473139468 529250411 /nfs/dbraw/zinc/25/04/11/529250411.db2.gz BFKZYQVVFXARKG-UHFFFAOYSA-N 1 1 247.407 3.951 20 0 BHADMO Cc1ccc2[nH]c(C[N@@H+]3CC[C@@H](C)C3)cc2c1C ZINC000473140345 534355703 /nfs/dbraw/zinc/35/57/03/534355703.db2.gz MKKGUXIAKQWPRK-LLVKDONJSA-N 1 1 242.366 3.627 20 0 BHADMO Cc1ccc2[nH]c(C[N@@H+]3CC[C@H](C)C3)cc2c1C ZINC000473140347 534355864 /nfs/dbraw/zinc/35/58/64/534355864.db2.gz MKKGUXIAKQWPRK-NSHDSACASA-N 1 1 242.366 3.627 20 0 BHADMO Cc1ccc2[nH]c(C[N@H+](C)C3CCC3)cc2c1C ZINC000473141282 534353748 /nfs/dbraw/zinc/35/37/48/534353748.db2.gz NOEWNNNNUSNYHB-UHFFFAOYSA-N 1 1 242.366 3.769 20 0 BHADMO CCC[N@@H+](C)Cc1cc2c(ccc(C)c2C)[nH]1 ZINC000473141503 527854638 /nfs/dbraw/zinc/85/46/38/527854638.db2.gz OUGZNEQIZGEAOI-UHFFFAOYSA-N 1 1 230.355 3.627 20 0 BHADMO Cc1ccc2[nH]c(C[N@@H+](C)CC3CC3)cc2c1C ZINC000473142948 534353728 /nfs/dbraw/zinc/35/37/28/534353728.db2.gz CYSJYMMYUURPRC-UHFFFAOYSA-N 1 1 242.366 3.627 20 0 BHADMO Cc1ccc2[nH]c(C[N@H+](C)CC(C)C)cc2c1C ZINC000473144101 534353965 /nfs/dbraw/zinc/35/39/65/534353965.db2.gz YYQQYECBWFUXSX-UHFFFAOYSA-N 1 1 244.382 3.873 20 0 BHADMO Cc1ccc2[nH]c(C[N@H+](C)C(C)C)cc2c1C ZINC000473146930 534352190 /nfs/dbraw/zinc/35/21/90/534352190.db2.gz MHRKSKOTSOUMAK-UHFFFAOYSA-N 1 1 230.355 3.625 20 0 BHADMO Cc1ccccc1[C@H](C)[N@H+]1CCCC2(CC2)C1 ZINC000473436914 225104399 /nfs/dbraw/zinc/10/43/99/225104399.db2.gz KEZRFASGGYSLJW-AWEZNQCLSA-N 1 1 229.367 3.932 20 0 BHADMO Cc1ccccc1[C@@H](C)[N@H+]1CCCC2(CC2)C1 ZINC000473436919 225104490 /nfs/dbraw/zinc/10/44/90/225104490.db2.gz KEZRFASGGYSLJW-CQSZACIVSA-N 1 1 229.367 3.932 20 0 BHADMO C[C@@H](C[N@H+]1CCCC2(CC2)C1)c1ccccc1 ZINC000473440521 533816778 /nfs/dbraw/zinc/81/67/78/533816778.db2.gz UPGWDWOUFPIFPG-AWEZNQCLSA-N 1 1 229.367 3.666 20 0 BHADMO C[C@H](C[N@H+]1CCCC2(CC2)C1)c1ccccc1 ZINC000473440522 225104544 /nfs/dbraw/zinc/10/45/44/225104544.db2.gz UPGWDWOUFPIFPG-CQSZACIVSA-N 1 1 229.367 3.666 20 0 BHADMO Fc1cccc(CCC[N@H+]2CCCC3(CC3)C2)c1 ZINC000473444120 225103659 /nfs/dbraw/zinc/10/36/59/225103659.db2.gz XUUHISSEGPUCSM-UHFFFAOYSA-N 1 1 247.357 3.634 20 0 BHADMO c1ccc2c(c1)CCC[C@@H]2[N@H+]1CCCC2(CC2)C1 ZINC000473445122 225103681 /nfs/dbraw/zinc/10/36/81/225103681.db2.gz RRZGBXIFCLHYRZ-INIZCTEOSA-N 1 1 241.378 3.940 20 0 BHADMO c1ccc2c(c1)CCC[C@H]2[N@H+]1CCCC2(CC2)C1 ZINC000473445123 225104221 /nfs/dbraw/zinc/10/42/21/225104221.db2.gz RRZGBXIFCLHYRZ-MRXNPFEDSA-N 1 1 241.378 3.940 20 0 BHADMO C[C@@H](CCc1ccccc1)[N@H+]1CCCC2(CC2)C1 ZINC000473445393 533674012 /nfs/dbraw/zinc/67/40/12/533674012.db2.gz UBILNADNJFCGRS-HNNXBMFYSA-N 1 1 243.394 3.884 20 0 BHADMO C[C@H](CCc1ccccc1)[N@H+]1CCCC2(CC2)C1 ZINC000473445394 533993029 /nfs/dbraw/zinc/99/30/29/533993029.db2.gz UBILNADNJFCGRS-OAHLLOKOSA-N 1 1 243.394 3.884 20 0 BHADMO Cc1cccc([C@H](C)[N@H+]2CCCC3(CC3)C2)c1 ZINC000473454139 225103737 /nfs/dbraw/zinc/10/37/37/225103737.db2.gz OGSAFETWCUDMTC-AWEZNQCLSA-N 1 1 229.367 3.932 20 0 BHADMO Cc1cccc([C@@H](C)[N@H+]2CCCC3(CC3)C2)c1 ZINC000473454140 225104571 /nfs/dbraw/zinc/10/45/71/225104571.db2.gz OGSAFETWCUDMTC-CQSZACIVSA-N 1 1 229.367 3.932 20 0 BHADMO CC(C)[C@H](C[N@@H+](C)C(C)C)c1ccccc1 ZINC000474093266 528988960 /nfs/dbraw/zinc/98/89/60/528988960.db2.gz CHUKWIAYFLONTH-HNNXBMFYSA-N 1 1 219.372 3.766 20 0 BHADMO CC(C)[C@@H](C[N@@H+](C)C(C)C)c1ccccc1 ZINC000474093267 528437498 /nfs/dbraw/zinc/43/74/98/528437498.db2.gz CHUKWIAYFLONTH-OAHLLOKOSA-N 1 1 219.372 3.766 20 0 BHADMO CCC[N@@H+](C)C[C@H](c1ccccc1)C(C)C ZINC000474105897 527840062 /nfs/dbraw/zinc/84/00/62/527840062.db2.gz NVWLYUOEXZRWKT-HNNXBMFYSA-N 1 1 219.372 3.768 20 0 BHADMO CCC[N@@H+](C)C[C@@H](c1ccccc1)C(C)C ZINC000474105899 527826129 /nfs/dbraw/zinc/82/61/29/527826129.db2.gz NVWLYUOEXZRWKT-OAHLLOKOSA-N 1 1 219.372 3.768 20 0 BHADMO CCc1cccc(F)c1C[N@H+](CC)C(C)C ZINC000474106229 529174071 /nfs/dbraw/zinc/17/40/71/529174071.db2.gz MZLGLAZISWTZCI-UHFFFAOYSA-N 1 1 223.335 3.618 20 0 BHADMO CC[N@@H+](C)C[C@H](CC(C)C)c1ccccc1 ZINC000474106330 527824299 /nfs/dbraw/zinc/82/42/99/527824299.db2.gz NSAMZEAUBRBCRO-HNNXBMFYSA-N 1 1 219.372 3.768 20 0 BHADMO CC[N@@H+](C)C[C@@H](CC(C)C)c1ccccc1 ZINC000474106333 527801837 /nfs/dbraw/zinc/80/18/37/527801837.db2.gz NSAMZEAUBRBCRO-OAHLLOKOSA-N 1 1 219.372 3.768 20 0 BHADMO CCc1cccc(F)c1C[N@@H+](C)[C@H](C)C1CC1 ZINC000474150689 529172143 /nfs/dbraw/zinc/17/21/43/529172143.db2.gz BHOHMTQGQIWDNZ-LLVKDONJSA-N 1 1 235.346 3.618 20 0 BHADMO CCc1cccc(F)c1C[N@@H+](C)[C@@H](C)C1CC1 ZINC000474150690 529172408 /nfs/dbraw/zinc/17/24/08/529172408.db2.gz BHOHMTQGQIWDNZ-NSHDSACASA-N 1 1 235.346 3.618 20 0 BHADMO CC(C)[C@H](C[N@@H+](C)C1CC1)c1ccccc1 ZINC000474150926 528989511 /nfs/dbraw/zinc/98/95/11/528989511.db2.gz CAOWOJBADLZNJQ-HNNXBMFYSA-N 1 1 217.356 3.520 20 0 BHADMO CC(C)[C@@H](C[N@@H+](C)C1CC1)c1ccccc1 ZINC000474150927 528438444 /nfs/dbraw/zinc/43/84/44/528438444.db2.gz CAOWOJBADLZNJQ-OAHLLOKOSA-N 1 1 217.356 3.520 20 0 BHADMO CC(C)[C@H](C[N@@H+](C)CC1CC1)c1ccccc1 ZINC000474151812 528989869 /nfs/dbraw/zinc/98/98/69/528989869.db2.gz ROQMJOXXQAYZPC-INIZCTEOSA-N 1 1 231.383 3.768 20 0 BHADMO CC(C)[C@@H](C[N@@H+](C)CC1CC1)c1ccccc1 ZINC000474151813 528437823 /nfs/dbraw/zinc/43/78/23/528437823.db2.gz ROQMJOXXQAYZPC-MRXNPFEDSA-N 1 1 231.383 3.768 20 0 BHADMO CCc1cccc(F)c1C[N@H+](C)[C@H](C)CC ZINC000474152241 529172399 /nfs/dbraw/zinc/17/23/99/529172399.db2.gz UATHCUZXPHJHEQ-LLVKDONJSA-N 1 1 223.335 3.618 20 0 BHADMO CCc1cccc(F)c1C[N@H+](C)[C@@H](C)CC ZINC000474152242 529172425 /nfs/dbraw/zinc/17/24/25/529172425.db2.gz UATHCUZXPHJHEQ-NSHDSACASA-N 1 1 223.335 3.618 20 0 BHADMO CCC[N@@H+](Cc1ccc(F)cc1)C(C)(C)C ZINC000474155359 528138900 /nfs/dbraw/zinc/13/89/00/528138900.db2.gz BROCFPHZLNMUBR-UHFFFAOYSA-N 1 1 223.335 3.836 20 0 BHADMO COCCCCC[N@@H+](CC(C)C)CC(C)(C)C ZINC000474216651 225115260 /nfs/dbraw/zinc/11/52/60/225115260.db2.gz FJCOPQYBSGVWDI-UHFFFAOYSA-N 1 1 243.435 3.807 20 0 BHADMO CCC[N@H+]1CCC[C@H]1c1cc(C)ccc1C ZINC000474221836 528235881 /nfs/dbraw/zinc/23/58/81/528235881.db2.gz VRZDIJGIQWQOQA-HNNXBMFYSA-N 1 1 217.356 3.850 20 0 BHADMO CCC[N@H+]1CCC[C@@H]1c1cc(C)ccc1C ZINC000474221837 528225733 /nfs/dbraw/zinc/22/57/33/528225733.db2.gz VRZDIJGIQWQOQA-OAHLLOKOSA-N 1 1 217.356 3.850 20 0 BHADMO Cc1ccncc1C[N@H+]1[C@H](C)C[C@H]2CCCC[C@@H]21 ZINC000474259093 225115102 /nfs/dbraw/zinc/11/51/02/225115102.db2.gz NSSWDFIQIMAOAP-FMKPAKJESA-N 1 1 244.382 3.543 20 0 BHADMO Cc1ccncc1C[N@H+]1[C@H](C)C[C@H]2CCCC[C@H]21 ZINC000474259095 225115304 /nfs/dbraw/zinc/11/53/04/225115304.db2.gz NSSWDFIQIMAOAP-IIAWOOMASA-N 1 1 244.382 3.543 20 0 BHADMO Cc1ccncc1C[N@H+]1[C@H](C)C[C@@H]2CCCC[C@H]21 ZINC000474259097 225114735 /nfs/dbraw/zinc/11/47/35/225114735.db2.gz NSSWDFIQIMAOAP-IJEWVQPXSA-N 1 1 244.382 3.543 20 0 BHADMO Cc1ccncc1C[N@H+]1[C@H](C)C[C@@H]2CCCC[C@@H]21 ZINC000474259098 225115271 /nfs/dbraw/zinc/11/52/71/225115271.db2.gz NSSWDFIQIMAOAP-YCPHGPKFSA-N 1 1 244.382 3.543 20 0 BHADMO Cc1ccncc1C[N@@H+](C)CCC1CCCCC1 ZINC000474262453 225115178 /nfs/dbraw/zinc/11/51/78/225115178.db2.gz CWVNXNFIGZAYFD-UHFFFAOYSA-N 1 1 246.398 3.792 20 0 BHADMO Cc1ccncc1C[N@@H+]1CCC[C@H](C(C)C)CC1 ZINC000474265737 225114335 /nfs/dbraw/zinc/11/43/35/225114335.db2.gz IAPYQWIADAHXKF-HNNXBMFYSA-N 1 1 246.398 3.648 20 0 BHADMO Cc1ccncc1C[N@@H+]1CCC[C@@H](C(C)C)CC1 ZINC000474265738 225115202 /nfs/dbraw/zinc/11/52/02/225115202.db2.gz IAPYQWIADAHXKF-OAHLLOKOSA-N 1 1 246.398 3.648 20 0 BHADMO CCc1cccc(F)c1C[N@H+]1CCC12CCC2 ZINC000474270375 529173248 /nfs/dbraw/zinc/17/32/48/529173248.db2.gz COIYEIKYLTXYMH-UHFFFAOYSA-N 1 1 233.330 3.517 20 0 BHADMO Cc1ccncc1C[N@H+](CC(C)C)CC(C)(C)C ZINC000474270719 225115190 /nfs/dbraw/zinc/11/51/90/225115190.db2.gz NARKACBOKYRRES-UHFFFAOYSA-N 1 1 248.414 3.894 20 0 BHADMO CCOCCC[N@@H+](Cc1ccccc1)C(C)(C)C ZINC000474279548 528659225 /nfs/dbraw/zinc/65/92/25/528659225.db2.gz XVZOHHFCHFLICV-UHFFFAOYSA-N 1 1 249.398 3.714 20 0 BHADMO CC(C)[C@H](C[N@@H+](C)C1CCC1)c1ccccc1 ZINC000474279785 528989536 /nfs/dbraw/zinc/98/95/36/528989536.db2.gz SURFVCUHNNTDDE-INIZCTEOSA-N 1 1 231.383 3.911 20 0 BHADMO CC(C)[C@@H](C[N@@H+](C)C1CCC1)c1ccccc1 ZINC000474279786 528437338 /nfs/dbraw/zinc/43/73/38/528437338.db2.gz SURFVCUHNNTDDE-MRXNPFEDSA-N 1 1 231.383 3.911 20 0 BHADMO CCc1cccc(Cl)c1C[NH2+]Cc1ccco1 ZINC000474345422 529172818 /nfs/dbraw/zinc/17/28/18/529172818.db2.gz GYFVWJQGNOWFOD-UHFFFAOYSA-N 1 1 249.741 3.785 20 0 BHADMO CCCCC[C@H]1CCC[N@H+]1Cc1cnccc1C ZINC000474383227 528275305 /nfs/dbraw/zinc/27/53/05/528275305.db2.gz AAEHSXNFMOQARL-INIZCTEOSA-N 1 1 246.398 3.935 20 0 BHADMO CCCCC[C@@H]1CCC[N@H+]1Cc1cnccc1C ZINC000474383228 528261581 /nfs/dbraw/zinc/26/15/81/528261581.db2.gz AAEHSXNFMOQARL-MRXNPFEDSA-N 1 1 246.398 3.935 20 0 BHADMO CCc1cccc(F)c1CNc1cc(C)cc[nH+]1 ZINC000474613573 529174825 /nfs/dbraw/zinc/17/48/25/529174825.db2.gz MHDSMFADBPSCMR-UHFFFAOYSA-N 1 1 244.313 3.704 20 0 BHADMO CCc1cccc(F)c1CNc1ccc(C)c[nH+]1 ZINC000474619761 529174688 /nfs/dbraw/zinc/17/46/88/529174688.db2.gz VRNVOKZSOHOZFI-UHFFFAOYSA-N 1 1 244.313 3.704 20 0 BHADMO CC(C)[N@@H+](C[C@H]1CC[C@H](C)O1)C1CCCCC1 ZINC000474973873 528936354 /nfs/dbraw/zinc/93/63/54/528936354.db2.gz OHFWVNNBPYUIMN-DZGCQCFKSA-N 1 1 239.403 3.597 20 0 BHADMO CC(C)[N@@H+](C[C@@H]1CC[C@@H](C)O1)C1CCCCC1 ZINC000474973874 528925849 /nfs/dbraw/zinc/92/58/49/528925849.db2.gz OHFWVNNBPYUIMN-HIFRSBDPSA-N 1 1 239.403 3.597 20 0 BHADMO CC(C)[N@@H+](C[C@H]1CC[C@@H](C)O1)C1CCCCC1 ZINC000474973877 528936442 /nfs/dbraw/zinc/93/64/42/528936442.db2.gz OHFWVNNBPYUIMN-UKRRQHHQSA-N 1 1 239.403 3.597 20 0 BHADMO CC(C)[N@@H+](C[C@@H]1CC[C@H](C)O1)C1CCCCC1 ZINC000474973879 528925762 /nfs/dbraw/zinc/92/57/62/528925762.db2.gz OHFWVNNBPYUIMN-ZFWWWQNUSA-N 1 1 239.403 3.597 20 0 BHADMO C[C@H]1C[N@H+](CCCCOC(C)(C)C)CC[C@@H]1C ZINC000474977051 533928748 /nfs/dbraw/zinc/92/87/48/533928748.db2.gz MLEFWNMECBWLTK-KBPBESRZSA-N 1 1 241.419 3.560 20 0 BHADMO C[C@@H]1CC[N@@H+](CCCCOC(C)(C)C)C[C@@H]1C ZINC000474977052 534031579 /nfs/dbraw/zinc/03/15/79/534031579.db2.gz MLEFWNMECBWLTK-KGLIPLIRSA-N 1 1 241.419 3.560 20 0 BHADMO C[C@H]1CC[N@@H+](CCCCOC(C)(C)C)C[C@H]1C ZINC000474977053 225124211 /nfs/dbraw/zinc/12/42/11/225124211.db2.gz MLEFWNMECBWLTK-UONOGXRCSA-N 1 1 241.419 3.560 20 0 BHADMO C[C@@H]1CC[N@@H+](CCCCOC(C)(C)C)C[C@H]1C ZINC000474977054 534031266 /nfs/dbraw/zinc/03/12/66/534031266.db2.gz MLEFWNMECBWLTK-ZIAGYGMSSA-N 1 1 241.419 3.560 20 0 BHADMO CC[C@@H](C)C[N@@H+](C)CCCCOC(C)(C)C ZINC000474978657 529313873 /nfs/dbraw/zinc/31/38/73/529313873.db2.gz ZKWHFUYDLDYALK-CYBMUJFWSA-N 1 1 229.408 3.560 20 0 BHADMO CC[C@H](C)C[N@@H+](C)CCCCOC(C)(C)C ZINC000474978661 529650927 /nfs/dbraw/zinc/65/09/27/529650927.db2.gz ZKWHFUYDLDYALK-ZDUSSCGKSA-N 1 1 229.408 3.560 20 0 BHADMO CC[C@H]1CCC[N@@H+](CCCCOC(C)(C)C)C1 ZINC000475023121 529217159 /nfs/dbraw/zinc/21/71/59/529217159.db2.gz LZWWXSMRSXXLGA-AWEZNQCLSA-N 1 1 241.419 3.704 20 0 BHADMO CC[C@@H]1CCC[N@@H+](CCCCOC(C)(C)C)C1 ZINC000475023122 529298875 /nfs/dbraw/zinc/29/88/75/529298875.db2.gz LZWWXSMRSXXLGA-CQSZACIVSA-N 1 1 241.419 3.704 20 0 BHADMO C[N@@H+](CCCCOC(C)(C)C)CC(C)(C)C ZINC000475024983 529884983 /nfs/dbraw/zinc/88/49/83/529884983.db2.gz VZRHWCPXMDEQND-UHFFFAOYSA-N 1 1 229.408 3.560 20 0 BHADMO C[C@H]1CC[C@H](C)[N@@H+](CCCCOC(C)(C)C)C1 ZINC000475028197 225125676 /nfs/dbraw/zinc/12/56/76/225125676.db2.gz XRQCDPXVOFIEKI-KBPBESRZSA-N 1 1 241.419 3.702 20 0 BHADMO C[C@@H]1CC[C@H](C)[N@@H+](CCCCOC(C)(C)C)C1 ZINC000475028198 534222554 /nfs/dbraw/zinc/22/25/54/534222554.db2.gz XRQCDPXVOFIEKI-KGLIPLIRSA-N 1 1 241.419 3.702 20 0 BHADMO C[C@@H]1CC[C@H](C)C[N@@H+]1CCCCOC(C)(C)C ZINC000475028200 534219293 /nfs/dbraw/zinc/21/92/93/534219293.db2.gz XRQCDPXVOFIEKI-UONOGXRCSA-N 1 1 241.419 3.702 20 0 BHADMO C[C@@H]1CC[C@@H](C)[N@@H+](CCCCOC(C)(C)C)C1 ZINC000475028201 225125882 /nfs/dbraw/zinc/12/58/82/225125882.db2.gz XRQCDPXVOFIEKI-ZIAGYGMSSA-N 1 1 241.419 3.702 20 0 BHADMO C[C@H]1C[N@@H+](CCCCOC(C)(C)C)C(C)(C)C1 ZINC000475028246 533930346 /nfs/dbraw/zinc/93/03/46/533930346.db2.gz YLGVAEOZCHBWHC-CYBMUJFWSA-N 1 1 241.419 3.702 20 0 BHADMO C[C@@H]1C[N@@H+](CCCCOC(C)(C)C)C(C)(C)C1 ZINC000475028247 534463223 /nfs/dbraw/zinc/46/32/23/534463223.db2.gz YLGVAEOZCHBWHC-ZDUSSCGKSA-N 1 1 241.419 3.702 20 0 BHADMO CC[C@@]1(C)CC[N@@H+](CCCCOC(C)(C)C)C1 ZINC000475034029 529527327 /nfs/dbraw/zinc/52/73/27/529527327.db2.gz LXSCHACVKLJKMI-HNNXBMFYSA-N 1 1 241.419 3.704 20 0 BHADMO CC[C@]1(C)CC[N@@H+](CCCCOC(C)(C)C)C1 ZINC000475034030 529400195 /nfs/dbraw/zinc/40/01/95/529400195.db2.gz LXSCHACVKLJKMI-OAHLLOKOSA-N 1 1 241.419 3.704 20 0 BHADMO CC(C)[C@@H]1CCC[N@H+]1CCCCOC(C)(C)C ZINC000475038823 528673964 /nfs/dbraw/zinc/67/39/64/528673964.db2.gz MWXUIHPJZZQFPB-AWEZNQCLSA-N 1 1 241.419 3.702 20 0 BHADMO CC(C)[C@H]1CCC[N@H+]1CCCCOC(C)(C)C ZINC000475038825 527782538 /nfs/dbraw/zinc/78/25/38/527782538.db2.gz MWXUIHPJZZQFPB-CQSZACIVSA-N 1 1 241.419 3.702 20 0 BHADMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCCCOC(C)(C)C ZINC000475039142 533827733 /nfs/dbraw/zinc/82/77/33/533827733.db2.gz OUILVPURDWEIBJ-OKILXGFUSA-N 1 1 241.419 3.845 20 0 BHADMO CC[C@H]1C[C@H](C)C[N@H+]1CCCCOC(C)(C)C ZINC000475040029 529325422 /nfs/dbraw/zinc/32/54/22/529325422.db2.gz TUPVRMBTOCAELP-KBPBESRZSA-N 1 1 241.419 3.702 20 0 BHADMO CC[C@H]1C[C@@H](C)C[N@H+]1CCCCOC(C)(C)C ZINC000475040030 529316524 /nfs/dbraw/zinc/31/65/24/529316524.db2.gz TUPVRMBTOCAELP-KGLIPLIRSA-N 1 1 241.419 3.702 20 0 BHADMO CC[C@@H]1C[C@H](C)C[N@H+]1CCCCOC(C)(C)C ZINC000475040031 529439254 /nfs/dbraw/zinc/43/92/54/529439254.db2.gz TUPVRMBTOCAELP-UONOGXRCSA-N 1 1 241.419 3.702 20 0 BHADMO CC[C@@H]1C[C@@H](C)C[N@H+]1CCCCOC(C)(C)C ZINC000475040032 529423455 /nfs/dbraw/zinc/42/34/55/529423455.db2.gz TUPVRMBTOCAELP-ZIAGYGMSSA-N 1 1 241.419 3.702 20 0 BHADMO CCCCC[C@@H]1CCC[N@H+]1C[C@@H]1CC[C@@H](C)O1 ZINC000475043824 528262135 /nfs/dbraw/zinc/26/21/35/528262135.db2.gz FTXMGKFWMYQXAX-KFWWJZLASA-N 1 1 239.403 3.599 20 0 BHADMO CCCCC[C@@H]1CCC[N@H+]1C[C@H]1CC[C@@H](C)O1 ZINC000475043825 528262510 /nfs/dbraw/zinc/26/25/10/528262510.db2.gz FTXMGKFWMYQXAX-RBSFLKMASA-N 1 1 239.403 3.599 20 0 BHADMO CCCCC[C@@H]1CCC[N@H+]1C[C@H]1CC[C@H](C)O1 ZINC000475043826 528262100 /nfs/dbraw/zinc/26/21/00/528262100.db2.gz FTXMGKFWMYQXAX-RRFJBIMHSA-N 1 1 239.403 3.599 20 0 BHADMO CCCCC[C@@H]1CCC[N@H+]1C[C@@H]1CC[C@H](C)O1 ZINC000475043827 528262184 /nfs/dbraw/zinc/26/21/84/528262184.db2.gz FTXMGKFWMYQXAX-ZNMIVQPWSA-N 1 1 239.403 3.599 20 0 BHADMO C[C@@H]1C[C@H](C)C[N@H+](CCCCOC(C)(C)C)C1 ZINC000475044026 533798134 /nfs/dbraw/zinc/79/81/34/533798134.db2.gz ASDYQTRNDTZVKW-OKILXGFUSA-N 1 1 241.419 3.560 20 0 BHADMO Cc1cccc(N(C)C[C@@H](C)c2ccccc2)[nH+]1 ZINC000475044335 534742393 /nfs/dbraw/zinc/74/23/93/534742393.db2.gz DGPGTVDJZMLSOY-CYBMUJFWSA-N 1 1 240.350 3.630 20 0 BHADMO Cc1cccc(N(C)C[C@H](C)c2ccccc2)[nH+]1 ZINC000475044338 534742667 /nfs/dbraw/zinc/74/26/67/534742667.db2.gz DGPGTVDJZMLSOY-ZDUSSCGKSA-N 1 1 240.350 3.630 20 0 BHADMO CC(C)[C@@H](C)[N@@H+](C)CCCCOC(C)(C)C ZINC000475046371 528407358 /nfs/dbraw/zinc/40/73/58/528407358.db2.gz DFJKTXUEUDIEHM-CYBMUJFWSA-N 1 1 229.408 3.558 20 0 BHADMO CC(C)[C@H](C)[N@@H+](C)CCCCOC(C)(C)C ZINC000475046372 528957734 /nfs/dbraw/zinc/95/77/34/528957734.db2.gz DFJKTXUEUDIEHM-ZDUSSCGKSA-N 1 1 229.408 3.558 20 0 BHADMO CCCC[N@@H+](C)CC[C@H](C)OCc1ccccc1 ZINC000475046663 528349168 /nfs/dbraw/zinc/34/91/68/528349168.db2.gz IXLUFVAJKOSYOH-HNNXBMFYSA-N 1 1 249.398 3.714 20 0 BHADMO CCCC[N@@H+](C)CC[C@@H](C)OCc1ccccc1 ZINC000475046664 528349116 /nfs/dbraw/zinc/34/91/16/528349116.db2.gz IXLUFVAJKOSYOH-OAHLLOKOSA-N 1 1 249.398 3.714 20 0 BHADMO CC(C)C[N@@H+](CCCCOC(C)(C)C)C1CC1 ZINC000475047149 527938974 /nfs/dbraw/zinc/93/89/74/527938974.db2.gz KDSAZTMACXNJNP-UHFFFAOYSA-N 1 1 241.419 3.702 20 0 BHADMO CC(C)[C@H]1CC[N@@H+](CCCCOC(C)(C)C)C1 ZINC000475047303 527800065 /nfs/dbraw/zinc/80/00/65/527800065.db2.gz GQSVNCCQLWIREV-AWEZNQCLSA-N 1 1 241.419 3.560 20 0 BHADMO CC(C)[C@@H]1CC[N@@H+](CCCCOC(C)(C)C)C1 ZINC000475047305 528698477 /nfs/dbraw/zinc/69/84/77/528698477.db2.gz GQSVNCCQLWIREV-CQSZACIVSA-N 1 1 241.419 3.560 20 0 BHADMO CCC[N@@H+](CCCCOC(C)(C)C)CC(C)C ZINC000475047714 528064210 /nfs/dbraw/zinc/06/42/10/528064210.db2.gz MARJYQAQMFSRJX-UHFFFAOYSA-N 1 1 243.435 3.950 20 0 BHADMO CC[C@H]1CCCC[N@H+]1CCCCOC(C)(C)C ZINC000475050202 529199903 /nfs/dbraw/zinc/19/99/03/529199903.db2.gz UPBWQIKXUSIMEZ-AWEZNQCLSA-N 1 1 241.419 3.846 20 0 BHADMO CC[C@@H]1CCCC[N@H+]1CCCCOC(C)(C)C ZINC000475050204 529271701 /nfs/dbraw/zinc/27/17/01/529271701.db2.gz UPBWQIKXUSIMEZ-CQSZACIVSA-N 1 1 241.419 3.846 20 0 BHADMO CCCC[N@@H+](CCCCOC(C)(C)C)C1CC1 ZINC000475050240 528407695 /nfs/dbraw/zinc/40/76/95/528407695.db2.gz UVJJVBHGGDHTDY-UHFFFAOYSA-N 1 1 241.419 3.846 20 0 BHADMO C[N@@H+](CCCCOC(C)(C)C)C1CCCCC1 ZINC000475050692 529884858 /nfs/dbraw/zinc/88/48/58/529884858.db2.gz XHSOTTCTODGOOP-UHFFFAOYSA-N 1 1 241.419 3.846 20 0 BHADMO CC(C)C[N@@H+](CCCCOC(C)(C)C)C(C)C ZINC000475051111 527939124 /nfs/dbraw/zinc/93/91/24/527939124.db2.gz YJZJZFVZLDMZGL-UHFFFAOYSA-N 1 1 243.435 3.948 20 0 BHADMO CC[C@H](C)C[N@@H+](CC)CCCCOC(C)(C)C ZINC000475053408 529657421 /nfs/dbraw/zinc/65/74/21/529657421.db2.gz LSJXQORVJYHMCX-AWEZNQCLSA-N 1 1 243.435 3.950 20 0 BHADMO CC[C@@H](C)C[N@@H+](CC)CCCCOC(C)(C)C ZINC000475053409 529318979 /nfs/dbraw/zinc/31/89/79/529318979.db2.gz LSJXQORVJYHMCX-CQSZACIVSA-N 1 1 243.435 3.950 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)CCCCOC(C)(C)C ZINC000475055266 528886812 /nfs/dbraw/zinc/88/68/12/528886812.db2.gz UMSSKKINPRNKDK-CYBMUJFWSA-N 1 1 229.408 3.702 20 0 BHADMO CCC[C@H](C)[N@@H+](C)CCCCOC(C)(C)C ZINC000475055267 528046043 /nfs/dbraw/zinc/04/60/43/528046043.db2.gz UMSSKKINPRNKDK-ZDUSSCGKSA-N 1 1 229.408 3.702 20 0 BHADMO CC[N@@H+](CCCCOC(C)(C)C)CC(C)C ZINC000475055404 528432354 /nfs/dbraw/zinc/43/23/54/528432354.db2.gz YSNSDQLYLQXIIO-UHFFFAOYSA-N 1 1 229.408 3.560 20 0 BHADMO C[C@H]1CCC[N@@H+](CCCCOC(C)(C)C)[C@H]1C ZINC000475056066 225128185 /nfs/dbraw/zinc/12/81/85/225128185.db2.gz UDIKTSMBUUDRAP-KBPBESRZSA-N 1 1 241.419 3.702 20 0 BHADMO C[C@@H]1CCC[N@@H+](CCCCOC(C)(C)C)[C@H]1C ZINC000475056067 225127815 /nfs/dbraw/zinc/12/78/15/225127815.db2.gz UDIKTSMBUUDRAP-KGLIPLIRSA-N 1 1 241.419 3.702 20 0 BHADMO C[C@@H]1[C@@H](C)CCC[N@H+]1CCCCOC(C)(C)C ZINC000475056068 534230922 /nfs/dbraw/zinc/23/09/22/534230922.db2.gz UDIKTSMBUUDRAP-UONOGXRCSA-N 1 1 241.419 3.702 20 0 BHADMO C[C@@H]1CCC[N@@H+](CCCCOC(C)(C)C)[C@@H]1C ZINC000475056069 225127323 /nfs/dbraw/zinc/12/73/23/225127323.db2.gz UDIKTSMBUUDRAP-ZIAGYGMSSA-N 1 1 241.419 3.702 20 0 BHADMO C[N@@H+](CCCCOC(C)(C)C)CC1CCCC1 ZINC000475057464 529884868 /nfs/dbraw/zinc/88/48/68/529884868.db2.gz ZHOPFISCWBOEER-UHFFFAOYSA-N 1 1 241.419 3.704 20 0 BHADMO CC[N@@H+](CCCCOC(C)(C)C)[C@@H](C)C(C)C ZINC000475058219 528432303 /nfs/dbraw/zinc/43/23/03/528432303.db2.gz QZXQVMNSSGMKGS-AWEZNQCLSA-N 1 1 243.435 3.948 20 0 BHADMO CC[N@@H+](CCCCOC(C)(C)C)[C@H](C)C(C)C ZINC000475058220 528432479 /nfs/dbraw/zinc/43/24/79/528432479.db2.gz QZXQVMNSSGMKGS-CQSZACIVSA-N 1 1 243.435 3.948 20 0 BHADMO CCC[N@@H+](CCCCOC(C)(C)C)CC1CC1 ZINC000475059116 528063084 /nfs/dbraw/zinc/06/30/84/528063084.db2.gz HUPQXWXSFFXKDM-UHFFFAOYSA-N 1 1 241.419 3.704 20 0 BHADMO CC(C)(C)OCCCC[N@H+]1CCCC(C)(C)C1 ZINC000475061509 526549524 /nfs/dbraw/zinc/54/95/24/526549524.db2.gz GEUDNZJJXQPGLW-UHFFFAOYSA-N 1 1 241.419 3.704 20 0 BHADMO CCCC[N@@H+](CC)CCCCOC(C)(C)C ZINC000475064628 528393071 /nfs/dbraw/zinc/39/30/71/528393071.db2.gz WVXRKLYWSAOAEM-UHFFFAOYSA-N 1 1 229.408 3.704 20 0 BHADMO C[C@H]1CCCCC[N@H+]1CCCCOC(C)(C)C ZINC000475069234 225127645 /nfs/dbraw/zinc/12/76/45/225127645.db2.gz QJVKXDWUPHDLEI-AWEZNQCLSA-N 1 1 241.419 3.846 20 0 BHADMO C[C@@H]1CCCCC[N@H+]1CCCCOC(C)(C)C ZINC000475069235 225127759 /nfs/dbraw/zinc/12/77/59/225127759.db2.gz QJVKXDWUPHDLEI-CQSZACIVSA-N 1 1 241.419 3.846 20 0 BHADMO C[C@@H]1C[C@H](C)[C@@H](C)[N@@H+](Cc2cccs2)C1 ZINC000475149133 533818963 /nfs/dbraw/zinc/81/89/63/533818963.db2.gz FXWNBRXCNQYUKD-GRYCIOLGSA-N 1 1 223.385 3.615 20 0 BHADMO C[C@@H]1C[C@@H](C)[C@@H](C)[N@@H+](Cc2cccs2)C1 ZINC000475149134 225129260 /nfs/dbraw/zinc/12/92/60/225129260.db2.gz FXWNBRXCNQYUKD-IJLUTSLNSA-N 1 1 223.385 3.615 20 0 BHADMO C[C@@H]1C[C@@H](C)[C@H](C)[N@@H+](Cc2cccs2)C1 ZINC000475149135 225128849 /nfs/dbraw/zinc/12/88/49/225128849.db2.gz FXWNBRXCNQYUKD-UTUOFQBUSA-N 1 1 223.385 3.615 20 0 BHADMO C[C@@H]1C[C@H](C)[C@H](C)[N@@H+](Cc2cccs2)C1 ZINC000475149136 225128940 /nfs/dbraw/zinc/12/89/40/225128940.db2.gz FXWNBRXCNQYUKD-WOPDTQHZSA-N 1 1 223.385 3.615 20 0 BHADMO Cc1ccncc1C[N@H+](C)[C@@H](C)C1CCCCC1 ZINC000475220189 225131207 /nfs/dbraw/zinc/13/12/07/225131207.db2.gz NPHAYADHNAOGEO-AWEZNQCLSA-N 1 1 246.398 3.791 20 0 BHADMO CCC(CC)C[N@H+]1CC[C@@H](C(F)(F)F)[C@@H]1C ZINC000475274463 528753958 /nfs/dbraw/zinc/75/39/58/528753958.db2.gz CFZDOVCBKZUTMQ-GXSJLCMTSA-N 1 1 237.309 3.695 20 0 BHADMO CCC(CC)C[N@H+]1CC[C@H](C(F)(F)F)[C@H]1C ZINC000475274464 528753989 /nfs/dbraw/zinc/75/39/89/528753989.db2.gz CFZDOVCBKZUTMQ-KOLCDFICSA-N 1 1 237.309 3.695 20 0 BHADMO CCC(CC)C[N@H+]1CC[C@@H](C(F)(F)F)[C@H]1C ZINC000475274465 528754439 /nfs/dbraw/zinc/75/44/39/528754439.db2.gz CFZDOVCBKZUTMQ-MWLCHTKSSA-N 1 1 237.309 3.695 20 0 BHADMO CCC(CC)C[N@H+]1CC[C@H](C(F)(F)F)[C@@H]1C ZINC000475274466 528754578 /nfs/dbraw/zinc/75/45/78/528754578.db2.gz CFZDOVCBKZUTMQ-ONGXEEELSA-N 1 1 237.309 3.695 20 0 BHADMO CCC[C@H](C)C[N@H+]1CC[C@H](C(F)(F)F)[C@H]1C ZINC000475282929 528031727 /nfs/dbraw/zinc/03/17/27/528031727.db2.gz VGAGVOOABRNBJN-AXFHLTTASA-N 1 1 237.309 3.695 20 0 BHADMO CCC[C@H](C)C[N@H+]1CC[C@H](C(F)(F)F)[C@@H]1C ZINC000475282931 528031889 /nfs/dbraw/zinc/03/18/89/528031889.db2.gz VGAGVOOABRNBJN-DCAQKATOSA-N 1 1 237.309 3.695 20 0 BHADMO CCC[C@H](C)C[N@H+]1CC[C@@H](C(F)(F)F)[C@@H]1C ZINC000475283330 528032822 /nfs/dbraw/zinc/03/28/22/528032822.db2.gz VGAGVOOABRNBJN-GARJFASQSA-N 1 1 237.309 3.695 20 0 BHADMO CCC[C@H](C)C[N@H+]1CC[C@@H](C(F)(F)F)[C@H]1C ZINC000475283331 528032920 /nfs/dbraw/zinc/03/29/20/528032920.db2.gz VGAGVOOABRNBJN-HBNTYKKESA-N 1 1 237.309 3.695 20 0 BHADMO C[C@@H]1[C@H](C(F)(F)F)CC[N@H+]1C[C@H]1CC=CCC1 ZINC000475283887 225131189 /nfs/dbraw/zinc/13/11/89/225131189.db2.gz XJCMIULKJNJNHU-GRYCIOLGSA-N 1 1 247.304 3.615 20 0 BHADMO C[C@@H]1[C@H](C(F)(F)F)CC[N@H+]1C[C@@H]1CC=CCC1 ZINC000475283888 225130181 /nfs/dbraw/zinc/13/01/81/225130181.db2.gz XJCMIULKJNJNHU-IJLUTSLNSA-N 1 1 247.304 3.615 20 0 BHADMO C[C@@H]1[C@@H](C(F)(F)F)CC[N@H+]1C[C@@H]1CC=CCC1 ZINC000475283889 534228614 /nfs/dbraw/zinc/22/86/14/534228614.db2.gz XJCMIULKJNJNHU-UTUOFQBUSA-N 1 1 247.304 3.615 20 0 BHADMO C[C@@H]1[C@@H](C(F)(F)F)CC[N@H+]1C[C@H]1CC=CCC1 ZINC000475283890 534228186 /nfs/dbraw/zinc/22/81/86/534228186.db2.gz XJCMIULKJNJNHU-WOPDTQHZSA-N 1 1 247.304 3.615 20 0 BHADMO CC[C@H]1CC[C@H](C)[N@H+]1CCCCOC(C)(C)C ZINC000475307414 529254025 /nfs/dbraw/zinc/25/40/25/529254025.db2.gz CKHIAJWCUCJWAZ-KBPBESRZSA-N 1 1 241.419 3.845 20 0 BHADMO CC[C@H]1CC[C@@H](C)[N@H+]1CCCCOC(C)(C)C ZINC000475307415 529249605 /nfs/dbraw/zinc/24/96/05/529249605.db2.gz CKHIAJWCUCJWAZ-KGLIPLIRSA-N 1 1 241.419 3.845 20 0 BHADMO CC[C@@H]1CC[C@H](C)[N@H+]1CCCCOC(C)(C)C ZINC000475307416 529343454 /nfs/dbraw/zinc/34/34/54/529343454.db2.gz CKHIAJWCUCJWAZ-UONOGXRCSA-N 1 1 241.419 3.845 20 0 BHADMO CC[C@@H]1CC[C@@H](C)[N@H+]1CCCCOC(C)(C)C ZINC000475307417 529337445 /nfs/dbraw/zinc/33/74/45/529337445.db2.gz CKHIAJWCUCJWAZ-ZIAGYGMSSA-N 1 1 241.419 3.845 20 0 BHADMO C[C@H]1CCCC[N@@H+](CCCCOC(C)(C)C)C1 ZINC000475318627 225132425 /nfs/dbraw/zinc/13/24/25/225132425.db2.gz QROPNSOFLZJEAH-AWEZNQCLSA-N 1 1 241.419 3.704 20 0 BHADMO C[C@@H]1CCCC[N@@H+](CCCCOC(C)(C)C)C1 ZINC000475318628 534154975 /nfs/dbraw/zinc/15/49/75/534154975.db2.gz QROPNSOFLZJEAH-CQSZACIVSA-N 1 1 241.419 3.704 20 0 BHADMO CC[C@H]1[C@@H](C)CC[N@H+]1CCCCOC(C)(C)C ZINC000475321560 529337216 /nfs/dbraw/zinc/33/72/16/529337216.db2.gz UHBFDZVRAVQDGJ-KBPBESRZSA-N 1 1 241.419 3.702 20 0 BHADMO CC[C@H]1[C@H](C)CC[N@H+]1CCCCOC(C)(C)C ZINC000475321565 529341504 /nfs/dbraw/zinc/34/15/04/529341504.db2.gz UHBFDZVRAVQDGJ-KGLIPLIRSA-N 1 1 241.419 3.702 20 0 BHADMO CC[C@@H]1[C@@H](C)CC[N@H+]1CCCCOC(C)(C)C ZINC000475321566 529477734 /nfs/dbraw/zinc/47/77/34/529477734.db2.gz UHBFDZVRAVQDGJ-UONOGXRCSA-N 1 1 241.419 3.702 20 0 BHADMO CC[C@@H]1[C@H](C)CC[N@H+]1CCCCOC(C)(C)C ZINC000475321568 529483318 /nfs/dbraw/zinc/48/33/18/529483318.db2.gz UHBFDZVRAVQDGJ-ZIAGYGMSSA-N 1 1 241.419 3.702 20 0 BHADMO CC[N@@H+](CCCCOC(C)(C)C)CCC1CC1 ZINC000475330469 528432182 /nfs/dbraw/zinc/43/21/82/528432182.db2.gz DRQSJRUGIJDYIT-UHFFFAOYSA-N 1 1 241.419 3.704 20 0 BHADMO CCC(C)(C)[N@@H+](C)Cc1cc2ccc(F)cc2[nH]1 ZINC000475337174 528538042 /nfs/dbraw/zinc/53/80/42/528538042.db2.gz PYHXEMUTUUXCQU-UHFFFAOYSA-N 1 1 248.345 3.927 20 0 BHADMO CCC(C)(C)[N@@H+](C)Cc1cc2c(cccc2F)[nH]1 ZINC000475337254 528538792 /nfs/dbraw/zinc/53/87/92/528538792.db2.gz PTWFRGTYJLFAMU-UHFFFAOYSA-N 1 1 248.345 3.927 20 0 BHADMO CCC(C)(C)[N@@H+](C)Cc1ccc(C)c(OC)c1 ZINC000475360302 528538494 /nfs/dbraw/zinc/53/84/94/528538494.db2.gz HTKJPTKIDIMLNL-UHFFFAOYSA-N 1 1 235.371 3.624 20 0 BHADMO CCCCC[N@@H+](C)[C@@H](C)Cc1ccccc1OC ZINC000475364542 528163416 /nfs/dbraw/zinc/16/34/16/528163416.db2.gz DNRPGOZFPMZJLB-AWEZNQCLSA-N 1 1 249.398 3.748 20 0 BHADMO CCCCC[N@@H+](C)[C@H](C)Cc1ccccc1OC ZINC000475364544 528164537 /nfs/dbraw/zinc/16/45/37/528164537.db2.gz DNRPGOZFPMZJLB-CQSZACIVSA-N 1 1 249.398 3.748 20 0 BHADMO Clc1cccc(C2=CC[N@@H+](CC3CC3)CC2)c1 ZINC000475430292 534641481 /nfs/dbraw/zinc/64/14/81/534641481.db2.gz SKWGOSWRDDNILS-UHFFFAOYSA-N 1 1 247.769 3.839 20 0 BHADMO CC[N@H+](Cc1cc(C)ccc1OC)CC1CCC1 ZINC000475544317 528766751 /nfs/dbraw/zinc/76/67/51/528766751.db2.gz AVTGJLLAGHTQAN-UHFFFAOYSA-N 1 1 247.382 3.626 20 0 BHADMO CCOc1ccc(C[N@@H+](CC)CC2CCC2)cc1 ZINC000475546647 528432331 /nfs/dbraw/zinc/43/23/31/528432331.db2.gz HNFCZBKYRKTXNA-UHFFFAOYSA-N 1 1 247.382 3.707 20 0 BHADMO C[N@@H+](Cc1ccc(Cl)o1)[C@H]1CCC(C)(C)C1 ZINC000475546862 529985614 /nfs/dbraw/zinc/98/56/14/529985614.db2.gz GFCQWAQGYXKNTL-JTQLQIEISA-N 1 1 241.762 3.944 20 0 BHADMO C[N@@H+](Cc1ccc(Cl)o1)[C@@H]1CCC(C)(C)C1 ZINC000475546871 529985888 /nfs/dbraw/zinc/98/58/88/529985888.db2.gz GFCQWAQGYXKNTL-SNVBAGLBSA-N 1 1 241.762 3.944 20 0 BHADMO CC[N@H+](Cc1ccc(C)c(OC)c1)CC1CCC1 ZINC000475569619 528777261 /nfs/dbraw/zinc/77/72/61/528777261.db2.gz AUWHWBNKRUHZND-UHFFFAOYSA-N 1 1 247.382 3.626 20 0 BHADMO CC[N@@H+](C[C@@H]1C[C@@H]1c1ccccc1)CC1CCC1 ZINC000475569645 528685434 /nfs/dbraw/zinc/68/54/34/528685434.db2.gz AWXMUJNBHOAOSM-DLBZAZTESA-N 1 1 243.394 3.912 20 0 BHADMO CC[N@@H+](C[C@H]1C[C@@H]1c1ccccc1)CC1CCC1 ZINC000475569647 528756559 /nfs/dbraw/zinc/75/65/59/528756559.db2.gz AWXMUJNBHOAOSM-IAGOWNOFSA-N 1 1 243.394 3.912 20 0 BHADMO CC[N@@H+](C[C@H]1C[C@H]1c1ccccc1)CC1CCC1 ZINC000475569649 528757012 /nfs/dbraw/zinc/75/70/12/528757012.db2.gz AWXMUJNBHOAOSM-SJORKVTESA-N 1 1 243.394 3.912 20 0 BHADMO CCOc1cccc(C[N@@H+](CC)CC2CCC2)c1 ZINC000475575211 528643892 /nfs/dbraw/zinc/64/38/92/528643892.db2.gz QMSBZLPISHHGOL-UHFFFAOYSA-N 1 1 247.382 3.707 20 0 BHADMO Cc1ccncc1C[N@@H+](C)CC1CCCCCC1 ZINC000475576475 225139230 /nfs/dbraw/zinc/13/92/30/225139230.db2.gz XAWQTTUJWRZYJX-UHFFFAOYSA-N 1 1 246.398 3.792 20 0 BHADMO CC[N@H+](Cc1ccc(OC)c(C)c1)CC1CCC1 ZINC000475576916 528788762 /nfs/dbraw/zinc/78/87/62/528788762.db2.gz BKUVTMQGNPMVAO-UHFFFAOYSA-N 1 1 247.382 3.626 20 0 BHADMO CC[N@H+](Cc1ccccc1C)CC1CCC1 ZINC000475577693 528835958 /nfs/dbraw/zinc/83/59/58/528835958.db2.gz GOWNLYSWHHFYIZ-UHFFFAOYSA-N 1 1 217.356 3.617 20 0 BHADMO CCOc1ccccc1C[N@@H+](CC)CC1CCC1 ZINC000475578085 225139646 /nfs/dbraw/zinc/13/96/46/225139646.db2.gz LSFFJURJXCIVOI-UHFFFAOYSA-N 1 1 247.382 3.707 20 0 BHADMO CC[N@@H+](C/C=C\c1ccccc1)CC1CCC1 ZINC000475578298 527871225 /nfs/dbraw/zinc/87/12/25/527871225.db2.gz OGTTUYRPMSTHCY-GHXNOFRVSA-N 1 1 229.367 3.822 20 0 BHADMO CC[N@@H+](C/C=C/c1ccccc1)CC1CCC1 ZINC000475578299 527870982 /nfs/dbraw/zinc/87/09/82/527870982.db2.gz OGTTUYRPMSTHCY-KPKJPENVSA-N 1 1 229.367 3.822 20 0 BHADMO CC(C)(C)[C@H]1CCC[N@@H+](Cc2cccc(O)c2)C1 ZINC000475630026 526720801 /nfs/dbraw/zinc/72/08/01/526720801.db2.gz XDQBAQJMFOMOTB-AWEZNQCLSA-N 1 1 247.382 3.650 20 0 BHADMO CC(C)(C)[C@@H]1CCC[N@@H+](Cc2cccc(O)c2)C1 ZINC000475630027 526652687 /nfs/dbraw/zinc/65/26/87/526652687.db2.gz XDQBAQJMFOMOTB-CQSZACIVSA-N 1 1 247.382 3.650 20 0 BHADMO Cc1cccnc1C[N@H+]1CCC[C@H](C(C)(C)C)C1 ZINC000475630495 225138493 /nfs/dbraw/zinc/13/84/93/225138493.db2.gz GCYXLJOBGAFITF-AWEZNQCLSA-N 1 1 246.398 3.648 20 0 BHADMO Cc1cccnc1C[N@H+]1CCC[C@@H](C(C)(C)C)C1 ZINC000475630496 225138441 /nfs/dbraw/zinc/13/84/41/225138441.db2.gz GCYXLJOBGAFITF-CQSZACIVSA-N 1 1 246.398 3.648 20 0 BHADMO Cc1ccsc1C[N@@H+](CC1CC1)C1CCC1 ZINC000475666410 534469651 /nfs/dbraw/zinc/46/96/51/534469651.db2.gz CGXKDIXUECQTIG-UHFFFAOYSA-N 1 1 235.396 3.821 20 0 BHADMO CCC(CC)C[N@@H+](CC1CC1)C1CCC1 ZINC000475668281 386107889 /nfs/dbraw/zinc/10/78/89/386107889.db2.gz AACXXKWTGQFUEP-UHFFFAOYSA-N 1 1 209.377 3.687 20 0 BHADMO C(=C/c1ccccc1)\C[N@@H+](CC1CC1)C1CCC1 ZINC000475669432 527467158 /nfs/dbraw/zinc/46/71/58/527467158.db2.gz DNNVPYQROLMMLL-VMPITWQZSA-N 1 1 241.378 3.964 20 0 BHADMO C(=C\c1ccccc1)\C[N@@H+](CC1CC1)C1CCC1 ZINC000475669433 527470761 /nfs/dbraw/zinc/47/07/61/527470761.db2.gz DNNVPYQROLMMLL-YVMONPNESA-N 1 1 241.378 3.964 20 0 BHADMO Fc1ccccc1CC[N@@H+](CC1CC1)C1CCC1 ZINC000475669473 225140560 /nfs/dbraw/zinc/14/05/60/225140560.db2.gz DZRHLQYQBZGYSX-UHFFFAOYSA-N 1 1 247.357 3.633 20 0 BHADMO c1csc(C[N@@H+](CC2CC2)CC2CCC2)c1 ZINC000475676923 534518890 /nfs/dbraw/zinc/51/88/90/534518890.db2.gz KYMAREUTIWKAKW-UHFFFAOYSA-N 1 1 235.396 3.760 20 0 BHADMO Cc1ccccc1C[N@@H+](CC1CC1)C1CCC1 ZINC000475677133 534811151 /nfs/dbraw/zinc/81/11/51/534811151.db2.gz DOULIJJKGDMVJQ-UHFFFAOYSA-N 1 1 229.367 3.760 20 0 BHADMO CCC[C@@H](C)C[N@@H+](CC1CC1)C1CCC1 ZINC000475678057 528876711 /nfs/dbraw/zinc/87/67/11/528876711.db2.gz HRXHAZVQASPUGA-GFCCVEGCSA-N 1 1 209.377 3.687 20 0 BHADMO CCC[C@H](C)C[N@@H+](CC1CC1)C1CCC1 ZINC000475678058 528032261 /nfs/dbraw/zinc/03/22/61/528032261.db2.gz HRXHAZVQASPUGA-LBPRGKRZSA-N 1 1 209.377 3.687 20 0 BHADMO Cc1cc(F)ccc1C[N@@H+](CC1CC1)C1CCC1 ZINC000475678479 533877435 /nfs/dbraw/zinc/87/74/35/533877435.db2.gz JOTGUFVPRJDDSN-UHFFFAOYSA-N 1 1 247.357 3.899 20 0 BHADMO CC(C)CCC[N@@H+](CC1CC1)C1CCC1 ZINC000475679634 527703222 /nfs/dbraw/zinc/70/32/22/527703222.db2.gz MYDCOMONBNPVFY-UHFFFAOYSA-N 1 1 209.377 3.687 20 0 BHADMO Cc1cccc(C[N@@H+](CC2CC2)C2CCC2)c1 ZINC000475680123 534705471 /nfs/dbraw/zinc/70/54/71/534705471.db2.gz OPSHHXJPOVZBAY-UHFFFAOYSA-N 1 1 229.367 3.760 20 0 BHADMO C1=CC[C@@H](C[N@H+](CC2CC2)C2CCC2)CC1 ZINC000475680752 526417967 /nfs/dbraw/zinc/41/79/67/526417967.db2.gz RCUUKWISRHJYSZ-CYBMUJFWSA-N 1 1 219.372 3.607 20 0 BHADMO C1=CC[C@H](C[N@H+](CC2CC2)C2CCC2)CC1 ZINC000475680757 526418619 /nfs/dbraw/zinc/41/86/19/526418619.db2.gz RCUUKWISRHJYSZ-ZDUSSCGKSA-N 1 1 219.372 3.607 20 0 BHADMO Cc1ccc(C[N@@H+](CC2CC2)C2CCC2)cc1 ZINC000475681284 533880910 /nfs/dbraw/zinc/88/09/10/533880910.db2.gz ULJVVVCQNYPPBQ-UHFFFAOYSA-N 1 1 229.367 3.760 20 0 BHADMO Cc1ccc(F)cc1C[N@@H+](CC1CC1)C1CCC1 ZINC000475681546 534157339 /nfs/dbraw/zinc/15/73/39/534157339.db2.gz WMHOJPDOUKRAMA-UHFFFAOYSA-N 1 1 247.357 3.899 20 0 BHADMO CC[N@@H+](C)[C@H](C)[C@@H](C)c1ccc(Cl)cc1 ZINC000475739274 527863946 /nfs/dbraw/zinc/86/39/46/527863946.db2.gz MAKGMPJTCXBHOS-GHMZBOCLSA-N 1 1 225.763 3.784 20 0 BHADMO CC[N@@H+](C)[C@@H](C)[C@@H](C)c1ccc(Cl)cc1 ZINC000475739275 527861402 /nfs/dbraw/zinc/86/14/02/527861402.db2.gz MAKGMPJTCXBHOS-MNOVXSKESA-N 1 1 225.763 3.784 20 0 BHADMO CC[N@@H+](C)[C@@H](C)[C@H](C)c1ccc(Cl)cc1 ZINC000475739276 527861729 /nfs/dbraw/zinc/86/17/29/527861729.db2.gz MAKGMPJTCXBHOS-QWRGUYRKSA-N 1 1 225.763 3.784 20 0 BHADMO CC[N@@H+](C)[C@H](C)[C@H](C)c1ccc(Cl)cc1 ZINC000475739277 527864072 /nfs/dbraw/zinc/86/40/72/527864072.db2.gz MAKGMPJTCXBHOS-WDEREUQCSA-N 1 1 225.763 3.784 20 0 BHADMO CCC[C@@H](CC)SCC[C@H]1CCC[N@H+]1C ZINC000477046067 528925306 /nfs/dbraw/zinc/92/53/06/528925306.db2.gz USWWWQMFDPVROL-CHWSQXEVSA-N 1 1 229.433 3.783 20 0 BHADMO CCC[C@H](CC)SCC[C@H]1CCC[N@H+]1C ZINC000477046096 528109829 /nfs/dbraw/zinc/10/98/29/528109829.db2.gz USWWWQMFDPVROL-OLZOCXBDSA-N 1 1 229.433 3.783 20 0 BHADMO CCC[C@@H](CC)SCC[C@@H]1CCC[N@H+]1C ZINC000477046097 528925205 /nfs/dbraw/zinc/92/52/05/528925205.db2.gz USWWWQMFDPVROL-QWHCGFSZSA-N 1 1 229.433 3.783 20 0 BHADMO CCC[C@H](CC)SCC[C@@H]1CCC[N@H+]1C ZINC000477046098 528109082 /nfs/dbraw/zinc/10/90/82/528109082.db2.gz USWWWQMFDPVROL-STQMWFEESA-N 1 1 229.433 3.783 20 0 BHADMO CCC[N@H+]1CCc2cc(-c3ccccc3)oc2C1 ZINC000477052380 528262239 /nfs/dbraw/zinc/26/22/39/528262239.db2.gz VEQHOQVUUBVBDE-UHFFFAOYSA-N 1 1 241.334 3.715 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)Cc1ccn(C2CCCC2)n1 ZINC000477145027 528888987 /nfs/dbraw/zinc/88/89/87/528888987.db2.gz QRFTYKUIHICJCR-CYBMUJFWSA-N 1 1 249.402 3.619 20 0 BHADMO CCC[C@H](C)[N@@H+](C)Cc1ccn(C2CCCC2)n1 ZINC000477145042 528048002 /nfs/dbraw/zinc/04/80/02/528048002.db2.gz QRFTYKUIHICJCR-ZDUSSCGKSA-N 1 1 249.402 3.619 20 0 BHADMO CCCC[N@@H+](CC)Cc1ccn(C2CCCC2)n1 ZINC000477153561 528395242 /nfs/dbraw/zinc/39/52/42/528395242.db2.gz VKCMGJBSSSZQBA-UHFFFAOYSA-N 1 1 249.402 3.620 20 0 BHADMO CCC[C@H]([NH2+]Cc1cn[nH]c1C)C1CCCCC1 ZINC000477201567 528226395 /nfs/dbraw/zinc/22/63/95/528226395.db2.gz FWKSLEKZAROIKO-HNNXBMFYSA-N 1 1 249.402 3.557 20 0 BHADMO CCC[C@@H]([NH2+]Cc1cn[nH]c1C)C1CCCCC1 ZINC000477201571 529012751 /nfs/dbraw/zinc/01/27/51/529012751.db2.gz FWKSLEKZAROIKO-OAHLLOKOSA-N 1 1 249.402 3.557 20 0 BHADMO CC(C)CC[N@H+]1CC[C@H](c2ccccc2)C1 ZINC000477294994 527727132 /nfs/dbraw/zinc/72/71/32/527727132.db2.gz XZNFSGBTPRFSTD-HNNXBMFYSA-N 1 1 217.356 3.522 20 0 BHADMO CC(C)CC[N@H+]1CC[C@@H](c2ccccc2)C1 ZINC000477294997 527727660 /nfs/dbraw/zinc/72/76/60/527727660.db2.gz XZNFSGBTPRFSTD-OAHLLOKOSA-N 1 1 217.356 3.522 20 0 BHADMO C[N@H+](Cc1cccs1)CC1CCCCC1 ZINC000477344691 530009467 /nfs/dbraw/zinc/00/94/67/530009467.db2.gz ASQNNQDSMSPTNA-UHFFFAOYSA-N 1 1 223.385 3.760 20 0 BHADMO Cc1ccccc1OCCC[N@H+]1CCCC1(C)C ZINC000477386551 225159745 /nfs/dbraw/zinc/15/97/45/225159745.db2.gz QNMFNEZWSYEQEY-UHFFFAOYSA-N 1 1 247.382 3.638 20 0 BHADMO Cc1ccc(C)c(C[N@H+]2CCCC2(C)C)c1 ZINC000477412795 533667635 /nfs/dbraw/zinc/66/76/35/533667635.db2.gz LQSVNBPMGBHBDB-UHFFFAOYSA-N 1 1 217.356 3.678 20 0 BHADMO C[N@@H+](Cc1ccc2c(c1)CCC2)C1CCCC1 ZINC000477414431 529991408 /nfs/dbraw/zinc/99/14/08/529991408.db2.gz OTSQAPVCKRBPRR-UHFFFAOYSA-N 1 1 229.367 3.550 20 0 BHADMO Cc1ccc(C)c(OCC[N@H+]2CCCC2(C)C)c1 ZINC000477417204 225160007 /nfs/dbraw/zinc/16/00/07/225160007.db2.gz XTRRREJADBVFGL-UHFFFAOYSA-N 1 1 247.382 3.557 20 0 BHADMO CC1(C)CCC[N@H+]1Cc1ccc(F)cc1Cl ZINC000477417816 528944058 /nfs/dbraw/zinc/94/40/58/528944058.db2.gz ZRXUOWBGXGKQIJ-UHFFFAOYSA-N 1 1 241.737 3.854 20 0 BHADMO CC1(C)CCC[N@H+]1Cc1c(F)cccc1Cl ZINC000477437157 528944313 /nfs/dbraw/zinc/94/43/13/528944313.db2.gz LAUXMMMDYQEMBU-UHFFFAOYSA-N 1 1 241.737 3.854 20 0 BHADMO CC1(C)CCC[N@H+]1Cc1ccc(Cl)cc1 ZINC000477437594 528944719 /nfs/dbraw/zinc/94/47/19/528944719.db2.gz MDEOIRUGYCYTGL-UHFFFAOYSA-N 1 1 223.747 3.714 20 0 BHADMO CCc1cccc(OCC[N@H+]2CCCC2(C)C)c1 ZINC000477439402 529542853 /nfs/dbraw/zinc/54/28/53/529542853.db2.gz ZLTUJSWTRMZNDL-UHFFFAOYSA-N 1 1 247.382 3.502 20 0 BHADMO CC1(C)CCC[N@H+]1Cc1cccc(Cl)c1 ZINC000477439502 528944562 /nfs/dbraw/zinc/94/45/62/528944562.db2.gz OIPDORGPXYIKCU-UHFFFAOYSA-N 1 1 223.747 3.714 20 0 BHADMO CC1(C)CCC[N@H+]1Cc1ccccc1Cl ZINC000477440065 528943643 /nfs/dbraw/zinc/94/36/43/528943643.db2.gz QMMYPXLKOOEWPN-UHFFFAOYSA-N 1 1 223.747 3.714 20 0 BHADMO CC(C)Oc1cccc(C[N@H+]2CCCC2(C)C)c1 ZINC000477441366 528223045 /nfs/dbraw/zinc/22/30/45/528223045.db2.gz UUBCJNDINIQADU-UHFFFAOYSA-N 1 1 247.382 3.848 20 0 BHADMO CC(C)Oc1ccccc1C[N@H+]1CCCC1(C)C ZINC000477510618 528251398 /nfs/dbraw/zinc/25/13/98/528251398.db2.gz SUDCARKILMYPTG-UHFFFAOYSA-N 1 1 247.382 3.848 20 0 BHADMO CC(C)Oc1ccc(C[N@H+]2CCCC2(C)C)cc1 ZINC000477533206 528151302 /nfs/dbraw/zinc/15/13/02/528151302.db2.gz AZFCANKKPIGRJR-UHFFFAOYSA-N 1 1 247.382 3.848 20 0 BHADMO CC1(C)CCC[N@H+]1CCc1ccccc1Cl ZINC000477541862 528943803 /nfs/dbraw/zinc/94/38/03/528943803.db2.gz MAMCNTRWABSPCG-UHFFFAOYSA-N 1 1 237.774 3.757 20 0 BHADMO CC1(C)CCC[N@H+]1Cc1ccc(Cl)s1 ZINC000477560912 528943963 /nfs/dbraw/zinc/94/39/63/528943963.db2.gz GCJRLUPMMRHOBS-UHFFFAOYSA-N 1 1 229.776 3.776 20 0 BHADMO Cc1ccccc1C[N@H+]1CCC[C@H]1C1CCC1 ZINC000477572398 225161155 /nfs/dbraw/zinc/16/11/55/225161155.db2.gz VUILWTCSBAKRQV-INIZCTEOSA-N 1 1 229.367 3.760 20 0 BHADMO Cc1ccccc1C[N@H+]1CCC[C@@H]1C1CCC1 ZINC000477572399 225161139 /nfs/dbraw/zinc/16/11/39/225161139.db2.gz VUILWTCSBAKRQV-MRXNPFEDSA-N 1 1 229.367 3.760 20 0 BHADMO Cc1cccc(C[N@H+]2CCC[C@H]2C2CCC2)c1 ZINC000477573625 225161215 /nfs/dbraw/zinc/16/12/15/225161215.db2.gz ZARSZFFSNUXOCI-INIZCTEOSA-N 1 1 229.367 3.760 20 0 BHADMO Cc1cccc(C[N@H+]2CCC[C@@H]2C2CCC2)c1 ZINC000477573626 225161174 /nfs/dbraw/zinc/16/11/74/225161174.db2.gz ZARSZFFSNUXOCI-MRXNPFEDSA-N 1 1 229.367 3.760 20 0 BHADMO C(C1CCCCC1)[N@H+]1CCC[C@H]1C1CCC1 ZINC000477591939 527475081 /nfs/dbraw/zinc/47/50/81/527475081.db2.gz PXVDWBNHQVHPND-HNNXBMFYSA-N 1 1 221.388 3.831 20 0 BHADMO C(C1CCCCC1)[N@H+]1CCC[C@@H]1C1CCC1 ZINC000477591951 527475730 /nfs/dbraw/zinc/47/57/30/527475730.db2.gz PXVDWBNHQVHPND-OAHLLOKOSA-N 1 1 221.388 3.831 20 0 BHADMO Cc1ccc(C[N@H+]2CCC[C@H]2C2CCC2)cc1 ZINC000477613353 533930380 /nfs/dbraw/zinc/93/03/80/533930380.db2.gz HORUUXWYLCIAPM-INIZCTEOSA-N 1 1 229.367 3.760 20 0 BHADMO Cc1ccc(C[N@H+]2CCC[C@@H]2C2CCC2)cc1 ZINC000477613355 533927049 /nfs/dbraw/zinc/92/70/49/533927049.db2.gz HORUUXWYLCIAPM-MRXNPFEDSA-N 1 1 229.367 3.760 20 0 BHADMO CC[C@@H]1CCC[N@@H+](CC2CCCCC2)C1 ZINC000477706925 529298866 /nfs/dbraw/zinc/29/88/66/529298866.db2.gz ZNSAOIXAIRHNKK-CYBMUJFWSA-N 1 1 209.377 3.689 20 0 BHADMO CC[C@H]1CCC[N@@H+](CC2CCCCC2)C1 ZINC000477706938 529217342 /nfs/dbraw/zinc/21/73/42/529217342.db2.gz ZNSAOIXAIRHNKK-ZDUSSCGKSA-N 1 1 209.377 3.689 20 0 BHADMO Fc1ccc(C[C@@H]2CCC[N@H+]2CCC2CC2)cc1 ZINC000477731192 225161266 /nfs/dbraw/zinc/16/12/66/225161266.db2.gz ZOAPHGDFRSNOQO-INIZCTEOSA-N 1 1 247.357 3.633 20 0 BHADMO Fc1ccc(C[C@H]2CCC[N@H+]2CCC2CC2)cc1 ZINC000477731193 225161565 /nfs/dbraw/zinc/16/15/65/225161565.db2.gz ZOAPHGDFRSNOQO-MRXNPFEDSA-N 1 1 247.357 3.633 20 0 BHADMO Fc1ccc(C[C@@H]2CCC[N@H+]2CC2CCC2)cc1 ZINC000477756654 225161222 /nfs/dbraw/zinc/16/12/22/225161222.db2.gz YFPSQIJHHDAZND-INIZCTEOSA-N 1 1 247.357 3.633 20 0 BHADMO Fc1ccc(C[C@H]2CCC[N@H+]2CC2CCC2)cc1 ZINC000477756655 225160683 /nfs/dbraw/zinc/16/06/83/225160683.db2.gz YFPSQIJHHDAZND-MRXNPFEDSA-N 1 1 247.357 3.633 20 0 BHADMO C1=C[C@H]([N@H+]2CCOC3(C2)CCCCCC3)CCC1 ZINC000477864396 526420259 /nfs/dbraw/zinc/42/02/59/526420259.db2.gz QEHFOJWKJLHSEW-HNNXBMFYSA-N 1 1 249.398 3.520 20 0 BHADMO C1=C[C@@H]([N@H+]2CCOC3(C2)CCCCCC3)CCC1 ZINC000477864399 526419401 /nfs/dbraw/zinc/41/94/01/526419401.db2.gz QEHFOJWKJLHSEW-OAHLLOKOSA-N 1 1 249.398 3.520 20 0 BHADMO C(C[N@H+]1CCC12CCC2)C1CCCCC1 ZINC000478028776 527480607 /nfs/dbraw/zinc/48/06/07/527480607.db2.gz UULOULFESDEDEV-UHFFFAOYSA-N 1 1 207.361 3.585 20 0 BHADMO CC[C@H]1CCC[N@H+]([C@@H](C)c2cccc(OC)c2)C1 ZINC000478955050 529217956 /nfs/dbraw/zinc/21/79/56/529217956.db2.gz IAFPCODQGXLZJN-KBPBESRZSA-N 1 1 247.382 3.878 20 0 BHADMO CC[C@H]1CCC[N@H+]([C@H](C)c2cccc(OC)c2)C1 ZINC000478955053 529217930 /nfs/dbraw/zinc/21/79/30/529217930.db2.gz IAFPCODQGXLZJN-KGLIPLIRSA-N 1 1 247.382 3.878 20 0 BHADMO CC[C@@H]1CCC[N@H+]([C@@H](C)c2cccc(OC)c2)C1 ZINC000478955057 529299484 /nfs/dbraw/zinc/29/94/84/529299484.db2.gz IAFPCODQGXLZJN-UONOGXRCSA-N 1 1 247.382 3.878 20 0 BHADMO CC[C@@H]1CCC[N@H+]([C@H](C)c2cccc(OC)c2)C1 ZINC000478955060 529299255 /nfs/dbraw/zinc/29/92/55/529299255.db2.gz IAFPCODQGXLZJN-ZIAGYGMSSA-N 1 1 247.382 3.878 20 0 BHADMO CC(C)c1cccc(C[NH2+]Cc2cscn2)c1 ZINC000479398146 528170149 /nfs/dbraw/zinc/17/01/49/528170149.db2.gz XXFZJXONNHMLOS-UHFFFAOYSA-N 1 1 246.379 3.556 20 0 BHADMO CC(C)C[C@@H](C)[N@@H+](C)CC1CCCCC1 ZINC000479552022 528258192 /nfs/dbraw/zinc/25/81/92/528258192.db2.gz BEVNNCMOMFWFGG-CYBMUJFWSA-N 1 1 211.393 3.933 20 0 BHADMO CC(C)C[C@H](C)[N@@H+](C)CC1CCCCC1 ZINC000479552023 528467405 /nfs/dbraw/zinc/46/74/05/528467405.db2.gz BEVNNCMOMFWFGG-ZDUSSCGKSA-N 1 1 211.393 3.933 20 0 BHADMO CC(C)[C@@H]1CCC[N@H+]1CC1CCCCC1 ZINC000479552591 528674742 /nfs/dbraw/zinc/67/47/42/528674742.db2.gz CEDXJJDCPFUYLL-AWEZNQCLSA-N 1 1 209.377 3.687 20 0 BHADMO C[C@H](C1CC1)[N@@H+](CC1CCCCC1)C1CC1 ZINC000479566689 225188222 /nfs/dbraw/zinc/18/82/22/225188222.db2.gz MERGFZXGDICVKQ-GFCCVEGCSA-N 1 1 221.388 3.830 20 0 BHADMO C[C@@H](C1CC1)[N@@H+](CC1CCCCC1)C1CC1 ZINC000479566727 225187501 /nfs/dbraw/zinc/18/75/01/225187501.db2.gz MERGFZXGDICVKQ-LBPRGKRZSA-N 1 1 221.388 3.830 20 0 BHADMO C[N@@H+](CC1CCCCC1)C1Cc2ccccc2C1 ZINC000479590361 529865056 /nfs/dbraw/zinc/86/50/56/529865056.db2.gz BTNKWCBMVSDDBV-UHFFFAOYSA-N 1 1 243.394 3.666 20 0 BHADMO CC[N@@H+](CC1CCCCC1)[C@H](C)C(C)C ZINC000479594466 528348764 /nfs/dbraw/zinc/34/87/64/528348764.db2.gz ORHNTNRXSMWDIH-CYBMUJFWSA-N 1 1 211.393 3.933 20 0 BHADMO C[C@H](c1ccco1)[N@@H+](C)CC1CCCCC1 ZINC000479594504 225189706 /nfs/dbraw/zinc/18/97/06/225189706.db2.gz OXZDIDKCBZHCQD-GFCCVEGCSA-N 1 1 221.344 3.853 20 0 BHADMO C[C@@H](c1ccco1)[N@@H+](C)CC1CCCCC1 ZINC000479594506 225189251 /nfs/dbraw/zinc/18/92/51/225189251.db2.gz OXZDIDKCBZHCQD-LBPRGKRZSA-N 1 1 221.344 3.853 20 0 BHADMO CC1(C)CCC[N@H+]1C/C=C\c1ccccc1 ZINC000479606733 528942760 /nfs/dbraw/zinc/94/27/60/528942760.db2.gz DCLQJNPLAQFHHR-POHAHGRESA-N 1 1 215.340 3.574 20 0 BHADMO CC1(C)CCC[N@H+]1C/C=C/c1ccccc1 ZINC000479606734 528942458 /nfs/dbraw/zinc/94/24/58/528942458.db2.gz DCLQJNPLAQFHHR-UXBLZVDNSA-N 1 1 215.340 3.574 20 0 BHADMO Cc1cc(C)cc(C[N@H+]2CCCC2(C)C)c1 ZINC000479615007 225190191 /nfs/dbraw/zinc/19/01/91/225190191.db2.gz HTNGZYMXEIFLBU-UHFFFAOYSA-N 1 1 217.356 3.678 20 0 BHADMO C(=C/c1ccccc1)\C[N@H+]1CCC[C@@H]1C1CCC1 ZINC000479623261 527467537 /nfs/dbraw/zinc/46/75/37/527467537.db2.gz ZXTBVKNRBXPTSK-HFTQHKIXSA-N 1 1 241.378 3.964 20 0 BHADMO C(=C/c1ccccc1)\C[N@H+]1CCC[C@H]1C1CCC1 ZINC000479623264 527468170 /nfs/dbraw/zinc/46/81/70/527468170.db2.gz ZXTBVKNRBXPTSK-MPNRVQBSSA-N 1 1 241.378 3.964 20 0 BHADMO C(=C\c1ccccc1)\C[N@H+]1CCC[C@H]1C1CCC1 ZINC000479623266 527471530 /nfs/dbraw/zinc/47/15/30/527471530.db2.gz ZXTBVKNRBXPTSK-OOYWPUHTSA-N 1 1 241.378 3.964 20 0 BHADMO C(=C\c1ccccc1)\C[N@H+]1CCC[C@@H]1C1CCC1 ZINC000479623269 527470289 /nfs/dbraw/zinc/47/02/89/527470289.db2.gz ZXTBVKNRBXPTSK-VWTAQGJOSA-N 1 1 241.378 3.964 20 0 BHADMO Cc1cccc(C)c1OCC[N@H+]1CCCC1(C)C ZINC000479638295 225191216 /nfs/dbraw/zinc/19/12/16/225191216.db2.gz LUOMJHBDKJONDC-UHFFFAOYSA-N 1 1 247.382 3.557 20 0 BHADMO CCc1cccc(F)c1CNc1[nH+]cccc1C ZINC000479762291 529174582 /nfs/dbraw/zinc/17/45/82/529174582.db2.gz HUHISVHQVFALKE-UHFFFAOYSA-N 1 1 244.313 3.704 20 0 BHADMO Cc1ccc(N[C@@H](C)CCCC(F)(F)F)[nH+]c1 ZINC000480151447 225197945 /nfs/dbraw/zinc/19/79/45/225197945.db2.gz UUAHETNLVMRKQP-JTQLQIEISA-N 1 1 246.276 3.923 20 0 BHADMO Cc1ccc(N[C@H](C)CCCC(F)(F)F)[nH+]c1 ZINC000480151448 225197996 /nfs/dbraw/zinc/19/79/96/225197996.db2.gz UUAHETNLVMRKQP-SNVBAGLBSA-N 1 1 246.276 3.923 20 0 BHADMO Cc1cc[nH+]c(N[C@@H](C)CCCC(F)(F)F)c1 ZINC000480171314 534404012 /nfs/dbraw/zinc/40/40/12/534404012.db2.gz QKODBEYNOUXXOF-JTQLQIEISA-N 1 1 246.276 3.923 20 0 BHADMO Cc1cc[nH+]c(N[C@H](C)CCCC(F)(F)F)c1 ZINC000480171316 534406478 /nfs/dbraw/zinc/40/64/78/534406478.db2.gz QKODBEYNOUXXOF-SNVBAGLBSA-N 1 1 246.276 3.923 20 0 BHADMO Cc1ccc([C@@H](C)[N@@H+](C)CCC2CC2)cc1 ZINC000480497498 225200413 /nfs/dbraw/zinc/20/04/13/225200413.db2.gz UQTTUFOJGYGMAL-CYBMUJFWSA-N 1 1 217.356 3.788 20 0 BHADMO Cc1ccc([C@H](C)[N@@H+](C)CCC2CC2)cc1 ZINC000480497499 225200441 /nfs/dbraw/zinc/20/04/41/225200441.db2.gz UQTTUFOJGYGMAL-ZDUSSCGKSA-N 1 1 217.356 3.788 20 0 BHADMO CC(C)[N@@H+](CCCCc1ccccc1)C1CC1 ZINC000480500193 528879418 /nfs/dbraw/zinc/87/94/18/528879418.db2.gz KOZZLCDNZGCPBY-UHFFFAOYSA-N 1 1 231.383 3.882 20 0 BHADMO CC[N@@H+](C[C@@H]1CCC(C)(C)O1)C1CCCCC1 ZINC000480504333 528671528 /nfs/dbraw/zinc/67/15/28/528671528.db2.gz WVWVJGALHUNHEV-AWEZNQCLSA-N 1 1 239.403 3.599 20 0 BHADMO CC[N@@H+](C[C@H]1CCC(C)(C)O1)C1CCCCC1 ZINC000480504334 528743252 /nfs/dbraw/zinc/74/32/52/528743252.db2.gz WVWVJGALHUNHEV-CQSZACIVSA-N 1 1 239.403 3.599 20 0 BHADMO Fc1cccc([C@@H]2CCC[N@H+]2CCC2CC2)c1 ZINC000480506778 225201794 /nfs/dbraw/zinc/20/17/94/225201794.db2.gz RNGFWIPVLVAZRE-HNNXBMFYSA-N 1 1 233.330 3.763 20 0 BHADMO Fc1cccc([C@H]2CCC[N@H+]2CCC2CC2)c1 ZINC000480506779 225202137 /nfs/dbraw/zinc/20/21/37/225202137.db2.gz RNGFWIPVLVAZRE-OAHLLOKOSA-N 1 1 233.330 3.763 20 0 BHADMO Cc1ccccc1[C@@H](C)[N@@H+](C)CCC1CC1 ZINC000480509601 225201990 /nfs/dbraw/zinc/20/19/90/225201990.db2.gz MNCFVWKOFHKTHN-CYBMUJFWSA-N 1 1 217.356 3.788 20 0 BHADMO Cc1ccccc1[C@H](C)[N@@H+](C)CCC1CC1 ZINC000480509602 225202488 /nfs/dbraw/zinc/20/24/88/225202488.db2.gz MNCFVWKOFHKTHN-ZDUSSCGKSA-N 1 1 217.356 3.788 20 0 BHADMO C[N@@H+](C[C@@H]1CCC(C)(C)O1)C1CCCCCC1 ZINC000480513263 529945195 /nfs/dbraw/zinc/94/51/95/529945195.db2.gz QFPIPEYGIPZRAM-AWEZNQCLSA-N 1 1 239.403 3.599 20 0 BHADMO C[N@@H+](C[C@H]1CCC(C)(C)O1)C1CCCCCC1 ZINC000480513264 529962938 /nfs/dbraw/zinc/96/29/38/529962938.db2.gz QFPIPEYGIPZRAM-CQSZACIVSA-N 1 1 239.403 3.599 20 0 BHADMO CC(C)[N@@H+](CCC1CC1)Cc1ccccc1 ZINC000480513949 528880046 /nfs/dbraw/zinc/88/00/46/528880046.db2.gz ZKXPMFMOJCTGBB-UHFFFAOYSA-N 1 1 217.356 3.697 20 0 BHADMO C[C@@H](c1c(F)cccc1F)[N@@H+](C)CCC1CC1 ZINC000480514476 534041520 /nfs/dbraw/zinc/04/15/20/534041520.db2.gz LMCIWLKBMBBSBG-JTQLQIEISA-N 1 1 239.309 3.758 20 0 BHADMO C[C@H](c1c(F)cccc1F)[N@@H+](C)CCC1CC1 ZINC000480514482 225202570 /nfs/dbraw/zinc/20/25/70/225202570.db2.gz LMCIWLKBMBBSBG-SNVBAGLBSA-N 1 1 239.309 3.758 20 0 BHADMO C[N@@H+](CCC1CC1)[C@H]1CCCc2ccccc21 ZINC000480514949 529876859 /nfs/dbraw/zinc/87/68/59/529876859.db2.gz WGEXVHPERDRFRG-INIZCTEOSA-N 1 1 229.367 3.796 20 0 BHADMO C[N@@H+](CCC1CC1)[C@@H]1CCCc2ccccc21 ZINC000480514950 529876875 /nfs/dbraw/zinc/87/68/75/529876875.db2.gz WGEXVHPERDRFRG-MRXNPFEDSA-N 1 1 229.367 3.796 20 0 BHADMO CC[C@@H]1c2ccsc2CC[N@@H+]1CCC1CC1 ZINC000480515148 529486632 /nfs/dbraw/zinc/48/66/32/529486632.db2.gz OLXYRNDTYCWXOM-CYBMUJFWSA-N 1 1 235.396 3.857 20 0 BHADMO CC[C@H]1c2ccsc2CC[N@@H+]1CCC1CC1 ZINC000480515149 529345502 /nfs/dbraw/zinc/34/55/02/529345502.db2.gz OLXYRNDTYCWXOM-ZDUSSCGKSA-N 1 1 235.396 3.857 20 0 BHADMO c1coc(C[N@H+](CCC2CC2)C2CCCC2)c1 ZINC000480519607 225201626 /nfs/dbraw/zinc/20/16/26/225201626.db2.gz CONXPCXYCIEBAH-UHFFFAOYSA-N 1 1 233.355 3.824 20 0 BHADMO Fc1cccc(C[C@@H]2CCC[N@H+]2CCC2CC2)c1 ZINC000480521717 534519608 /nfs/dbraw/zinc/51/96/08/534519608.db2.gz GBEWSQVGWYJSIH-INIZCTEOSA-N 1 1 247.357 3.633 20 0 BHADMO Fc1cccc(C[C@H]2CCC[N@H+]2CCC2CC2)c1 ZINC000480521721 534519735 /nfs/dbraw/zinc/51/97/35/534519735.db2.gz GBEWSQVGWYJSIH-MRXNPFEDSA-N 1 1 247.357 3.633 20 0 BHADMO CC[N@@H+](CCCCc1ccccc1)C(C)C ZINC000480523175 528432084 /nfs/dbraw/zinc/43/20/84/528432084.db2.gz OMAWDPOURAEVAH-UHFFFAOYSA-N 1 1 219.372 3.740 20 0 BHADMO CC(C)[N@@H+](CCC1CC1)Cc1cccc(F)c1 ZINC000480524011 528879546 /nfs/dbraw/zinc/87/95/46/528879546.db2.gz KZNOGJGFWVFCRC-UHFFFAOYSA-N 1 1 235.346 3.836 20 0 BHADMO Fc1ccc([C@@H]2CCC[N@H+]2CCC2CC2)cc1 ZINC000480524699 225202100 /nfs/dbraw/zinc/20/21/00/225202100.db2.gz HYWZELGIRZGUCX-HNNXBMFYSA-N 1 1 233.330 3.763 20 0 BHADMO Fc1ccc([C@H]2CCC[N@H+]2CCC2CC2)cc1 ZINC000480524701 534496323 /nfs/dbraw/zinc/49/63/23/534496323.db2.gz HYWZELGIRZGUCX-OAHLLOKOSA-N 1 1 233.330 3.763 20 0 BHADMO C[C@@H](c1cc(F)ccc1F)[N@@H+](C)CCC1CC1 ZINC000480524721 534044062 /nfs/dbraw/zinc/04/40/62/534044062.db2.gz ICSJHCZNZKDCDW-JTQLQIEISA-N 1 1 239.309 3.758 20 0 BHADMO C[C@H](c1cc(F)ccc1F)[N@@H+](C)CCC1CC1 ZINC000480524722 225202940 /nfs/dbraw/zinc/20/29/40/225202940.db2.gz ICSJHCZNZKDCDW-SNVBAGLBSA-N 1 1 239.309 3.758 20 0 BHADMO CC[N@@H+](CCCCc1ccccc1)C1CCC1 ZINC000480525440 528432656 /nfs/dbraw/zinc/43/26/56/528432656.db2.gz IMUKMHUFWOKICX-UHFFFAOYSA-N 1 1 231.383 3.884 20 0 BHADMO Fc1ccc(C2=CC[N@@H+](CCC3CC3)CC2)cc1 ZINC000480526110 225201927 /nfs/dbraw/zinc/20/19/27/225201927.db2.gz NCRUKPXAVMMTGB-UHFFFAOYSA-N 1 1 245.341 3.715 20 0 BHADMO C[C@@H](c1ccc(F)c(F)c1)[N@@H+](C)CCC1CC1 ZINC000480533035 534056078 /nfs/dbraw/zinc/05/60/78/534056078.db2.gz UKQXTCSSEZFVTK-JTQLQIEISA-N 1 1 239.309 3.758 20 0 BHADMO C[C@H](c1ccc(F)c(F)c1)[N@@H+](C)CCC1CC1 ZINC000480533036 225201749 /nfs/dbraw/zinc/20/17/49/225201749.db2.gz UKQXTCSSEZFVTK-SNVBAGLBSA-N 1 1 239.309 3.758 20 0 BHADMO C[C@H](c1cccc(Cl)c1F)[N@@H+](C)CC1CC1 ZINC000480533492 534127340 /nfs/dbraw/zinc/12/73/40/534127340.db2.gz YJQQNQZWHQDFKD-SECBINFHSA-N 1 1 241.737 3.882 20 0 BHADMO C[C@@H](c1cccc(Cl)c1F)[N@@H+](C)CC1CC1 ZINC000480533494 534087429 /nfs/dbraw/zinc/08/74/29/534087429.db2.gz YJQQNQZWHQDFKD-VIFPVBQESA-N 1 1 241.737 3.882 20 0 BHADMO Cc1ccc(C[C@H](C)[N@@H+](C)CCC2CC2)cc1 ZINC000480545849 225202199 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225203630 /nfs/dbraw/zinc/20/36/30/225203630.db2.gz HAVFWTODPNDUGL-AWEZNQCLSA-N 1 1 249.785 3.929 20 0 BHADMO Clc1ccc([C@@H]2CC[N@@H+](CCC3CC3)C2)cc1 ZINC000480561134 225204572 /nfs/dbraw/zinc/20/45/72/225204572.db2.gz HAVFWTODPNDUGL-CQSZACIVSA-N 1 1 249.785 3.929 20 0 BHADMO c1coc([C@@H]2CCCCC[N@@H+]2CCC2CC2)c1 ZINC000480562559 225204775 /nfs/dbraw/zinc/20/47/75/225204775.db2.gz ZPRIKOWVLCHNPR-AWEZNQCLSA-N 1 1 233.355 3.997 20 0 BHADMO c1coc([C@H]2CCCCC[N@@H+]2CCC2CC2)c1 ZINC000480562560 225203935 /nfs/dbraw/zinc/20/39/35/225203935.db2.gz ZPRIKOWVLCHNPR-CQSZACIVSA-N 1 1 233.355 3.997 20 0 BHADMO c1ccc(CCCC[N@H+]2CCC23CCC3)cc1 ZINC000480569094 534484478 /nfs/dbraw/zinc/48/44/78/534484478.db2.gz UWPUQIHLPNCLKF-UHFFFAOYSA-N 1 1 229.367 3.638 20 0 BHADMO C(C[N@H+]1CCSC2(CCCCC2)C1)C1CC1 ZINC000480576183 527481970 /nfs/dbraw/zinc/48/19/70/527481970.db2.gz GJDQUDNUXDQPDE-UHFFFAOYSA-N 1 1 239.428 3.538 20 0 BHADMO c1ccc2c(c1)CC[C@@H]2[N@@H+](CCC1CC1)C1CC1 ZINC000480586082 225203780 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534126824 /nfs/dbraw/zinc/12/68/24/534126824.db2.gz SJUSCUOXPDTXOU-NXEZZACHSA-N 1 1 241.737 3.882 20 0 BHADMO C[C@@H](c1cccc(Cl)c1F)[N@H+]1CC[C@H](C)C1 ZINC000480593670 534088795 /nfs/dbraw/zinc/08/87/95/534088795.db2.gz SJUSCUOXPDTXOU-UWVGGRQHSA-N 1 1 241.737 3.882 20 0 BHADMO C[C@H](c1cccc(Cl)c1F)[N@H+]1CC[C@H](C)C1 ZINC000480593828 534127978 /nfs/dbraw/zinc/12/79/78/534127978.db2.gz SJUSCUOXPDTXOU-VHSXEESVSA-N 1 1 241.737 3.882 20 0 BHADMO C[C@@H](c1cccc(Cl)c1F)[N@H+]1CC[C@@H](C)C1 ZINC000480593829 534088834 /nfs/dbraw/zinc/08/88/34/534088834.db2.gz SJUSCUOXPDTXOU-ZJUUUORDSA-N 1 1 241.737 3.882 20 0 BHADMO Cc1cccc(CCC[N@H+](C(C)C)C2CC2)c1 ZINC000480655019 225204567 /nfs/dbraw/zinc/20/45/67/225204567.db2.gz RQJGLCIOJSRLAF-UHFFFAOYSA-N 1 1 231.383 3.800 20 0 BHADMO CC[N@@H+](CCCc1cccc(C)c1)C(C)C ZINC000480684781 528473436 /nfs/dbraw/zinc/47/34/36/528473436.db2.gz YVKVYUGBTLYBLP-UHFFFAOYSA-N 1 1 219.372 3.658 20 0 BHADMO Cc1cccc(CCC[N@H+](C)C2CCCC2)c1 ZINC000480698397 225206338 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/nfs/dbraw/zinc/21/00/21/225210021.db2.gz JSSYNLGQBJYWLU-ZDUSSCGKSA-N 1 1 232.371 3.653 20 0 BHADMO Cc1cccc(CCC[N@H+]2CCC23CCC3)c1 ZINC000481042109 225212350 /nfs/dbraw/zinc/21/23/50/225212350.db2.gz VWQNOQWCOQPUAY-UHFFFAOYSA-N 1 1 229.367 3.556 20 0 BHADMO Cc1cccc(N2CCC[C@@H](C(C)(C)C)C2)[nH+]1 ZINC000481062469 225212342 /nfs/dbraw/zinc/21/23/42/225212342.db2.gz UONIXBSXHLHVMU-CYBMUJFWSA-N 1 1 232.371 3.653 20 0 BHADMO Cc1cccc(N2CCC[C@H](C(C)(C)C)C2)[nH+]1 ZINC000481062471 225211521 /nfs/dbraw/zinc/21/15/21/225211521.db2.gz UONIXBSXHLHVMU-ZDUSSCGKSA-N 1 1 232.371 3.653 20 0 BHADMO CC[N@@H+](CCCc1cccc(C)c1)C1CCC1 ZINC000481064147 528473507 /nfs/dbraw/zinc/47/35/07/528473507.db2.gz XJSXMWBHXXHESP-UHFFFAOYSA-N 1 1 231.383 3.802 20 0 BHADMO Cc1cccc(CCC[N@H+](C)CCC2CC2)c1 ZINC000481074486 225212572 /nfs/dbraw/zinc/21/25/72/225212572.db2.gz MXOPYBYALZBVII-UHFFFAOYSA-N 1 1 231.383 3.660 20 0 BHADMO CC[C@@H](C)C[N@H+]1CCc2[nH]c3ccccc3c2C1 ZINC000481090310 529320151 /nfs/dbraw/zinc/32/01/51/529320151.db2.gz ISMYIVFMZNAWOR-GFCCVEGCSA-N 1 1 242.366 3.572 20 0 BHADMO CC[C@H](C)C[N@H+]1CCc2[nH]c3ccccc3c2C1 ZINC000481090313 529659095 /nfs/dbraw/zinc/65/90/95/529659095.db2.gz ISMYIVFMZNAWOR-LBPRGKRZSA-N 1 1 242.366 3.572 20 0 BHADMO CC[C@H](C)[N@@H+](C)CCCc1cccc(C)c1 ZINC000481095394 529687876 /nfs/dbraw/zinc/68/78/76/529687876.db2.gz SDSKPJLFCNLWRF-AWEZNQCLSA-N 1 1 219.372 3.658 20 0 BHADMO CC[C@@H](C)[N@@H+](C)CCCc1cccc(C)c1 ZINC000481095401 529340979 /nfs/dbraw/zinc/34/09/79/529340979.db2.gz SDSKPJLFCNLWRF-CQSZACIVSA-N 1 1 219.372 3.658 20 0 BHADMO CCCc1ccc(C[N@H+]2CCCSCC2)cc1 ZINC000481095458 528620608 /nfs/dbraw/zinc/62/06/08/528620608.db2.gz SJXITMSEILUEKD-UHFFFAOYSA-N 1 1 249.423 3.578 20 0 BHADMO CC1=C(C)CN(c2cc[nH+]c3ccsc32)CC1 ZINC000481095515 528092308 /nfs/dbraw/zinc/09/23/08/528092308.db2.gz XMBFFJGUEAUBDM-UHFFFAOYSA-N 1 1 244.363 3.843 20 0 BHADMO CC[N@@H+](CCCc1cccc(C)c1)CC1CC1 ZINC000481095850 528473596 /nfs/dbraw/zinc/47/35/96/528473596.db2.gz USGBBUYRYJYJAT-UHFFFAOYSA-N 1 1 231.383 3.660 20 0 BHADMO Cc1cccc(CCC[N@@H+]2CC=C(C)CC2)c1 ZINC000481111845 225211932 /nfs/dbraw/zinc/21/19/32/225211932.db2.gz REQCDYXFNOHDNJ-UHFFFAOYSA-N 1 1 229.367 3.580 20 0 BHADMO CC[C@H]1[C@@H](C)CC[N@H+]1Cc1cc(F)ccc1F ZINC000481345995 529337043 /nfs/dbraw/zinc/33/70/43/529337043.db2.gz SRJCIGUMAXNGIM-HZMBPMFUSA-N 1 1 239.309 3.585 20 0 BHADMO CC[C@@H]1[C@@H](C)CC[N@H+]1Cc1cc(F)ccc1F ZINC000481345996 529478167 /nfs/dbraw/zinc/47/81/67/529478167.db2.gz SRJCIGUMAXNGIM-IINYFYTJSA-N 1 1 239.309 3.585 20 0 BHADMO CC[C@@H]1[C@H](C)CC[N@H+]1Cc1cc(F)ccc1F ZINC000481345997 529483597 /nfs/dbraw/zinc/48/35/97/529483597.db2.gz SRJCIGUMAXNGIM-QMTHXVAHSA-N 1 1 239.309 3.585 20 0 BHADMO CC[C@H]1[C@H](C)CC[N@H+]1Cc1cc(F)ccc1F ZINC000481345998 529341865 /nfs/dbraw/zinc/34/18/65/529341865.db2.gz SRJCIGUMAXNGIM-YGRLFVJLSA-N 1 1 239.309 3.585 20 0 BHADMO CC[C@H]1[C@@H](C)CC[N@H+]1Cc1ccc(F)c(F)c1 ZINC000481347968 529337423 /nfs/dbraw/zinc/33/74/23/529337423.db2.gz WHZZTACHTCBRBN-HZMBPMFUSA-N 1 1 239.309 3.585 20 0 BHADMO CC[C@@H]1[C@@H](C)CC[N@H+]1Cc1ccc(F)c(F)c1 ZINC000481347969 529478062 /nfs/dbraw/zinc/47/80/62/529478062.db2.gz WHZZTACHTCBRBN-IINYFYTJSA-N 1 1 239.309 3.585 20 0 BHADMO CC[C@@H]1[C@H](C)CC[N@H+]1Cc1ccc(F)c(F)c1 ZINC000481347972 529483612 /nfs/dbraw/zinc/48/36/12/529483612.db2.gz WHZZTACHTCBRBN-QMTHXVAHSA-N 1 1 239.309 3.585 20 0 BHADMO CC[C@H]1[C@H](C)CC[N@H+]1Cc1ccc(F)c(F)c1 ZINC000481347974 529341466 /nfs/dbraw/zinc/34/14/66/529341466.db2.gz WHZZTACHTCBRBN-YGRLFVJLSA-N 1 1 239.309 3.585 20 0 BHADMO CC[C@H]1[C@@H](C)CC[N@H+]1Cc1cccc(F)c1F ZINC000481376119 529337154 /nfs/dbraw/zinc/33/71/54/529337154.db2.gz USULJOKKRBPFGA-GWCFXTLKSA-N 1 1 239.309 3.585 20 0 BHADMO CC[C@@H]1[C@@H](C)CC[N@H+]1Cc1cccc(F)c1F ZINC000481376121 529478068 /nfs/dbraw/zinc/47/80/68/529478068.db2.gz USULJOKKRBPFGA-GXFFZTMASA-N 1 1 239.309 3.585 20 0 BHADMO CC[C@H]1[C@H](C)CC[N@H+]1Cc1cccc(F)c1F ZINC000481376124 529341793 /nfs/dbraw/zinc/34/17/93/529341793.db2.gz USULJOKKRBPFGA-MFKMUULPSA-N 1 1 239.309 3.585 20 0 BHADMO CC[C@@H]1[C@H](C)CC[N@H+]1Cc1cccc(F)c1F ZINC000481376127 529483547 /nfs/dbraw/zinc/48/35/47/529483547.db2.gz USULJOKKRBPFGA-ZWNOBZJWSA-N 1 1 239.309 3.585 20 0 BHADMO CC[C@@H]1[C@@H](C)CC[N@H+]1CCCc1ccsc1 ZINC000481378902 529478199 /nfs/dbraw/zinc/47/81/99/529478199.db2.gz YJKXAVPFJHMWDT-GXTWGEPZSA-N 1 1 237.412 3.801 20 0 BHADMO CC[C@H]1[C@@H](C)CC[N@H+]1CCCc1ccsc1 ZINC000481378903 529336981 /nfs/dbraw/zinc/33/69/81/529336981.db2.gz YJKXAVPFJHMWDT-JSGCOSHPSA-N 1 1 237.412 3.801 20 0 BHADMO CC[C@H]1[C@H](C)CC[N@H+]1CCCc1ccsc1 ZINC000481378904 529341481 /nfs/dbraw/zinc/34/14/81/529341481.db2.gz YJKXAVPFJHMWDT-OCCSQVGLSA-N 1 1 237.412 3.801 20 0 BHADMO CC[C@@H]1[C@H](C)CC[N@H+]1CCCc1ccsc1 ZINC000481378905 529483568 /nfs/dbraw/zinc/48/35/68/529483568.db2.gz YJKXAVPFJHMWDT-TZMCWYRMSA-N 1 1 237.412 3.801 20 0 BHADMO CC[C@H]1[C@@H](C)CC[N@H+]1Cc1c(F)cccc1F ZINC000481394534 529337112 /nfs/dbraw/zinc/33/71/12/529337112.db2.gz WFYOZCMNRWMOAX-HZMBPMFUSA-N 1 1 239.309 3.585 20 0 BHADMO CC[C@@H]1[C@@H](C)CC[N@H+]1Cc1c(F)cccc1F ZINC000481394535 529478088 /nfs/dbraw/zinc/47/80/88/529478088.db2.gz WFYOZCMNRWMOAX-IINYFYTJSA-N 1 1 239.309 3.585 20 0 BHADMO CC[C@@H]1[C@H](C)CC[N@H+]1Cc1c(F)cccc1F ZINC000481394536 529483357 /nfs/dbraw/zinc/48/33/57/529483357.db2.gz WFYOZCMNRWMOAX-QMTHXVAHSA-N 1 1 239.309 3.585 20 0 BHADMO CC[C@H]1[C@H](C)CC[N@H+]1Cc1c(F)cccc1F ZINC000481394537 529341664 /nfs/dbraw/zinc/34/16/64/529341664.db2.gz WFYOZCMNRWMOAX-YGRLFVJLSA-N 1 1 239.309 3.585 20 0 BHADMO CC[C@@H]1[C@H](C)CC[N@H+]1CCCCC(F)(F)F ZINC000481394822 529483515 /nfs/dbraw/zinc/48/35/15/529483515.db2.gz YBQVFGHXHYOHIN-GHMZBOCLSA-N 1 1 237.309 3.839 20 0 BHADMO CC[C@H]1[C@H](C)CC[N@H+]1CCCCC(F)(F)F ZINC000481394823 529341486 /nfs/dbraw/zinc/34/14/86/529341486.db2.gz YBQVFGHXHYOHIN-MNOVXSKESA-N 1 1 237.309 3.839 20 0 BHADMO CC[C@H]1[C@@H](C)CC[N@H+]1CCCCC(F)(F)F ZINC000481394824 529337408 /nfs/dbraw/zinc/33/74/08/529337408.db2.gz YBQVFGHXHYOHIN-QWRGUYRKSA-N 1 1 237.309 3.839 20 0 BHADMO CC[C@@H]1[C@@H](C)CC[N@H+]1CCCCC(F)(F)F ZINC000481394825 529477832 /nfs/dbraw/zinc/47/78/32/529477832.db2.gz YBQVFGHXHYOHIN-WDEREUQCSA-N 1 1 237.309 3.839 20 0 BHADMO CCC[N@@H+](CC1CC1)[C@H]1CCCc2cccnc21 ZINC000481444069 528029026 /nfs/dbraw/zinc/02/90/26/528029026.db2.gz ZKIUQISOLZXWLI-HNNXBMFYSA-N 1 1 244.382 3.581 20 0 BHADMO CCC[N@@H+](CC1CC1)[C@@H]1CCCc2cccnc21 ZINC000481444072 528028781 /nfs/dbraw/zinc/02/87/81/528028781.db2.gz ZKIUQISOLZXWLI-OAHLLOKOSA-N 1 1 244.382 3.581 20 0 BHADMO Fc1ccc([C@H]2CCC[N@@H+](CC3CC3)CC2)cc1 ZINC000481512705 362639778 /nfs/dbraw/zinc/63/97/78/362639778.db2.gz BXSOIGJPBBJOEJ-AWEZNQCLSA-N 1 1 247.357 3.805 20 0 BHADMO Fc1ccc([C@@H]2CCC[N@@H+](CC3CC3)CC2)cc1 ZINC000481512718 362639467 /nfs/dbraw/zinc/63/94/67/362639467.db2.gz BXSOIGJPBBJOEJ-CQSZACIVSA-N 1 1 247.357 3.805 20 0 BHADMO C[C@@H]1CCCC[N@@H+](Cc2ccc(F)c(F)c2)C1 ZINC000481573911 534155899 /nfs/dbraw/zinc/15/58/99/534155899.db2.gz UTEXKWYCINSUKW-LLVKDONJSA-N 1 1 239.309 3.587 20 0 BHADMO C[C@H]1CCCC[N@@H+](Cc2ccc(F)c(F)c2)C1 ZINC000481573912 225217477 /nfs/dbraw/zinc/21/74/77/225217477.db2.gz UTEXKWYCINSUKW-NSHDSACASA-N 1 1 239.309 3.587 20 0 BHADMO C[C@@H]1CCCC[N@@H+](Cc2cccc(F)c2F)C1 ZINC000481580297 534155934 /nfs/dbraw/zinc/15/59/34/534155934.db2.gz SPXIMYWGEWZCGR-LLVKDONJSA-N 1 1 239.309 3.587 20 0 BHADMO C[C@H]1CCCC[N@@H+](Cc2cccc(F)c2F)C1 ZINC000481580298 225216917 /nfs/dbraw/zinc/21/69/17/225216917.db2.gz SPXIMYWGEWZCGR-NSHDSACASA-N 1 1 239.309 3.587 20 0 BHADMO C[C@@H]1CCCC[N@@H+](CCCc2ccsc2)C1 ZINC000481584147 534156032 /nfs/dbraw/zinc/15/60/32/534156032.db2.gz ZAKCXCPTJIYAQV-CYBMUJFWSA-N 1 1 237.412 3.803 20 0 BHADMO C[C@H]1CCCC[N@@H+](CCCc2ccsc2)C1 ZINC000481584148 225216862 /nfs/dbraw/zinc/21/68/62/225216862.db2.gz ZAKCXCPTJIYAQV-ZDUSSCGKSA-N 1 1 237.412 3.803 20 0 BHADMO C[C@@H]1CCCC[N@@H+](CCCCC(F)(F)F)C1 ZINC000481617250 534155007 /nfs/dbraw/zinc/15/50/07/534155007.db2.gz QAQZAQRIOGYOIV-LLVKDONJSA-N 1 1 237.309 3.841 20 0 BHADMO C[C@H]1CCCC[N@@H+](CCCCC(F)(F)F)C1 ZINC000481617251 225217429 /nfs/dbraw/zinc/21/74/29/225217429.db2.gz QAQZAQRIOGYOIV-NSHDSACASA-N 1 1 237.309 3.841 20 0 BHADMO Cc1cc2[nH]c(C[N@H+](C)C(C)C)cc2c(C)c1 ZINC000481682606 225217505 /nfs/dbraw/zinc/21/75/05/225217505.db2.gz HLVITEIZMZDBFR-UHFFFAOYSA-N 1 1 230.355 3.625 20 0 BHADMO CCCCC[N@H+]1Cc2ccccc2C2(CC2)C1 ZINC000481718784 528185391 /nfs/dbraw/zinc/18/53/91/528185391.db2.gz AWLCXLUHVRGZPZ-UHFFFAOYSA-N 1 1 229.367 3.724 20 0 BHADMO c1ccc2c(c1)C[N@@H+]([C@H]1C=CCCC1)CC21CC1 ZINC000481720383 225219437 /nfs/dbraw/zinc/21/94/37/225219437.db2.gz FTBAFDAIUKGQOW-HNNXBMFYSA-N 1 1 239.362 3.643 20 0 BHADMO c1ccc2c(c1)C[N@@H+]([C@@H]1C=CCCC1)CC21CC1 ZINC000481720394 225218643 /nfs/dbraw/zinc/21/86/43/225218643.db2.gz FTBAFDAIUKGQOW-OAHLLOKOSA-N 1 1 239.362 3.643 20 0 BHADMO CC[C@H](C)C[N@H+]1CCC[C@H](C(F)(F)F)[C@H]1C ZINC000481729602 529659384 /nfs/dbraw/zinc/65/93/84/529659384.db2.gz NGORVXGNHGVGDX-AXFHLTTASA-N 1 1 237.309 3.695 20 0 BHADMO CC[C@H](C)C[N@H+]1CCC[C@H](C(F)(F)F)[C@@H]1C ZINC000481729603 529659377 /nfs/dbraw/zinc/65/93/77/529659377.db2.gz NGORVXGNHGVGDX-DCAQKATOSA-N 1 1 237.309 3.695 20 0 BHADMO CC[C@H](C)C[N@H+]1CCC[C@@H](C(F)(F)F)[C@@H]1C ZINC000481729604 529658732 /nfs/dbraw/zinc/65/87/32/529658732.db2.gz NGORVXGNHGVGDX-GARJFASQSA-N 1 1 237.309 3.695 20 0 BHADMO CC[C@H](C)C[N@H+]1CCC[C@@H](C(F)(F)F)[C@H]1C ZINC000481729605 529659168 /nfs/dbraw/zinc/65/91/68/529659168.db2.gz NGORVXGNHGVGDX-HBNTYKKESA-N 1 1 237.309 3.695 20 0 BHADMO CC(C)CC[N@H+]1Cc2ccccc2C2(CC2)C1 ZINC000481749014 527728969 /nfs/dbraw/zinc/72/89/69/527728969.db2.gz VFGDJTQRVHUGRZ-UHFFFAOYSA-N 1 1 229.367 3.580 20 0 BHADMO CC[C@@H](C[N@@H+](CC)CCCOC)c1ccccc1 ZINC000481749381 529472287 /nfs/dbraw/zinc/47/22/87/529472287.db2.gz MXRLYHQGEWUZKM-HNNXBMFYSA-N 1 1 249.398 3.539 20 0 BHADMO CC[C@H](C[N@@H+](CC)CCCOC)c1ccccc1 ZINC000481749382 529334009 /nfs/dbraw/zinc/33/40/09/529334009.db2.gz MXRLYHQGEWUZKM-OAHLLOKOSA-N 1 1 249.398 3.539 20 0 BHADMO CC[C@@H](C)C[N@H+]1Cc2ccccc2C2(CC2)C1 ZINC000481749670 529319844 /nfs/dbraw/zinc/31/98/44/529319844.db2.gz WZDLYVQYOBNQRI-CYBMUJFWSA-N 1 1 229.367 3.580 20 0 BHADMO CC[C@H](C)C[N@H+]1Cc2ccccc2C2(CC2)C1 ZINC000481749671 529658950 /nfs/dbraw/zinc/65/89/50/529658950.db2.gz WZDLYVQYOBNQRI-ZDUSSCGKSA-N 1 1 229.367 3.580 20 0 BHADMO CC[C@@H](C[N@@H+](CC)CCCF)c1ccccc1 ZINC000481752672 529472550 /nfs/dbraw/zinc/47/25/50/529472550.db2.gz WIEDVYOZDRVGST-AWEZNQCLSA-N 1 1 237.362 3.862 20 0 BHADMO CC[C@H](C[N@@H+](CC)CCCF)c1ccccc1 ZINC000481752723 529333998 /nfs/dbraw/zinc/33/39/98/529333998.db2.gz WIEDVYOZDRVGST-CQSZACIVSA-N 1 1 237.362 3.862 20 0 BHADMO CC(C)[N@@H+]1CC=C(c2cccc(Cl)c2)CC1 ZINC000481780510 528985443 /nfs/dbraw/zinc/98/54/43/528985443.db2.gz BJHDKZXSIGTHFC-UHFFFAOYSA-N 1 1 235.758 3.838 20 0 BHADMO CCC[N@@H+]1CC=C(c2cccc(Cl)c2)CC1 ZINC000481793256 528180498 /nfs/dbraw/zinc/18/04/98/528180498.db2.gz GYNITZVBBBDFGA-UHFFFAOYSA-N 1 1 235.758 3.839 20 0 BHADMO CC[N@@H+](Cc1cc2c(cc(C)cc2C)[nH]1)C1CC1 ZINC000481887495 528768653 /nfs/dbraw/zinc/76/86/53/528768653.db2.gz AMPRIKCQYFKDDT-UHFFFAOYSA-N 1 1 242.366 3.769 20 0 BHADMO Cc1cc2[nH]c(C[N@@H+](C)CC3CC3)cc2c(C)c1 ZINC000481889417 225218441 /nfs/dbraw/zinc/21/84/41/225218441.db2.gz GBUVGHSKVKCEJF-UHFFFAOYSA-N 1 1 242.366 3.627 20 0 BHADMO C[C@@H](Cc1ccccc1)C[N@@H+](C)C1CCCC1 ZINC000481895568 534246250 /nfs/dbraw/zinc/24/62/50/534246250.db2.gz PVOLYBXLTHJFLC-AWEZNQCLSA-N 1 1 231.383 3.740 20 0 BHADMO C[C@H](Cc1ccccc1)C[N@@H+](C)C1CCCC1 ZINC000481895569 225221000 /nfs/dbraw/zinc/22/10/00/225221000.db2.gz PVOLYBXLTHJFLC-CQSZACIVSA-N 1 1 231.383 3.740 20 0 BHADMO Cc1cc2[nH]c(C[N@H+](C)CC(C)C)cc2c(C)c1 ZINC000481906976 225220327 /nfs/dbraw/zinc/22/03/27/225220327.db2.gz SVLLUBJDVQEGNC-UHFFFAOYSA-N 1 1 244.382 3.873 20 0 BHADMO CCC[N@@H+](C)Cc1cc2c(cc(C)cc2C)[nH]1 ZINC000481909496 527854201 /nfs/dbraw/zinc/85/42/01/527854201.db2.gz ZKTZBRFXZZMTDF-UHFFFAOYSA-N 1 1 230.355 3.627 20 0 BHADMO CCCc1cccc(C[N@@H+](C)[C@H]2CCSC2)c1 ZINC000481914549 528633309 /nfs/dbraw/zinc/63/33/09/528633309.db2.gz AISNDHCRRAZJKN-HNNXBMFYSA-N 1 1 249.423 3.576 20 0 BHADMO CCCc1cccc(C[N@@H+](C)[C@@H]2CCSC2)c1 ZINC000481914550 528633301 /nfs/dbraw/zinc/63/33/01/528633301.db2.gz AISNDHCRRAZJKN-OAHLLOKOSA-N 1 1 249.423 3.576 20 0 BHADMO CCCc1cccc(C[N@@H+](C)Cc2ccco2)c1 ZINC000481930937 528632243 /nfs/dbraw/zinc/63/22/43/528632243.db2.gz HNJLRIJVSDITTN-UHFFFAOYSA-N 1 1 243.350 3.864 20 0 BHADMO COc1cccc2c(NC3CCC3)cc(C)[nH+]c12 ZINC000481973101 533842183 /nfs/dbraw/zinc/84/21/83/533842183.db2.gz YUKFBKDHDSJRRS-UHFFFAOYSA-N 1 1 242.322 3.516 20 0 BHADMO CCCc1cccc(C[N@H+]2CCC23CCC3)c1 ZINC000481986902 528632417 /nfs/dbraw/zinc/63/24/17/528632417.db2.gz UVUOIWQZIMHLAV-UHFFFAOYSA-N 1 1 229.367 3.768 20 0 BHADMO CCCc1cccc(C[N@@H+](C)Cc2ccc[nH]2)c1 ZINC000481989584 528632314 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225222448 /nfs/dbraw/zinc/22/24/48/225222448.db2.gz QHQYWCRKSIQSQB-CYBMUJFWSA-N 1 1 242.366 3.769 20 0 BHADMO Cc1cc2[nH]c(C[N@@H+]3CCC[C@@H]3C)cc2c(C)c1 ZINC000481999744 225222109 /nfs/dbraw/zinc/22/21/09/225222109.db2.gz QHQYWCRKSIQSQB-ZDUSSCGKSA-N 1 1 242.366 3.769 20 0 BHADMO CCCc1cccc(C[N@@H+](C)C2CCC2)c1 ZINC000481999807 528632403 /nfs/dbraw/zinc/63/24/03/528632403.db2.gz QTDUATNPZZUABY-UHFFFAOYSA-N 1 1 217.356 3.623 20 0 BHADMO CC1=CC[N@@H+](C[C@@H](C)Cc2ccccc2)CC1 ZINC000482009937 528121542 /nfs/dbraw/zinc/12/15/42/528121542.db2.gz QIKGGKBHJGVLRV-HNNXBMFYSA-N 1 1 229.367 3.517 20 0 BHADMO CC1=CC[N@@H+](C[C@H](C)Cc2ccccc2)CC1 ZINC000482009938 528120767 /nfs/dbraw/zinc/12/07/67/528120767.db2.gz QIKGGKBHJGVLRV-OAHLLOKOSA-N 1 1 229.367 3.517 20 0 BHADMO CC[N@@H+](C)CCCc1c(Cl)cccc1Cl ZINC000482071894 527793733 /nfs/dbraw/zinc/79/37/33/527793733.db2.gz SGKIZVAAMIMVLU-UHFFFAOYSA-N 1 1 246.181 3.878 20 0 BHADMO CC(C)=CCC[C@H](C)CC[N@@H+](C)Cc1cc[nH]n1 ZINC000482156005 527418385 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KSUMWZQOIZRSMI-UHFFFAOYSA-N 1 1 241.787 3.944 20 0 BHADMO CC1=C(C)C[N@@H+](C[C@@H]2C[C@@H]2c2ccccc2)CC1 ZINC000482458269 528090441 /nfs/dbraw/zinc/09/04/41/528090441.db2.gz LJPGNODSXMJURN-DLBZAZTESA-N 1 1 241.378 3.832 20 0 BHADMO CC1=C(C)C[N@@H+](C[C@H]2C[C@@H]2c2ccccc2)CC1 ZINC000482458270 528089723 /nfs/dbraw/zinc/08/97/23/528089723.db2.gz LJPGNODSXMJURN-IAGOWNOFSA-N 1 1 241.378 3.832 20 0 BHADMO CC1=C(C)C[N@@H+](C[C@H]2C[C@H]2c2ccccc2)CC1 ZINC000482458271 528089750 /nfs/dbraw/zinc/08/97/50/528089750.db2.gz LJPGNODSXMJURN-SJORKVTESA-N 1 1 241.378 3.832 20 0 BHADMO CC1=C(C)C[N@@H+](Cc2cc3ccccc3o2)CC1 ZINC000482458330 528091234 /nfs/dbraw/zinc/09/12/34/528091234.db2.gz LZWNFBKCWDESNH-UHFFFAOYSA-N 1 1 241.334 3.975 20 0 BHADMO Cc1ccc2c(c1)C[N@H+](C[C@H]1CC=CCC1)C2 ZINC000482458508 534424655 /nfs/dbraw/zinc/42/46/55/534424655.db2.gz XUPUFAOXROBAQC-AWEZNQCLSA-N 1 1 227.351 3.667 20 0 BHADMO Cc1ccc2c(c1)C[N@H+](C[C@@H]1CC=CCC1)C2 ZINC000482458509 534424011 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ZINC000482488797 386806691 /nfs/dbraw/zinc/80/66/91/386806691.db2.gz RMBMMZJTDSUZHK-IUODEOHRSA-N 1 1 242.366 3.788 20 0 BHADMO CC[C@@H]1[C@@H](C)CC[N@H+]1Cc1cccc2cc[nH]c21 ZINC000482488828 386806299 /nfs/dbraw/zinc/80/62/99/386806299.db2.gz RMBMMZJTDSUZHK-SWLSCSKDSA-N 1 1 242.366 3.788 20 0 BHADMO CC[C@H]1[C@@H](C)CC[N@H+]1Cc1cccc2cc[nH]c21 ZINC000482488910 386806595 /nfs/dbraw/zinc/80/65/95/386806595.db2.gz RMBMMZJTDSUZHK-WFASDCNBSA-N 1 1 242.366 3.788 20 0 BHADMO CC[C@H]1[C@@H](C)CC[N@H+]1Cc1cc(F)cc(F)c1 ZINC000482490697 529337250 /nfs/dbraw/zinc/33/72/50/529337250.db2.gz ZLKMVCUEKGTQQH-HZMBPMFUSA-N 1 1 239.309 3.585 20 0 BHADMO CC[C@@H]1[C@@H](C)CC[N@H+]1Cc1cc(F)cc(F)c1 ZINC000482490698 529477691 /nfs/dbraw/zinc/47/76/91/529477691.db2.gz ZLKMVCUEKGTQQH-IINYFYTJSA-N 1 1 239.309 3.585 20 0 BHADMO CC[C@@H]1[C@H](C)CC[N@H+]1Cc1cc(F)cc(F)c1 ZINC000482490699 529483602 /nfs/dbraw/zinc/48/36/02/529483602.db2.gz ZLKMVCUEKGTQQH-QMTHXVAHSA-N 1 1 239.309 3.585 20 0 BHADMO CC[C@H]1[C@H](C)CC[N@H+]1Cc1cc(F)cc(F)c1 ZINC000482490700 529341717 /nfs/dbraw/zinc/34/17/17/529341717.db2.gz ZLKMVCUEKGTQQH-YGRLFVJLSA-N 1 1 239.309 3.585 20 0 BHADMO CC[C@@H]1[C@@H](C)CC[N@H+]1Cc1sccc1C ZINC000482494140 529478179 /nfs/dbraw/zinc/47/81/79/529478179.db2.gz BLSXGRSOVVQSKD-CMPLNLGQSA-N 1 1 223.385 3.677 20 0 BHADMO CC[C@H]1[C@@H](C)CC[N@H+]1Cc1sccc1C ZINC000482494141 529337125 /nfs/dbraw/zinc/33/71/25/529337125.db2.gz BLSXGRSOVVQSKD-JQWIXIFHSA-N 1 1 223.385 3.677 20 0 BHADMO CC[C@H]1[C@H](C)CC[N@H+]1Cc1sccc1C ZINC000482494142 529341820 /nfs/dbraw/zinc/34/18/20/529341820.db2.gz BLSXGRSOVVQSKD-PWSUYJOCSA-N 1 1 223.385 3.677 20 0 BHADMO CC[C@@H]1[C@H](C)CC[N@H+]1Cc1sccc1C ZINC000482494143 529483437 /nfs/dbraw/zinc/48/34/37/529483437.db2.gz BLSXGRSOVVQSKD-ZYHUDNBSSA-N 1 1 223.385 3.677 20 0 BHADMO CC[C@H]1[C@@H](C)CC[N@H+]1Cc1ccc(C)s1 ZINC000482496890 529337337 /nfs/dbraw/zinc/33/73/37/529337337.db2.gz XAXPUXCCPISCAX-GWCFXTLKSA-N 1 1 223.385 3.677 20 0 BHADMO CC[C@@H]1[C@@H](C)CC[N@H+]1Cc1ccc(C)s1 ZINC000482496891 529478127 /nfs/dbraw/zinc/47/81/27/529478127.db2.gz XAXPUXCCPISCAX-GXFFZTMASA-N 1 1 223.385 3.677 20 0 BHADMO CC[C@H]1[C@H](C)CC[N@H+]1Cc1ccc(C)s1 ZINC000482496892 529341882 /nfs/dbraw/zinc/34/18/82/529341882.db2.gz XAXPUXCCPISCAX-MFKMUULPSA-N 1 1 223.385 3.677 20 0 BHADMO CC[C@@H]1[C@H](C)CC[N@H+]1Cc1ccc(C)s1 ZINC000482496893 529483489 /nfs/dbraw/zinc/48/34/89/529483489.db2.gz XAXPUXCCPISCAX-ZWNOBZJWSA-N 1 1 223.385 3.677 20 0 BHADMO CCCC[N@@H+](C)Cc1ccc(Cl)cc1OC ZINC000482621021 528359184 /nfs/dbraw/zinc/35/91/84/528359184.db2.gz RGMCLUZGPKIYQD-UHFFFAOYSA-N 1 1 241.762 3.581 20 0 BHADMO CCC[N@@H+](CC)Cc1ccc(Cl)cc1OC ZINC000482701009 528003550 /nfs/dbraw/zinc/00/35/50/528003550.db2.gz ZPOVQYPLTUZWST-UHFFFAOYSA-N 1 1 241.762 3.581 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1ccc(Cl)cc1OC ZINC000482796697 529691001 /nfs/dbraw/zinc/69/10/01/529691001.db2.gz VPZRBVJVOHQWIB-JTQLQIEISA-N 1 1 241.762 3.579 20 0 BHADMO CC[C@@H](C)[N@@H+](C)Cc1ccc(Cl)cc1OC ZINC000482796699 529344644 /nfs/dbraw/zinc/34/46/44/529344644.db2.gz VPZRBVJVOHQWIB-SNVBAGLBSA-N 1 1 241.762 3.579 20 0 BHADMO C[C@H](c1ccc(F)c(F)c1)[N@H+]1CC[C@@H](C)[C@H]1C ZINC000482837272 225230633 /nfs/dbraw/zinc/23/06/33/225230633.db2.gz IOVNTPDNSYUEHW-GMTAPVOTSA-N 1 1 239.309 3.756 20 0 BHADMO C[C@@H](c1ccc(F)c(F)c1)[N@H+]1CC[C@@H](C)[C@H]1C ZINC000482837273 225229949 /nfs/dbraw/zinc/22/99/49/225229949.db2.gz IOVNTPDNSYUEHW-MXWKQRLJSA-N 1 1 239.309 3.756 20 0 BHADMO C[C@H](c1ccc(F)c(F)c1)[N@H+]1CC[C@@H](C)[C@@H]1C ZINC000482837274 225230297 /nfs/dbraw/zinc/23/02/97/225230297.db2.gz IOVNTPDNSYUEHW-OUAUKWLOSA-N 1 1 239.309 3.756 20 0 BHADMO C[C@@H](c1ccc(F)c(F)c1)[N@H+]1CC[C@@H](C)[C@@H]1C ZINC000482837275 225230895 /nfs/dbraw/zinc/23/08/95/225230895.db2.gz IOVNTPDNSYUEHW-VWYCJHECSA-N 1 1 239.309 3.756 20 0 BHADMO CC[C@H](c1ccccc1)[N@H+]1CC[C@H](C)[C@H]1C ZINC000482842760 529182471 /nfs/dbraw/zinc/18/24/71/529182471.db2.gz VJROKUWKKVYEOQ-GZBFAFLISA-N 1 1 217.356 3.868 20 0 BHADMO CC[C@H](c1ccccc1)[N@H+]1CC[C@H](C)[C@@H]1C ZINC000482842761 529182228 /nfs/dbraw/zinc/18/22/28/529182228.db2.gz VJROKUWKKVYEOQ-KCQAQPDRSA-N 1 1 217.356 3.868 20 0 BHADMO CC[C@H](c1ccccc1)[N@H+]1CC[C@@H](C)[C@H]1C ZINC000482842762 529182261 /nfs/dbraw/zinc/18/22/61/529182261.db2.gz VJROKUWKKVYEOQ-UMVBOHGHSA-N 1 1 217.356 3.868 20 0 BHADMO CC[C@H](c1ccccc1)[N@H+]1CC[C@@H](C)[C@@H]1C ZINC000482842763 529182476 /nfs/dbraw/zinc/18/24/76/529182476.db2.gz VJROKUWKKVYEOQ-VNHYZAJKSA-N 1 1 217.356 3.868 20 0 BHADMO CCOCCC[N@@H+](CC(C)C)C(CC)CC ZINC000482845670 528657379 /nfs/dbraw/zinc/65/73/79/528657379.db2.gz RUSGGQOAVDQKQZ-UHFFFAOYSA-N 1 1 229.408 3.560 20 0 BHADMO C[C@H](c1cc(F)ccc1F)[N@H+]1CC[C@@H](C)[C@H]1C ZINC000482851797 225230437 /nfs/dbraw/zinc/23/04/37/225230437.db2.gz CWXSVAKNVJYBCY-GMTAPVOTSA-N 1 1 239.309 3.756 20 0 BHADMO C[C@@H](c1cc(F)ccc1F)[N@H+]1CC[C@@H](C)[C@H]1C ZINC000482851798 534045887 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225230560 /nfs/dbraw/zinc/23/05/60/225230560.db2.gz HVRKYMGPXQNWTI-STQMWFEESA-N 1 1 235.396 3.509 20 0 BHADMO C[C@H](c1ccc(F)cc1)[N@H+]1CC[C@@H](C)[C@@H]1C ZINC000482860719 225230652 /nfs/dbraw/zinc/23/06/52/225230652.db2.gz UZSKTSVHSGMZRX-GRYCIOLGSA-N 1 1 221.319 3.617 20 0 BHADMO C[C@H](c1ccc(F)cc1)[N@H+]1CC[C@@H](C)[C@H]1C ZINC000482860720 225230780 /nfs/dbraw/zinc/23/07/80/225230780.db2.gz UZSKTSVHSGMZRX-IJLUTSLNSA-N 1 1 221.319 3.617 20 0 BHADMO C[C@@H](c1ccc(F)cc1)[N@H+]1CC[C@@H](C)[C@H]1C ZINC000482860721 534061606 /nfs/dbraw/zinc/06/16/06/534061606.db2.gz UZSKTSVHSGMZRX-UTUOFQBUSA-N 1 1 221.319 3.617 20 0 BHADMO C[C@@H](c1ccc(F)cc1)[N@H+]1CC[C@@H](C)[C@@H]1C ZINC000482860722 534062812 /nfs/dbraw/zinc/06/28/12/534062812.db2.gz UZSKTSVHSGMZRX-WOPDTQHZSA-N 1 1 221.319 3.617 20 0 BHADMO C[C@H](c1c(F)cccc1F)[N@H+]1CC[C@@H](C)[C@H]1C ZINC000482861151 225230189 /nfs/dbraw/zinc/23/01/89/225230189.db2.gz VWHLGTZWYAQAKS-GMTAPVOTSA-N 1 1 239.309 3.756 20 0 BHADMO C[C@@H](c1c(F)cccc1F)[N@H+]1CC[C@@H](C)[C@H]1C ZINC000482861153 534040214 /nfs/dbraw/zinc/04/02/14/534040214.db2.gz VWHLGTZWYAQAKS-MXWKQRLJSA-N 1 1 239.309 3.756 20 0 BHADMO C[C@H](c1c(F)cccc1F)[N@H+]1CC[C@@H](C)[C@@H]1C ZINC000482861156 225230497 /nfs/dbraw/zinc/23/04/97/225230497.db2.gz VWHLGTZWYAQAKS-OUAUKWLOSA-N 1 1 239.309 3.756 20 0 BHADMO C[C@@H](c1c(F)cccc1F)[N@H+]1CC[C@@H](C)[C@@H]1C ZINC000482861159 534040641 /nfs/dbraw/zinc/04/06/41/534040641.db2.gz VWHLGTZWYAQAKS-VWYCJHECSA-N 1 1 239.309 3.756 20 0 BHADMO C[C@H](c1ccccc1F)[N@H+]1CC[C@@H](C)[C@@H]1C ZINC000482865359 225230965 /nfs/dbraw/zinc/23/09/65/225230965.db2.gz YEWLMTYEJNEWFB-GRYCIOLGSA-N 1 1 221.319 3.617 20 0 BHADMO C[C@H](c1ccccc1F)[N@H+]1CC[C@@H](C)[C@H]1C ZINC000482865361 225230245 /nfs/dbraw/zinc/23/02/45/225230245.db2.gz YEWLMTYEJNEWFB-IJLUTSLNSA-N 1 1 221.319 3.617 20 0 BHADMO C[C@@H](c1ccccc1F)[N@H+]1CC[C@@H](C)[C@H]1C ZINC000482865363 225230854 /nfs/dbraw/zinc/23/08/54/225230854.db2.gz YEWLMTYEJNEWFB-UTUOFQBUSA-N 1 1 221.319 3.617 20 0 BHADMO C[C@@H](c1ccccc1F)[N@H+]1CC[C@@H](C)[C@@H]1C ZINC000482865370 225232514 /nfs/dbraw/zinc/23/25/14/225232514.db2.gz YEWLMTYEJNEWFB-WOPDTQHZSA-N 1 1 221.319 3.617 20 0 BHADMO C[C@H](c1cccc(F)c1)[N@H+]1CC[C@@H](C)[C@@H]1C ZINC000482867051 534129901 /nfs/dbraw/zinc/12/99/01/534129901.db2.gz NJBQCJQXQVYNCX-GRYCIOLGSA-N 1 1 221.319 3.617 20 0 BHADMO C[C@H](c1cccc(F)c1)[N@H+]1CC[C@@H](C)[C@H]1C ZINC000482867052 534129870 /nfs/dbraw/zinc/12/98/70/534129870.db2.gz NJBQCJQXQVYNCX-IJLUTSLNSA-N 1 1 221.319 3.617 20 0 BHADMO C[C@@H](c1cccc(F)c1)[N@H+]1CC[C@@H](C)[C@H]1C ZINC000482867053 534088725 /nfs/dbraw/zinc/08/87/25/534088725.db2.gz NJBQCJQXQVYNCX-UTUOFQBUSA-N 1 1 221.319 3.617 20 0 BHADMO C[C@@H](c1cccc(F)c1)[N@H+]1CC[C@@H](C)[C@@H]1C ZINC000482867054 534089325 /nfs/dbraw/zinc/08/93/25/534089325.db2.gz NJBQCJQXQVYNCX-WOPDTQHZSA-N 1 1 221.319 3.617 20 0 BHADMO C[C@@H]1CC[N@@H+](CCCCOc2ccccc2)[C@H]1C ZINC000482869578 534031472 /nfs/dbraw/zinc/03/14/72/534031472.db2.gz VCLLVSLCEIHNLY-CABCVRRESA-N 1 1 247.382 3.576 20 0 BHADMO C[C@H]1CC[N@@H+](CCCCOc2ccccc2)[C@H]1C ZINC000482869579 225232354 /nfs/dbraw/zinc/23/23/54/225232354.db2.gz VCLLVSLCEIHNLY-GJZGRUSLSA-N 1 1 247.382 3.576 20 0 BHADMO C[C@@H]1CC[N@@H+](CCCCOc2ccccc2)[C@@H]1C ZINC000482869580 534032421 /nfs/dbraw/zinc/03/24/21/534032421.db2.gz VCLLVSLCEIHNLY-HUUCEWRRSA-N 1 1 247.382 3.576 20 0 BHADMO C[C@@H]1[C@@H](C)CC[N@H+]1CCCCOc1ccccc1 ZINC000482869581 534233430 /nfs/dbraw/zinc/23/34/30/534233430.db2.gz VCLLVSLCEIHNLY-LSDHHAIUSA-N 1 1 247.382 3.576 20 0 BHADMO C[C@@H]1CC[N@H+]([C@H]2CCc3ccc(F)cc32)[C@@H]1C ZINC000482879564 534055215 /nfs/dbraw/zinc/05/52/15/534055215.db2.gz YIQSCDVXRYISEN-HFAKWTLXSA-N 1 1 233.330 3.543 20 0 BHADMO C[C@@H]1CC[N@H+]([C@@H]2CCc3ccc(F)cc32)[C@H]1C ZINC000482879565 534054679 /nfs/dbraw/zinc/05/46/79/534054679.db2.gz YIQSCDVXRYISEN-JRPNMDOOSA-N 1 1 233.330 3.543 20 0 BHADMO C[C@@H]1CC[N@H+]([C@@H]2CCc3ccc(F)cc32)[C@@H]1C ZINC000482879566 534055609 /nfs/dbraw/zinc/05/56/09/534055609.db2.gz YIQSCDVXRYISEN-UEKVPHQBSA-N 1 1 233.330 3.543 20 0 BHADMO C[C@@H]1CC[N@H+]([C@H]2CCc3ccc(F)cc32)[C@H]1C ZINC000482879567 534053965 /nfs/dbraw/zinc/05/39/65/534053965.db2.gz YIQSCDVXRYISEN-ZETOZRRWSA-N 1 1 233.330 3.543 20 0 BHADMO C[C@H](C[N@H+]1CC[C@H](C)[C@H]1C)c1ccccc1 ZINC000482882365 534070540 /nfs/dbraw/zinc/07/05/40/534070540.db2.gz AQNOWTIDXKVBKE-BFHYXJOUSA-N 1 1 217.356 3.520 20 0 BHADMO C[C@H](C[N@H+]1CC[C@@H](C)[C@@H]1C)c1ccccc1 ZINC000482882366 534068745 /nfs/dbraw/zinc/06/87/45/534068745.db2.gz AQNOWTIDXKVBKE-MCIONIFRSA-N 1 1 217.356 3.520 20 0 BHADMO C[C@H](C[N@H+]1CC[C@@H](C)[C@H]1C)c1ccccc1 ZINC000482882367 534070289 /nfs/dbraw/zinc/07/02/89/534070289.db2.gz AQNOWTIDXKVBKE-MGPQQGTHSA-N 1 1 217.356 3.520 20 0 BHADMO C[C@H](C[N@H+]1CC[C@H](C)[C@@H]1C)c1ccccc1 ZINC000482882368 534069634 /nfs/dbraw/zinc/06/96/34/534069634.db2.gz AQNOWTIDXKVBKE-MJBXVCDLSA-N 1 1 217.356 3.520 20 0 BHADMO C[C@H](c1ccc(F)cc1F)[N@H+]1CC[C@@H](C)[C@H]1C ZINC000482886843 225231993 /nfs/dbraw/zinc/23/19/93/225231993.db2.gz HPRYMTFSWLJPCN-GMTAPVOTSA-N 1 1 239.309 3.756 20 0 BHADMO C[C@@H](c1ccc(F)cc1F)[N@H+]1CC[C@@H](C)[C@H]1C ZINC000482886844 534064330 /nfs/dbraw/zinc/06/43/30/534064330.db2.gz HPRYMTFSWLJPCN-MXWKQRLJSA-N 1 1 239.309 3.756 20 0 BHADMO C[C@H](c1ccc(F)cc1F)[N@H+]1CC[C@@H](C)[C@@H]1C ZINC000482886846 225232215 /nfs/dbraw/zinc/23/22/15/225232215.db2.gz HPRYMTFSWLJPCN-OUAUKWLOSA-N 1 1 239.309 3.756 20 0 BHADMO C[C@@H](c1ccc(F)cc1F)[N@H+]1CC[C@@H](C)[C@@H]1C ZINC000482886847 534063857 /nfs/dbraw/zinc/06/38/57/534063857.db2.gz HPRYMTFSWLJPCN-VWYCJHECSA-N 1 1 239.309 3.756 20 0 BHADMO C[C@@H]1CC[N@@H+](CCc2ccccc2Cl)[C@H]1C ZINC000482891732 534035906 /nfs/dbraw/zinc/03/59/06/534035906.db2.gz OZBYBPCKQMRJAI-NEPJUHHUSA-N 1 1 237.774 3.613 20 0 BHADMO C[C@@H]1[C@@H](C)CC[N@H+]1CCc1ccccc1Cl ZINC000482892429 534233046 /nfs/dbraw/zinc/23/30/46/534233046.db2.gz OZBYBPCKQMRJAI-NWDGAFQWSA-N 1 1 237.774 3.613 20 0 BHADMO C[C@H]1CC[N@@H+](CCc2ccccc2Cl)[C@H]1C ZINC000482892430 225231708 /nfs/dbraw/zinc/23/17/08/225231708.db2.gz OZBYBPCKQMRJAI-RYUDHWBXSA-N 1 1 237.774 3.613 20 0 BHADMO C[C@@H]1CC[N@@H+](CCc2ccccc2Cl)[C@@H]1C ZINC000482892431 534033171 /nfs/dbraw/zinc/03/31/71/534033171.db2.gz OZBYBPCKQMRJAI-VXGBXAGGSA-N 1 1 237.774 3.613 20 0 BHADMO Cc1cccc([C@H](C)[N@H+]2CC[C@H](C)[C@@H]2C)c1 ZINC000482895670 225232081 /nfs/dbraw/zinc/23/20/81/225232081.db2.gz ULFVORHSRPTDDN-IHRRRGAJSA-N 1 1 217.356 3.786 20 0 BHADMO Cc1cccc([C@H](C)[N@H+]2CC[C@@H](C)[C@H]2C)c1 ZINC000482895671 225232415 /nfs/dbraw/zinc/23/24/15/225232415.db2.gz ULFVORHSRPTDDN-MCIONIFRSA-N 1 1 217.356 3.786 20 0 BHADMO Cc1cccc([C@H](C)[N@H+]2CC[C@H](C)[C@H]2C)c1 ZINC000482895672 225231442 /nfs/dbraw/zinc/23/14/42/225231442.db2.gz ULFVORHSRPTDDN-MJBXVCDLSA-N 1 1 217.356 3.786 20 0 BHADMO Cc1cccc([C@H](C)[N@H+]2CC[C@@H](C)[C@@H]2C)c1 ZINC000482895673 225231479 /nfs/dbraw/zinc/23/14/79/225231479.db2.gz ULFVORHSRPTDDN-RDBSUJKOSA-N 1 1 217.356 3.786 20 0 BHADMO C[N@@H+](CC(C)(C)C)[C@H]1CCc2ccc(F)cc21 ZINC000482935953 529844310 /nfs/dbraw/zinc/84/43/10/529844310.db2.gz IXSBEPUDTDLFRX-AWEZNQCLSA-N 1 1 235.346 3.791 20 0 BHADMO C[N@@H+](CC(C)(C)C)[C@@H]1CCc2ccc(F)cc21 ZINC000482935954 529844366 /nfs/dbraw/zinc/84/43/66/529844366.db2.gz IXSBEPUDTDLFRX-CQSZACIVSA-N 1 1 235.346 3.791 20 0 BHADMO Cc1cccc(C[N@H+]2CC[C@H]2c2ccccc2)c1 ZINC000482950127 534710378 /nfs/dbraw/zinc/71/03/78/534710378.db2.gz QJRUWZFBRFCOFN-KRWDZBQOSA-N 1 1 237.346 3.942 20 0 BHADMO Cc1cccc(C[N@H+]2CC[C@@H]2c2ccccc2)c1 ZINC000482950151 534711188 /nfs/dbraw/zinc/71/11/88/534711188.db2.gz QJRUWZFBRFCOFN-QGZVFWFLSA-N 1 1 237.346 3.942 20 0 BHADMO CCCCC[N@H+]1CC[C@H]1c1ccccc1 ZINC000482952162 528186371 /nfs/dbraw/zinc/18/63/71/528186371.db2.gz VLBJUPYWVYYYGA-AWEZNQCLSA-N 1 1 203.329 3.624 20 0 BHADMO CCCCC[N@H+]1CC[C@@H]1c1ccccc1 ZINC000482952176 528186936 /nfs/dbraw/zinc/18/69/36/528186936.db2.gz VLBJUPYWVYYYGA-CQSZACIVSA-N 1 1 203.329 3.624 20 0 BHADMO c1ccc([C@@H]2CC[N@@H+]2[C@@H]2C=CCCC2)cc1 ZINC000482954661 225233860 /nfs/dbraw/zinc/23/38/60/225233860.db2.gz TZXAUBPJRQTUIZ-CABCVRRESA-N 1 1 213.324 3.542 20 0 BHADMO c1ccc([C@@H]2CC[N@@H+]2[C@H]2C=CCCC2)cc1 ZINC000482954667 225233288 /nfs/dbraw/zinc/23/32/88/225233288.db2.gz TZXAUBPJRQTUIZ-GJZGRUSLSA-N 1 1 213.324 3.542 20 0 BHADMO c1ccc([C@H]2CC[N@@H+]2[C@@H]2C=CCCC2)cc1 ZINC000482954677 225233540 /nfs/dbraw/zinc/23/35/40/225233540.db2.gz TZXAUBPJRQTUIZ-HUUCEWRRSA-N 1 1 213.324 3.542 20 0 BHADMO c1ccc([C@H]2CC[N@@H+]2[C@H]2C=CCCC2)cc1 ZINC000482954678 225233190 /nfs/dbraw/zinc/23/31/90/225233190.db2.gz TZXAUBPJRQTUIZ-LSDHHAIUSA-N 1 1 213.324 3.542 20 0 BHADMO CCC(C)(C)CC[N@H+]1CCC[C@](C)(OC)CC1 ZINC000483038186 528503150 /nfs/dbraw/zinc/50/31/50/528503150.db2.gz UATGJHAJDZIWPZ-HNNXBMFYSA-N 1 1 241.419 3.704 20 0 BHADMO CCC(C)(C)CC[N@H+]1CCC[C@@](C)(OC)CC1 ZINC000483038187 528502940 /nfs/dbraw/zinc/50/29/40/528502940.db2.gz UATGJHAJDZIWPZ-OAHLLOKOSA-N 1 1 241.419 3.704 20 0 BHADMO Cc1cc(C)cc(OCCC[N@H+](C)C2CCC2)c1 ZINC000483054964 225233511 /nfs/dbraw/zinc/23/35/11/225233511.db2.gz AUXKVRKMEUUSPC-UHFFFAOYSA-N 1 1 247.382 3.557 20 0 BHADMO Cc1ccc(C)c(OCCC[N@H+](C)C2CCC2)c1 ZINC000483058224 225233260 /nfs/dbraw/zinc/23/32/60/225233260.db2.gz JCEIFYUCGUDWNQ-UHFFFAOYSA-N 1 1 247.382 3.557 20 0 BHADMO CC1(C)CC[N@H+]([C@H]2CCc3ccc(F)cc32)C1 ZINC000483060576 529013056 /nfs/dbraw/zinc/01/30/56/529013056.db2.gz OLFKCKZDXJIWJJ-AWEZNQCLSA-N 1 1 233.330 3.545 20 0 BHADMO CC1(C)CC[N@H+]([C@@H]2CCc3ccc(F)cc32)C1 ZINC000483060578 529013160 /nfs/dbraw/zinc/01/31/60/529013160.db2.gz OLFKCKZDXJIWJJ-CQSZACIVSA-N 1 1 233.330 3.545 20 0 BHADMO CCCCC[N@H+]1C[C@H](C)[C@@H]1c1ccccc1 ZINC000483078184 528186386 /nfs/dbraw/zinc/18/63/86/528186386.db2.gz WRYDLSWPCFVNEH-DZGCQCFKSA-N 1 1 217.356 3.870 20 0 BHADMO CCCCC[N@H+]1C[C@@H](C)[C@H]1c1ccccc1 ZINC000483078185 528186064 /nfs/dbraw/zinc/18/60/64/528186064.db2.gz WRYDLSWPCFVNEH-HIFRSBDPSA-N 1 1 217.356 3.870 20 0 BHADMO CCCCC[N@H+]1C[C@@H](C)[C@@H]1c1ccccc1 ZINC000483078186 528186881 /nfs/dbraw/zinc/18/68/81/528186881.db2.gz WRYDLSWPCFVNEH-UKRRQHHQSA-N 1 1 217.356 3.870 20 0 BHADMO CCCCC[N@H+]1C[C@H](C)[C@H]1c1ccccc1 ZINC000483078187 528186411 /nfs/dbraw/zinc/18/64/11/528186411.db2.gz WRYDLSWPCFVNEH-ZFWWWQNUSA-N 1 1 217.356 3.870 20 0 BHADMO C[C@@H]1C[N@H+]([C@@H]2C=CCCC2)[C@@H]1c1ccccc1 ZINC000483079258 225233757 /nfs/dbraw/zinc/23/37/57/225233757.db2.gz QUEOUCIVZKEPCI-BMFZPTHFSA-N 1 1 227.351 3.788 20 0 BHADMO C[C@@H]1C[N@H+]([C@@H]2C=CCCC2)[C@H]1c1ccccc1 ZINC000483079259 225232844 /nfs/dbraw/zinc/23/28/44/225232844.db2.gz QUEOUCIVZKEPCI-FVQBIDKESA-N 1 1 227.351 3.788 20 0 BHADMO C[C@@H]1C[N@H+]([C@H]2C=CCCC2)[C@@H]1c1ccccc1 ZINC000483079260 534477981 /nfs/dbraw/zinc/47/79/81/534477981.db2.gz QUEOUCIVZKEPCI-KBMXLJTQSA-N 1 1 227.351 3.788 20 0 BHADMO C[C@@H]1C[N@H+]([C@H]2C=CCCC2)[C@H]1c1ccccc1 ZINC000483079261 534479214 /nfs/dbraw/zinc/47/92/14/534479214.db2.gz QUEOUCIVZKEPCI-VNQPRFMTSA-N 1 1 227.351 3.788 20 0 BHADMO C[N@@H+]([C@@H]1CCC(C)(C)C1)[C@@H]1C=CCCC1 ZINC000483099133 530033069 /nfs/dbraw/zinc/03/30/69/530033069.db2.gz DDVCNVRFIWXEGG-CHWSQXEVSA-N 1 1 207.361 3.606 20 0 BHADMO C[N@@H+]([C@H]1CCC(C)(C)C1)[C@@H]1C=CCCC1 ZINC000483099134 530034152 /nfs/dbraw/zinc/03/41/52/530034152.db2.gz DDVCNVRFIWXEGG-OLZOCXBDSA-N 1 1 207.361 3.606 20 0 BHADMO C[N@@H+]([C@@H]1CCC(C)(C)C1)[C@H]1C=CCCC1 ZINC000483099136 530033145 /nfs/dbraw/zinc/03/31/45/530033145.db2.gz DDVCNVRFIWXEGG-QWHCGFSZSA-N 1 1 207.361 3.606 20 0 BHADMO C[N@@H+]([C@H]1CCC(C)(C)C1)[C@H]1C=CCCC1 ZINC000483099138 530034067 /nfs/dbraw/zinc/03/40/67/530034067.db2.gz DDVCNVRFIWXEGG-STQMWFEESA-N 1 1 207.361 3.606 20 0 BHADMO CC[N@@H+](CC1CCC1)[C@H](C)c1cccc(OC)c1 ZINC000483114631 528346870 /nfs/dbraw/zinc/34/68/70/528346870.db2.gz DLOBVWRMXHFTQC-CYBMUJFWSA-N 1 1 247.382 3.878 20 0 BHADMO CC[N@@H+](CC1CCC1)[C@@H](C)c1cccc(OC)c1 ZINC000483114633 528347659 /nfs/dbraw/zinc/34/76/59/528347659.db2.gz DLOBVWRMXHFTQC-ZDUSSCGKSA-N 1 1 247.382 3.878 20 0 BHADMO Fc1ccc([C@@H]2CC[N@H+]([C@@H]3C=CCCC3)C2)cc1 ZINC000483122889 534491384 /nfs/dbraw/zinc/49/13/84/534491384.db2.gz OLQZCLGLVQGWNA-GDBMZVCRSA-N 1 1 245.341 3.724 20 0 BHADMO Fc1ccc([C@H]2CC[N@H+]([C@@H]3C=CCCC3)C2)cc1 ZINC000483122891 225234504 /nfs/dbraw/zinc/23/45/04/225234504.db2.gz OLQZCLGLVQGWNA-GOEBONIOSA-N 1 1 245.341 3.724 20 0 BHADMO Fc1ccc([C@H]2CC[N@H+]([C@H]3C=CCCC3)C2)cc1 ZINC000483122893 225235272 /nfs/dbraw/zinc/23/52/72/225235272.db2.gz OLQZCLGLVQGWNA-HOCLYGCPSA-N 1 1 245.341 3.724 20 0 BHADMO Fc1ccc([C@@H]2CC[N@H+]([C@H]3C=CCCC3)C2)cc1 ZINC000483122895 534489924 /nfs/dbraw/zinc/48/99/24/534489924.db2.gz OLQZCLGLVQGWNA-ZBFHGGJFSA-N 1 1 245.341 3.724 20 0 BHADMO CC[N@@H+](CCCc1ccsc1)CC1CCC1 ZINC000483127775 528475785 /nfs/dbraw/zinc/47/57/85/528475785.db2.gz GFIODSDQBDPXKJ-UHFFFAOYSA-N 1 1 237.412 3.803 20 0 BHADMO CC[N@@H+](CCCCC(F)(F)F)CC1CCC1 ZINC000483129776 528432841 /nfs/dbraw/zinc/43/28/41/528432841.db2.gz MCVWJHOBRKFIGL-UHFFFAOYSA-N 1 1 237.309 3.841 20 0 BHADMO CCCC[N@@H+](C)Cc1ccc(OCC2CC2)cc1 ZINC000483140468 528360262 /nfs/dbraw/zinc/36/02/62/528360262.db2.gz DQKGQOSAKHVWSF-UHFFFAOYSA-N 1 1 247.382 3.707 20 0 BHADMO COC1(C[N@@H+](C)C2CCCCCC2)CCCC1 ZINC000483142031 532990094 /nfs/dbraw/zinc/99/00/94/532990094.db2.gz KWTDLGCUFPWZAT-UHFFFAOYSA-N 1 1 239.403 3.600 20 0 BHADMO C[N@@H+](Cc1ccsc1Cl)C1CCCC1 ZINC000483142906 530013971 /nfs/dbraw/zinc/01/39/71/530013971.db2.gz JSHCDHBOSZTTTF-UHFFFAOYSA-N 1 1 229.776 3.776 20 0 BHADMO CC[N@@H+](Cc1ccc(OCC2CC2)cc1)C(C)C ZINC000483146647 528796127 /nfs/dbraw/zinc/79/61/27/528796127.db2.gz XXHHIIBBDDIPEF-UHFFFAOYSA-N 1 1 247.382 3.706 20 0 BHADMO COC1(C[N@@H+](C)C2CCCCC2)CCCCC1 ZINC000483154472 532989347 /nfs/dbraw/zinc/98/93/47/532989347.db2.gz VKDBPMNYQWEHQX-UHFFFAOYSA-N 1 1 239.403 3.600 20 0 BHADMO CC(C)[C@@H](C)[N@@H+](C)Cc1ccsc1Cl ZINC000483154778 528406494 /nfs/dbraw/zinc/40/64/94/528406494.db2.gz NMQCKUJPKZGXAW-SECBINFHSA-N 1 1 231.792 3.878 20 0 BHADMO CC(C)[C@H](C)[N@@H+](C)Cc1ccsc1Cl ZINC000483154779 528959450 /nfs/dbraw/zinc/95/94/50/528959450.db2.gz NMQCKUJPKZGXAW-VIFPVBQESA-N 1 1 231.792 3.878 20 0 BHADMO C[C@H](C1CC1)[N@@H+](C)CCC1CCCCC1 ZINC000483155031 225235386 /nfs/dbraw/zinc/23/53/86/225235386.db2.gz GSXVTBBWJKBYSU-GFCCVEGCSA-N 1 1 209.377 3.687 20 0 BHADMO C[C@@H](C1CC1)[N@@H+](C)CCC1CCCCC1 ZINC000483155043 225234746 /nfs/dbraw/zinc/23/47/46/225234746.db2.gz GSXVTBBWJKBYSU-LBPRGKRZSA-N 1 1 209.377 3.687 20 0 BHADMO CC(C)C[N@@H+](C)Cc1ccc(OCC2CC2)cc1 ZINC000483169002 527914075 /nfs/dbraw/zinc/91/40/75/527914075.db2.gz OQNZHXOISTYHQS-UHFFFAOYSA-N 1 1 247.382 3.563 20 0 BHADMO CCC[N@@H+](CC)Cc1ccc(OCC2CC2)cc1 ZINC000483170799 528004542 /nfs/dbraw/zinc/00/45/42/528004542.db2.gz AJCBFRYADAPUHT-UHFFFAOYSA-N 1 1 247.382 3.707 20 0 BHADMO CC[C@@H](C)[N@@H+](C)Cc1ccc(OCC2CC2)cc1 ZINC000483174461 529344593 /nfs/dbraw/zinc/34/45/93/529344593.db2.gz FOMKYMDOEYQPKG-CYBMUJFWSA-N 1 1 247.382 3.706 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1ccc(OCC2CC2)cc1 ZINC000483174463 529690961 /nfs/dbraw/zinc/69/09/61/529690961.db2.gz FOMKYMDOEYQPKG-ZDUSSCGKSA-N 1 1 247.382 3.706 20 0 BHADMO CC[N@H+](Cc1ccsc1Cl)CC(C)C ZINC000483179998 528863033 /nfs/dbraw/zinc/86/30/33/528863033.db2.gz PPCUGZWDNFHPBS-UHFFFAOYSA-N 1 1 231.792 3.879 20 0 BHADMO Cc1ccc([C@@H]2CCCC[N@H+]2CCCF)cc1 ZINC000483191203 225236161 /nfs/dbraw/zinc/23/61/61/225236161.db2.gz BEEQFSPMLOXVFW-HNNXBMFYSA-N 1 1 235.346 3.882 20 0 BHADMO Cc1ccc([C@H]2CCCC[N@H+]2CCCF)cc1 ZINC000483191204 225236260 /nfs/dbraw/zinc/23/62/60/225236260.db2.gz BEEQFSPMLOXVFW-OAHLLOKOSA-N 1 1 235.346 3.882 20 0 BHADMO Cc1ccc([C@H]2CCC[C@@H]2[N@@H+](C)CCCF)cc1 ZINC000483195027 225236177 /nfs/dbraw/zinc/23/61/77/225236177.db2.gz AUHWQCQEDJFHQD-CVEARBPZSA-N 1 1 249.373 3.923 20 0 BHADMO Cc1ccc([C@@H]2CCC[C@@H]2[N@@H+](C)CCCF)cc1 ZINC000483195028 225235976 /nfs/dbraw/zinc/23/59/76/225235976.db2.gz AUHWQCQEDJFHQD-HOTGVXAUSA-N 1 1 249.373 3.923 20 0 BHADMO Cc1ccc([C@H]2CCC[C@H]2[N@@H+](C)CCCF)cc1 ZINC000483195029 225236546 /nfs/dbraw/zinc/23/65/46/225236546.db2.gz AUHWQCQEDJFHQD-HZPDHXFCSA-N 1 1 249.373 3.923 20 0 BHADMO Cc1ccc([C@@H]2CCC[C@H]2[N@@H+](C)CCCF)cc1 ZINC000483195030 225236730 /nfs/dbraw/zinc/23/67/30/225236730.db2.gz AUHWQCQEDJFHQD-JKSUJKDBSA-N 1 1 249.373 3.923 20 0 BHADMO Cc1ccccc1[C@H](C)[N@@H+]1C[C@@H]2[C@H](C1)C2(C)C ZINC000483197834 225235756 /nfs/dbraw/zinc/23/57/56/225235756.db2.gz QAHMCTSEIWHQMY-AEGPPILISA-N 1 1 229.367 3.644 20 0 BHADMO Cc1ccccc1[C@@H](C)[N@@H+]1C[C@@H]2[C@H](C1)C2(C)C ZINC000483197840 225236683 /nfs/dbraw/zinc/23/66/83/225236683.db2.gz QAHMCTSEIWHQMY-YUELXQCFSA-N 1 1 229.367 3.644 20 0 BHADMO Cc1ccccc1[C@@H](C)[N@H+]1C[C@H](C)[C@H](C)C1 ZINC000483198115 225236675 /nfs/dbraw/zinc/23/66/75/225236675.db2.gz HJUKMUWBIRZBKC-HZSPNIEDSA-N 1 1 217.356 3.644 20 0 BHADMO Cc1ccccc1[C@H](C)[N@H+]1C[C@H](C)[C@H](C)C1 ZINC000483198120 225235730 /nfs/dbraw/zinc/23/57/30/225235730.db2.gz HJUKMUWBIRZBKC-MJBXVCDLSA-N 1 1 217.356 3.644 20 0 BHADMO C(CC1CCCC1)C[N@H+]1CCC12CCC2 ZINC000483201067 527476324 /nfs/dbraw/zinc/47/63/24/527476324.db2.gz RDGUXEVUCGWXHM-UHFFFAOYSA-N 1 1 207.361 3.585 20 0 BHADMO CC(C)OCCC[N@@H+](C)CCCC1CCCC1 ZINC000483204107 527936560 /nfs/dbraw/zinc/93/65/60/527936560.db2.gz SNPJCZAKWKSMDR-UHFFFAOYSA-N 1 1 241.419 3.704 20 0 BHADMO Cc1ccccc1[C@@H](C)[N@H+]1CCSC(C)(C)C1 ZINC000483205160 225236493 /nfs/dbraw/zinc/23/64/93/225236493.db2.gz VJQXKGPFBUFVPH-CYBMUJFWSA-N 1 1 249.423 3.883 20 0 BHADMO Cc1ccccc1[C@H](C)[N@H+]1CCSC(C)(C)C1 ZINC000483205161 225236429 /nfs/dbraw/zinc/23/64/29/225236429.db2.gz VJQXKGPFBUFVPH-ZDUSSCGKSA-N 1 1 249.423 3.883 20 0 BHADMO FCCC[N@H+]1CCCC[C@H]1c1ccc(F)cc1 ZINC000483206755 534431675 /nfs/dbraw/zinc/43/16/75/534431675.db2.gz DDGVBYBDSWOILZ-AWEZNQCLSA-N 1 1 239.309 3.712 20 0 BHADMO FCCC[N@H+]1CCCC[C@@H]1c1ccc(F)cc1 ZINC000483206757 534432041 /nfs/dbraw/zinc/43/20/41/534432041.db2.gz DDGVBYBDSWOILZ-CQSZACIVSA-N 1 1 239.309 3.712 20 0 BHADMO COc1ccccc1C[C@H](C)[N@@H+](C)CCC(C)C ZINC000483213227 534115132 /nfs/dbraw/zinc/11/51/32/534115132.db2.gz ABZYKPYEKCGAEO-AWEZNQCLSA-N 1 1 249.398 3.604 20 0 BHADMO COc1ccccc1C[C@@H](C)[N@@H+](C)CCC(C)C ZINC000483213228 534104324 /nfs/dbraw/zinc/10/43/24/534104324.db2.gz ABZYKPYEKCGAEO-CQSZACIVSA-N 1 1 249.398 3.604 20 0 BHADMO CC(C)C[C@H]1CCCCC[N@H+]1CCCF ZINC000483217410 528583588 /nfs/dbraw/zinc/58/35/88/528583588.db2.gz XUNOZPJEKPEREG-CYBMUJFWSA-N 1 1 215.356 3.637 20 0 BHADMO CC(C)C[C@@H]1CCCCC[N@H+]1CCCF ZINC000483217411 528372246 /nfs/dbraw/zinc/37/22/46/528372246.db2.gz XUNOZPJEKPEREG-ZDUSSCGKSA-N 1 1 215.356 3.637 20 0 BHADMO FCCC[N@H+]1CCCC2(C1)CCCCCC2 ZINC000483218576 534430020 /nfs/dbraw/zinc/43/00/20/534430020.db2.gz PTMQAFJAZZTLOV-UHFFFAOYSA-N 1 1 227.367 3.782 20 0 BHADMO Cc1ccccc1[C@@H](C)[N@H+]1CCC(C)(C)C1 ZINC000483219620 225236595 /nfs/dbraw/zinc/23/65/95/225236595.db2.gz LRTKDMPHNXWTAO-CYBMUJFWSA-N 1 1 217.356 3.788 20 0 BHADMO Cc1ccccc1[C@H](C)[N@H+]1CCC(C)(C)C1 ZINC000483219621 225235961 /nfs/dbraw/zinc/23/59/61/225235961.db2.gz LRTKDMPHNXWTAO-ZDUSSCGKSA-N 1 1 217.356 3.788 20 0 BHADMO CC[C@@H]1C[N@@H+](CCCF)CC[C@H]1c1ccccc1 ZINC000483220801 529390172 /nfs/dbraw/zinc/39/01/72/529390172.db2.gz PNBQITZGFDQKHS-GDBMZVCRSA-N 1 1 249.373 3.862 20 0 BHADMO CC[C@H]1C[N@@H+](CCCF)CC[C@H]1c1ccccc1 ZINC000483220803 529291020 /nfs/dbraw/zinc/29/10/20/529291020.db2.gz PNBQITZGFDQKHS-GOEBONIOSA-N 1 1 249.373 3.862 20 0 BHADMO CC[C@H]1C[N@@H+](CCCF)CC[C@@H]1c1ccccc1 ZINC000483220805 529291190 /nfs/dbraw/zinc/29/11/90/529291190.db2.gz PNBQITZGFDQKHS-HOCLYGCPSA-N 1 1 249.373 3.862 20 0 BHADMO CC[C@@H]1C[N@@H+](CCCF)CC[C@@H]1c1ccccc1 ZINC000483220807 529390251 /nfs/dbraw/zinc/39/02/51/529390251.db2.gz PNBQITZGFDQKHS-ZBFHGGJFSA-N 1 1 249.373 3.862 20 0 BHADMO C[C@]1(CCc2ccccc2)CC[N@@H+](CCCF)C1 ZINC000483222117 225235912 /nfs/dbraw/zinc/23/59/12/225235912.db2.gz SYWYNWUWFMBSQD-INIZCTEOSA-N 1 1 249.373 3.691 20 0 BHADMO C[C@@]1(CCc2ccccc2)CC[N@@H+](CCCF)C1 ZINC000483222119 225235926 /nfs/dbraw/zinc/23/59/26/225235926.db2.gz SYWYNWUWFMBSQD-MRXNPFEDSA-N 1 1 249.373 3.691 20 0 BHADMO CC(C)(C)[C@H]1CCC[N@@H+](CCC(F)(F)F)C1 ZINC000483229802 526721028 /nfs/dbraw/zinc/72/10/28/526721028.db2.gz DUYWUKAMHOVEEL-JTQLQIEISA-N 1 1 237.309 3.697 20 0 BHADMO CC(C)(C)[C@@H]1CCC[N@@H+](CCC(F)(F)F)C1 ZINC000483229803 526652930 /nfs/dbraw/zinc/65/29/30/526652930.db2.gz DUYWUKAMHOVEEL-SNVBAGLBSA-N 1 1 237.309 3.697 20 0 BHADMO Cc1ccccc1[C@@H](C)[N@H+]1C[C@@H]2CCC[C@@H]2C1 ZINC000483233044 225238422 /nfs/dbraw/zinc/23/84/22/225238422.db2.gz PUSLCLRYEPLMKE-KFWWJZLASA-N 1 1 229.367 3.788 20 0 BHADMO Cc1ccccc1[C@H](C)[N@H+]1C[C@@H]2CCC[C@@H]2C1 ZINC000483233047 225237998 /nfs/dbraw/zinc/23/79/98/225237998.db2.gz PUSLCLRYEPLMKE-SOUVJXGZSA-N 1 1 229.367 3.788 20 0 BHADMO CC(C)OCCC[N@H+]1CCC[C@H](C(C)(C)C)C1 ZINC000483234135 527937081 /nfs/dbraw/zinc/93/70/81/527937081.db2.gz JFCAJKPYVLXNBE-AWEZNQCLSA-N 1 1 241.419 3.560 20 0 BHADMO CC(C)OCCC[N@H+]1CCC[C@@H](C(C)(C)C)C1 ZINC000483234137 527937604 /nfs/dbraw/zinc/93/76/04/527937604.db2.gz JFCAJKPYVLXNBE-CQSZACIVSA-N 1 1 241.419 3.560 20 0 BHADMO Cc1ccccc1[C@H](C)[N@H+]1CC[C@@H](C)[C@H]1C ZINC000483234959 225237568 /nfs/dbraw/zinc/23/75/68/225237568.db2.gz WFFLFWKXHUGGDW-BNOWGMLFSA-N 1 1 217.356 3.786 20 0 BHADMO Cc1ccccc1[C@H](C)[N@H+]1CC[C@H](C)[C@@H]1C ZINC000483234961 225238053 /nfs/dbraw/zinc/23/80/53/225238053.db2.gz WFFLFWKXHUGGDW-UBHSHLNASA-N 1 1 217.356 3.786 20 0 BHADMO Cc1ccccc1[C@H](C)[N@H+]1CC[C@@H](C)[C@@H]1C ZINC000483234962 225238430 /nfs/dbraw/zinc/23/84/30/225238430.db2.gz WFFLFWKXHUGGDW-XBFCOCLRSA-N 1 1 217.356 3.786 20 0 BHADMO Cc1ccccc1[C@H](C)[N@H+]1CC[C@H](C)[C@H]1C ZINC000483234963 225237961 /nfs/dbraw/zinc/23/79/61/225237961.db2.gz WFFLFWKXHUGGDW-YUTCNCBUSA-N 1 1 217.356 3.786 20 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COC(C)(C)CC[N@H+]1CCC[C@@H](C(C)(C)C)C1 ZINC000483245170 532950020 /nfs/dbraw/zinc/95/00/20/532950020.db2.gz HIZWDFSMELMFON-CYBMUJFWSA-N 1 1 241.419 3.560 20 0 BHADMO COC(C)(C)CC[N@H+]1CCC[C@H](C(C)(C)C)C1 ZINC000483245171 532949825 /nfs/dbraw/zinc/94/98/25/532949825.db2.gz HIZWDFSMELMFON-ZDUSSCGKSA-N 1 1 241.419 3.560 20 0 BHADMO Cc1ccccc1[C@H](C)[N@H+]1CCC2(CCC2)C1 ZINC000483245299 225238308 /nfs/dbraw/zinc/23/83/08/225238308.db2.gz PZSMRYMOPQNBCT-AWEZNQCLSA-N 1 1 229.367 3.932 20 0 BHADMO Cc1ccccc1[C@@H](C)[N@H+]1CCC2(CCC2)C1 ZINC000483245301 225237816 /nfs/dbraw/zinc/23/78/16/225237816.db2.gz PZSMRYMOPQNBCT-CQSZACIVSA-N 1 1 229.367 3.932 20 0 BHADMO C[C@@H](c1ccccn1)[N@H+]1CCC[C@H](C(C)(C)C)C1 ZINC000483246272 225237203 /nfs/dbraw/zinc/23/72/03/225237203.db2.gz ZWHNAQFLFXFGNI-KBPBESRZSA-N 1 1 246.398 3.901 20 0 BHADMO C[C@H](c1ccccn1)[N@H+]1CCC[C@H](C(C)(C)C)C1 ZINC000483246275 534142261 /nfs/dbraw/zinc/14/22/61/534142261.db2.gz ZWHNAQFLFXFGNI-KGLIPLIRSA-N 1 1 246.398 3.901 20 0 BHADMO C[C@@H](c1ccccn1)[N@H+]1CCC[C@@H](C(C)(C)C)C1 ZINC000483246277 225237615 /nfs/dbraw/zinc/23/76/15/225237615.db2.gz ZWHNAQFLFXFGNI-UONOGXRCSA-N 1 1 246.398 3.901 20 0 BHADMO C[C@H](c1ccccn1)[N@H+]1CCC[C@@H](C(C)(C)C)C1 ZINC000483246280 534142313 /nfs/dbraw/zinc/14/23/13/534142313.db2.gz ZWHNAQFLFXFGNI-ZIAGYGMSSA-N 1 1 246.398 3.901 20 0 BHADMO C[C@@H](c1cccnc1)[N@H+]1CCC[C@@H](C(C)(C)C)C1 ZINC000483247106 225237555 /nfs/dbraw/zinc/23/75/55/225237555.db2.gz VZMAHNQUWZVDSJ-DZGCQCFKSA-N 1 1 246.398 3.901 20 0 BHADMO C[C@H](c1cccnc1)[N@H+]1CCC[C@H](C(C)(C)C)C1 ZINC000483247107 225238185 /nfs/dbraw/zinc/23/81/85/225238185.db2.gz VZMAHNQUWZVDSJ-HIFRSBDPSA-N 1 1 246.398 3.901 20 0 BHADMO C[C@H](c1cccnc1)[N@H+]1CCC[C@@H](C(C)(C)C)C1 ZINC000483247109 225237864 /nfs/dbraw/zinc/23/78/64/225237864.db2.gz VZMAHNQUWZVDSJ-UKRRQHHQSA-N 1 1 246.398 3.901 20 0 BHADMO C[C@@H](c1cccnc1)[N@H+]1CCC[C@H](C(C)(C)C)C1 ZINC000483247111 225237941 /nfs/dbraw/zinc/23/79/41/225237941.db2.gz VZMAHNQUWZVDSJ-ZFWWWQNUSA-N 1 1 246.398 3.901 20 0 BHADMO CC[C@H]1C[N@H+]([C@@H](C)c2ccccc2C)CCS1 ZINC000483247854 529300707 /nfs/dbraw/zinc/30/07/07/529300707.db2.gz YVFWTLFCWHCYST-KBPBESRZSA-N 1 1 249.423 3.883 20 0 BHADMO CC[C@H]1C[N@H+]([C@H](C)c2ccccc2C)CCS1 ZINC000483247855 529301059 /nfs/dbraw/zinc/30/10/59/529301059.db2.gz YVFWTLFCWHCYST-KGLIPLIRSA-N 1 1 249.423 3.883 20 0 BHADMO CC[C@@H]1C[N@H+]([C@@H](C)c2ccccc2C)CCS1 ZINC000483247856 529401160 /nfs/dbraw/zinc/40/11/60/529401160.db2.gz YVFWTLFCWHCYST-UONOGXRCSA-N 1 1 249.423 3.883 20 0 BHADMO CC[C@@H]1C[N@H+]([C@H](C)c2ccccc2C)CCS1 ZINC000483247857 529401543 /nfs/dbraw/zinc/40/15/43/529401543.db2.gz YVFWTLFCWHCYST-ZIAGYGMSSA-N 1 1 249.423 3.883 20 0 BHADMO Clc1sccc1C[N@H+]1C[C@@H]2CCC[C@@H]2C1 ZINC000483259092 225238439 /nfs/dbraw/zinc/23/84/39/225238439.db2.gz VXIMARZTWLITFR-AOOOYVTPSA-N 1 1 241.787 3.633 20 0 BHADMO CC(C)[C@H]1CC[N@@H+](Cc2ccsc2Cl)C1 ZINC000483262357 527800095 /nfs/dbraw/zinc/80/00/95/527800095.db2.gz QJXUVZJGLFKJQB-JTQLQIEISA-N 1 1 243.803 3.879 20 0 BHADMO CC(C)[C@@H]1CC[N@@H+](Cc2ccsc2Cl)C1 ZINC000483262358 528699632 /nfs/dbraw/zinc/69/96/32/528699632.db2.gz QJXUVZJGLFKJQB-SNVBAGLBSA-N 1 1 243.803 3.879 20 0 BHADMO C[N@@H+](CCCC1CCCC1)CCC(F)(F)F ZINC000483263263 529880644 /nfs/dbraw/zinc/88/06/44/529880644.db2.gz NDWFKLQRBQIJPN-UHFFFAOYSA-N 1 1 237.309 3.841 20 0 BHADMO CC[C@@H](C)C[N@@H+](C)Cc1ccsc1Cl ZINC000483265551 529314421 /nfs/dbraw/zinc/31/44/21/529314421.db2.gz IDAOFTIKICQLDC-SECBINFHSA-N 1 1 231.792 3.879 20 0 BHADMO CC[C@H](C)C[N@@H+](C)Cc1ccsc1Cl ZINC000483265562 529650769 /nfs/dbraw/zinc/65/07/69/529650769.db2.gz IDAOFTIKICQLDC-VIFPVBQESA-N 1 1 231.792 3.879 20 0 BHADMO C1=C[C@H]([N@@H+](CC2CC2)CC2CCC2)CCC1 ZINC000483267673 526420203 /nfs/dbraw/zinc/42/02/03/526420203.db2.gz YOXHWOPFKJJZHD-HNNXBMFYSA-N 1 1 219.372 3.607 20 0 BHADMO C1=C[C@@H]([N@@H+](CC2CC2)CC2CCC2)CCC1 ZINC000483267684 526419105 /nfs/dbraw/zinc/41/91/05/526419105.db2.gz YOXHWOPFKJJZHD-OAHLLOKOSA-N 1 1 219.372 3.607 20 0 BHADMO CCCC[N@@H+](CCCF)Cc1ccccc1F ZINC000483269774 528408673 /nfs/dbraw/zinc/40/86/73/528408673.db2.gz NMSRGUXJEOREQV-UHFFFAOYSA-N 1 1 241.325 3.787 20 0 BHADMO C[N@@H+](Cc1ccsc1Cl)CC(C)(C)C ZINC000483278015 530013802 /nfs/dbraw/zinc/01/38/02/530013802.db2.gz BDPVVNHBIUZUFA-UHFFFAOYSA-N 1 1 231.792 3.879 20 0 BHADMO C[C@@H]1C[C@H](C)[N@@H+](Cc2ccsc2Cl)C1 ZINC000483285343 225238769 /nfs/dbraw/zinc/23/87/69/225238769.db2.gz XNRAEPIPHXYBQQ-BDAKNGLRSA-N 1 1 229.776 3.632 20 0 BHADMO C[C@@H]1C[C@H](C)C[N@@H+]1Cc1ccsc1Cl ZINC000483285344 533807876 /nfs/dbraw/zinc/80/78/76/533807876.db2.gz XNRAEPIPHXYBQQ-DTWKUNHWSA-N 1 1 229.776 3.632 20 0 BHADMO C[C@H]1C[C@H](C)[N@@H+](Cc2ccsc2Cl)C1 ZINC000483285345 225239563 /nfs/dbraw/zinc/23/95/63/225239563.db2.gz XNRAEPIPHXYBQQ-IUCAKERBSA-N 1 1 229.776 3.632 20 0 BHADMO C[C@@H]1C[C@@H](C)[N@@H+](Cc2ccsc2Cl)C1 ZINC000483285346 225238810 /nfs/dbraw/zinc/23/88/10/225238810.db2.gz XNRAEPIPHXYBQQ-RKDXNWHRSA-N 1 1 229.776 3.632 20 0 BHADMO Clc1sccc1C[N@H+]1CC[C@H](C2CC2)C1 ZINC000483288167 225239303 /nfs/dbraw/zinc/23/93/03/225239303.db2.gz WKNKAQSREIQHMU-JTQLQIEISA-N 1 1 241.787 3.633 20 0 BHADMO Clc1sccc1C[N@H+]1CC[C@@H](C2CC2)C1 ZINC000483288168 225239605 /nfs/dbraw/zinc/23/96/05/225239605.db2.gz WKNKAQSREIQHMU-SNVBAGLBSA-N 1 1 241.787 3.633 20 0 BHADMO CC[C@@H]1CC[N@@H+](Cc2ccsc2Cl)C1 ZINC000483300634 529327135 /nfs/dbraw/zinc/32/71/35/529327135.db2.gz YCZUXKHAJPNIOU-SECBINFHSA-N 1 1 229.776 3.633 20 0 BHADMO CC[C@H]1CC[N@@H+](Cc2ccsc2Cl)C1 ZINC000483300636 529239280 /nfs/dbraw/zinc/23/92/80/529239280.db2.gz YCZUXKHAJPNIOU-VIFPVBQESA-N 1 1 229.776 3.633 20 0 BHADMO Cc1ccc(C)c([C@@H]2CCC[N@H+]2CCCF)c1 ZINC000483303501 225239295 /nfs/dbraw/zinc/23/92/95/225239295.db2.gz MWJWIJQMWWKOHA-HNNXBMFYSA-N 1 1 235.346 3.800 20 0 BHADMO Cc1ccc(C)c([C@H]2CCC[N@H+]2CCCF)c1 ZINC000483303502 533713466 /nfs/dbraw/zinc/71/34/66/533713466.db2.gz MWJWIJQMWWKOHA-OAHLLOKOSA-N 1 1 235.346 3.800 20 0 BHADMO CCCCC[N@H+]1Cc2ccc(C)cc2C1 ZINC000483306259 528186703 /nfs/dbraw/zinc/18/67/03/528186703.db2.gz DNYCLBDQJROTSB-UHFFFAOYSA-N 1 1 203.329 3.501 20 0 BHADMO CC/C=C\CC[N@@H+](CC1CC1)C1CCC1 ZINC000483308346 528789104 /nfs/dbraw/zinc/78/91/04/528789104.db2.gz PHYYLBMTFQVPAU-ARJAWSKDSA-N 1 1 207.361 3.607 20 0 BHADMO CC/C=C/CC[N@@H+](CC1CC1)C1CCC1 ZINC000483308347 528770209 /nfs/dbraw/zinc/77/02/09/528770209.db2.gz PHYYLBMTFQVPAU-ONEGZZNKSA-N 1 1 207.361 3.607 20 0 BHADMO Cc1ccc(CC[N@@H+](CC2CC2)C2CCC2)cc1 ZINC000483309752 533784352 /nfs/dbraw/zinc/78/43/52/533784352.db2.gz UVURQJDSOLNLQV-UHFFFAOYSA-N 1 1 243.394 3.802 20 0 BHADMO c1cc(CCC[N@@H+](CC2CC2)C2CCC2)cs1 ZINC000483310044 225239348 /nfs/dbraw/zinc/23/93/48/225239348.db2.gz UZAAUXYPWPURDS-UHFFFAOYSA-N 1 1 249.423 3.945 20 0 BHADMO FC(F)(F)CCCC[N@@H+](CC1CC1)C1CCC1 ZINC000483315342 534381197 /nfs/dbraw/zinc/38/11/97/534381197.db2.gz OEIKAPXGKJGGHP-UHFFFAOYSA-N 1 1 249.320 3.984 20 0 BHADMO c1ccc(CCC[N@@H+](CC2CC2)C2CCC2)cc1 ZINC000483316020 534485908 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/nfs/dbraw/zinc/76/77/66/533767766.db2.gz REHOYYYPFRNWPT-AWEZNQCLSA-N 1 1 245.366 3.798 20 0 BHADMO COc1cccc([C@@H](C)[N@H+]2CCC(C)=C(C)C2)c1 ZINC000483344357 533700557 /nfs/dbraw/zinc/70/05/57/533700557.db2.gz REHOYYYPFRNWPT-CQSZACIVSA-N 1 1 245.366 3.798 20 0 BHADMO CC1=C(C)C[N@@H+](CCCc2ccccc2)CC1 ZINC000483352976 528091157 /nfs/dbraw/zinc/09/11/57/528091157.db2.gz KAPQRSQJHSMKRV-UHFFFAOYSA-N 1 1 229.367 3.661 20 0 BHADMO CC1=C(C)C[N@@H+]([C@H](C)c2ccc(F)cc2)CC1 ZINC000483354541 528090953 /nfs/dbraw/zinc/09/09/53/528090953.db2.gz MJVLPXVFSPTLOC-CYBMUJFWSA-N 1 1 233.330 3.929 20 0 BHADMO CC1=C(C)C[N@@H+]([C@@H](C)c2ccc(F)cc2)CC1 ZINC000483354543 528091101 /nfs/dbraw/zinc/09/11/01/528091101.db2.gz MJVLPXVFSPTLOC-ZDUSSCGKSA-N 1 1 233.330 3.929 20 0 BHADMO Clc1sccc1C[N@H+]1CC[C@@H]2CCC[C@H]21 ZINC000483354764 225241369 /nfs/dbraw/zinc/24/13/69/225241369.db2.gz JHOAERABMCHMLO-GXSJLCMTSA-N 1 1 241.787 3.776 20 0 BHADMO Clc1sccc1C[N@H+]1CC[C@H]2CCC[C@@H]21 ZINC000483354768 225241166 /nfs/dbraw/zinc/24/11/66/225241166.db2.gz JHOAERABMCHMLO-KOLCDFICSA-N 1 1 241.787 3.776 20 0 BHADMO Clc1sccc1C[N@H+]1CC[C@H]2CCC[C@H]21 ZINC000483354771 225240266 /nfs/dbraw/zinc/24/02/66/225240266.db2.gz JHOAERABMCHMLO-MWLCHTKSSA-N 1 1 241.787 3.776 20 0 BHADMO Clc1sccc1C[N@H+]1CC[C@@H]2CCC[C@@H]21 ZINC000483354775 225241410 /nfs/dbraw/zinc/24/14/10/225241410.db2.gz JHOAERABMCHMLO-ONGXEEELSA-N 1 1 241.787 3.776 20 0 BHADMO CC1=C(C)C[N@@H+]([C@H](C)c2ccccc2F)CC1 ZINC000483365312 528091186 /nfs/dbraw/zinc/09/11/86/528091186.db2.gz KCCADAADSUISJW-CYBMUJFWSA-N 1 1 233.330 3.929 20 0 BHADMO CC1=C(C)C[N@@H+]([C@@H](C)c2ccccc2F)CC1 ZINC000483365313 528091092 /nfs/dbraw/zinc/09/10/92/528091092.db2.gz KCCADAADSUISJW-ZDUSSCGKSA-N 1 1 233.330 3.929 20 0 BHADMO CC1=C(C)C[N@@H+](CCCCC(F)(F)F)CC1 ZINC000483365605 528089800 /nfs/dbraw/zinc/08/98/00/528089800.db2.gz LDMJQCMEUHBOFC-UHFFFAOYSA-N 1 1 235.293 3.761 20 0 BHADMO Cc1ccccc1[C@H](C(C)C)[N@@H+](C)CCCF ZINC000483375799 225241305 /nfs/dbraw/zinc/24/13/05/225241305.db2.gz IUWJAPNMODZIND-HNNXBMFYSA-N 1 1 237.362 3.984 20 0 BHADMO Cc1ccccc1[C@@H](C(C)C)[N@@H+](C)CCCF ZINC000483375800 225240941 /nfs/dbraw/zinc/24/09/41/225240941.db2.gz IUWJAPNMODZIND-OAHLLOKOSA-N 1 1 237.362 3.984 20 0 BHADMO CC(C)(C)C[N@@H+](CCCF)Cc1ccccc1 ZINC000483377069 527682069 /nfs/dbraw/zinc/68/20/69/527682069.db2.gz XMCFGWUNPQKMKI-UHFFFAOYSA-N 1 1 237.362 3.894 20 0 BHADMO CC[C@@H]1C[N@H+]([C@@H](C)c2ccccc2C)C[C@@H](C)O1 ZINC000483379168 529400772 /nfs/dbraw/zinc/40/07/72/529400772.db2.gz MMBSBKNHKOJUGT-QLFBSQMISA-N 1 1 247.382 3.555 20 0 BHADMO CC[C@@H]1C[N@H+]([C@H](C)c2ccccc2C)C[C@@H](C)O1 ZINC000483379172 529401774 /nfs/dbraw/zinc/40/17/74/529401774.db2.gz MMBSBKNHKOJUGT-RBSFLKMASA-N 1 1 247.382 3.555 20 0 BHADMO CC[C@@H]1C[N@H+]([C@H](C)c2ccccc2C)C[C@H](C)O1 ZINC000483379175 529401925 /nfs/dbraw/zinc/40/19/25/529401925.db2.gz MMBSBKNHKOJUGT-RRFJBIMHSA-N 1 1 247.382 3.555 20 0 BHADMO CC[C@@H]1C[N@H+]([C@@H](C)c2ccccc2C)C[C@H](C)O1 ZINC000483379179 529401076 /nfs/dbraw/zinc/40/10/76/529401076.db2.gz MMBSBKNHKOJUGT-SOUVJXGZSA-N 1 1 247.382 3.555 20 0 BHADMO CC1=C(C)C[N@@H+](CCCCOC(C)(C)C)CC1 ZINC000483381845 528090225 /nfs/dbraw/zinc/09/02/25/528090225.db2.gz WGHOEIVRUVTJFM-UHFFFAOYSA-N 1 1 239.403 3.624 20 0 BHADMO FCCC[N@@H+](CCc1ccccc1)C1CCCC1 ZINC000483383005 534430601 /nfs/dbraw/zinc/43/06/01/534430601.db2.gz SESURVBUKKIKHK-UHFFFAOYSA-N 1 1 249.373 3.833 20 0 BHADMO CC1=C(C)C[N@H+]([C@H]2CCc3ccc(F)cc32)CC1 ZINC000483384872 528092106 /nfs/dbraw/zinc/09/21/06/528092106.db2.gz OLDYBWMBJFBCSM-INIZCTEOSA-N 1 1 245.341 3.855 20 0 BHADMO CC1=C(C)C[N@H+]([C@@H]2CCc3ccc(F)cc32)CC1 ZINC000483384873 528090905 /nfs/dbraw/zinc/09/09/05/528090905.db2.gz OLDYBWMBJFBCSM-MRXNPFEDSA-N 1 1 245.341 3.855 20 0 BHADMO CSc1ccccc1C[N@H+]1CCC(C)=C(C)C1 ZINC000483388167 533039717 /nfs/dbraw/zinc/03/97/17/533039717.db2.gz ZGTQFJOFKIMDKE-UHFFFAOYSA-N 1 1 247.407 3.951 20 0 BHADMO CC1=C(C)C[N@@H+](Cc2ncc(C(C)(C)C)o2)CC1 ZINC000483388203 528090407 /nfs/dbraw/zinc/09/04/07/528090407.db2.gz VJUJANOGYNQPGC-UHFFFAOYSA-N 1 1 248.370 3.514 20 0 BHADMO CC1=C(C)C[N@H+](Cc2ncc(C(C)(C)C)o2)CC1 ZINC000483388203 528090401 /nfs/dbraw/zinc/09/04/01/528090401.db2.gz VJUJANOGYNQPGC-UHFFFAOYSA-N 1 1 248.370 3.514 20 0 BHADMO Cc1ccc2ccccc2c1C[N@H+](C)C1CC1 ZINC000483399373 534485627 /nfs/dbraw/zinc/48/56/27/534485627.db2.gz AUUKOIZEKOLZQC-UHFFFAOYSA-N 1 1 225.335 3.742 20 0 BHADMO CCC[N@@H+](CCCF)[C@H]1CCc2ccccc2C1 ZINC000483399976 528063415 /nfs/dbraw/zinc/06/34/15/528063415.db2.gz BPNRDKCUFJZVMX-INIZCTEOSA-N 1 1 249.373 3.616 20 0 BHADMO CCC[N@@H+](CCCF)[C@@H]1CCc2ccccc2C1 ZINC000483399977 528064078 /nfs/dbraw/zinc/06/40/78/528064078.db2.gz BPNRDKCUFJZVMX-MRXNPFEDSA-N 1 1 249.373 3.616 20 0 BHADMO Cc1ccc([C@@H](C)[N@@H+](C)CCCF)c(C)c1 ZINC000483401261 225242352 /nfs/dbraw/zinc/24/23/52/225242352.db2.gz FBTDZYCOCRKTOZ-CYBMUJFWSA-N 1 1 223.335 3.656 20 0 BHADMO Cc1ccc([C@H](C)[N@@H+](C)CCCF)c(C)c1 ZINC000483401271 225243109 /nfs/dbraw/zinc/24/31/09/225243109.db2.gz FBTDZYCOCRKTOZ-ZDUSSCGKSA-N 1 1 223.335 3.656 20 0 BHADMO CCC[N@@H+](CCCF)[C@H]1CCc2ccccc21 ZINC000483403795 528063012 /nfs/dbraw/zinc/06/30/12/528063012.db2.gz IKGKTMMMOVTLGK-HNNXBMFYSA-N 1 1 235.346 3.746 20 0 BHADMO CCC[N@@H+](CCCF)[C@@H]1CCc2ccccc21 ZINC000483403797 528063540 /nfs/dbraw/zinc/06/35/40/528063540.db2.gz IKGKTMMMOVTLGK-OAHLLOKOSA-N 1 1 235.346 3.746 20 0 BHADMO C[C@]1(c2ccc(F)cc2)CC[N@@H+](CCC2CC2)C1 ZINC000483404146 225243121 /nfs/dbraw/zinc/24/31/21/225243121.db2.gz IUZQNMPYARUHAS-INIZCTEOSA-N 1 1 247.357 3.589 20 0 BHADMO C[C@@]1(c2ccc(F)cc2)CC[N@@H+](CCC2CC2)C1 ZINC000483404163 225242339 /nfs/dbraw/zinc/24/23/39/225242339.db2.gz IUZQNMPYARUHAS-MRXNPFEDSA-N 1 1 247.357 3.589 20 0 BHADMO Cc1ccccc1[C@@H](C)[N@H+]1CCC[C@H](C)C1 ZINC000483404823 225243053 /nfs/dbraw/zinc/24/30/53/225243053.db2.gz JFOZLISKHBSXAY-GXTWGEPZSA-N 1 1 217.356 3.788 20 0 BHADMO Cc1ccccc1[C@H](C)[N@H+]1CCC[C@H](C)C1 ZINC000483404825 225242791 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/nfs/dbraw/zinc/43/11/92/534431192.db2.gz FOURPPJZGDNHJQ-AWEZNQCLSA-N 1 1 227.367 3.781 20 0 BHADMO FCCC[N@H+]1CCC[C@@H]1CC1CCCCC1 ZINC000483415146 534432255 /nfs/dbraw/zinc/43/22/55/534432255.db2.gz FOURPPJZGDNHJQ-CQSZACIVSA-N 1 1 227.367 3.781 20 0 BHADMO CCc1ccc(C[N@H+]2CCSCC[C@H]2C)cc1 ZINC000483419171 529642123 /nfs/dbraw/zinc/64/21/23/529642123.db2.gz HKVOBIIIJXUNIJ-CYBMUJFWSA-N 1 1 249.423 3.576 20 0 BHADMO CCc1ccc(C[N@H+]2CCSCC[C@@H]2C)cc1 ZINC000483419172 529641888 /nfs/dbraw/zinc/64/18/88/529641888.db2.gz HKVOBIIIJXUNIJ-ZDUSSCGKSA-N 1 1 249.423 3.576 20 0 BHADMO CC(C)C[N@@H+](CCCF)CCc1ccccc1 ZINC000483421735 527938508 /nfs/dbraw/zinc/93/85/08/527938508.db2.gz OHNSBDKERRXZMA-UHFFFAOYSA-N 1 1 237.362 3.547 20 0 BHADMO Cc1cccc(C[N@@H+]2CCSCC[C@H]2C)c1C ZINC000483422198 534709485 /nfs/dbraw/zinc/70/94/85/534709485.db2.gz QAXAXDWLRJNDOW-CYBMUJFWSA-N 1 1 249.423 3.631 20 0 BHADMO Cc1cccc(C[N@@H+]2CCSCC[C@@H]2C)c1C ZINC000483422199 534708708 /nfs/dbraw/zinc/70/87/08/534708708.db2.gz QAXAXDWLRJNDOW-ZDUSSCGKSA-N 1 1 249.423 3.631 20 0 BHADMO C[C@@H]1CCSCC[N@H+]1C/C=C\c1ccccc1 ZINC000483422434 534123514 /nfs/dbraw/zinc/12/35/14/534123514.db2.gz QIBTXOXDZDEYSX-BMWLXYDHSA-N 1 1 247.407 3.527 20 0 BHADMO C[C@H]1CCSCC[N@H+]1C/C=C\c1ccccc1 ZINC000483422435 225242817 /nfs/dbraw/zinc/24/28/17/225242817.db2.gz QIBTXOXDZDEYSX-PODYEWJSSA-N 1 1 247.407 3.527 20 0 BHADMO Cc1ccc(C)c(C[N@@H+]2CCSCC[C@@H]2C)c1 ZINC000483425343 533668285 /nfs/dbraw/zinc/66/82/85/533668285.db2.gz ILYDCKXONWDAAI-AWEZNQCLSA-N 1 1 249.423 3.631 20 0 BHADMO Cc1ccc(C)c(C[N@@H+]2CCSCC[C@H]2C)c1 ZINC000483425344 533668962 /nfs/dbraw/zinc/66/89/62/533668962.db2.gz ILYDCKXONWDAAI-CQSZACIVSA-N 1 1 249.423 3.631 20 0 BHADMO Cc1ccc(C[N@@H+]2CCSCC[C@@H]2C)cc1C ZINC000483425814 533942069 /nfs/dbraw/zinc/94/20/69/533942069.db2.gz KLSHIBUCDMAANX-AWEZNQCLSA-N 1 1 249.423 3.631 20 0 BHADMO Cc1ccc(C[N@@H+]2CCSCC[C@H]2C)cc1C ZINC000483425815 533941884 /nfs/dbraw/zinc/94/18/84/533941884.db2.gz KLSHIBUCDMAANX-CQSZACIVSA-N 1 1 249.423 3.631 20 0 BHADMO Cc1ccc([C@@H]2CCC[N@H+]2CCCF)cc1C ZINC000483426832 225242371 /nfs/dbraw/zinc/24/23/71/225242371.db2.gz HBZWQWWFEZZPMW-HNNXBMFYSA-N 1 1 235.346 3.800 20 0 BHADMO Cc1ccc([C@H]2CCC[N@H+]2CCCF)cc1C ZINC000483426833 225243075 /nfs/dbraw/zinc/24/30/75/225243075.db2.gz HBZWQWWFEZZPMW-OAHLLOKOSA-N 1 1 235.346 3.800 20 0 BHADMO CCC[N@@H+](CCCF)CC1CCCCC1 ZINC000483426991 528062939 /nfs/dbraw/zinc/06/29/39/528062939.db2.gz QCZCUTNLMDWLQN-UHFFFAOYSA-N 1 1 215.356 3.638 20 0 BHADMO C[C@]1(c2ccc(F)cc2)CC[N@@H+](CC2CCC2)C1 ZINC000483427267 225244455 /nfs/dbraw/zinc/24/44/55/225244455.db2.gz RDISPCRWDFLSQU-INIZCTEOSA-N 1 1 247.357 3.589 20 0 BHADMO C[C@@]1(c2ccc(F)cc2)CC[N@@H+](CC2CCC2)C1 ZINC000483427268 225244268 /nfs/dbraw/zinc/24/42/68/225244268.db2.gz RDISPCRWDFLSQU-MRXNPFEDSA-N 1 1 247.357 3.589 20 0 BHADMO Cc1ccc(C[N@@H+]2CCSCC[C@@H]2C)c(C)c1 ZINC000483427537 533941183 /nfs/dbraw/zinc/94/11/83/533941183.db2.gz SAYZVCWTGIECDS-AWEZNQCLSA-N 1 1 249.423 3.631 20 0 BHADMO Cc1ccc(C[N@@H+]2CCSCC[C@H]2C)c(C)c1 ZINC000483427539 533941860 /nfs/dbraw/zinc/94/18/60/533941860.db2.gz SAYZVCWTGIECDS-CQSZACIVSA-N 1 1 249.423 3.631 20 0 BHADMO CCc1ccc(C[N@@H+](CCCF)C2CC2)cc1 ZINC000483428155 529637478 /nfs/dbraw/zinc/63/74/78/529637478.db2.gz BNZAZAOLSJHDGS-UHFFFAOYSA-N 1 1 235.346 3.573 20 0 BHADMO CC[C@@H](c1ccccc1)[N@@H+](CC)CCCF ZINC000483428521 529256568 /nfs/dbraw/zinc/25/65/68/529256568.db2.gz OIGBRYLRBPHLEL-AWEZNQCLSA-N 1 1 223.335 3.819 20 0 BHADMO CC[C@H](c1ccccc1)[N@@H+](CC)CCCF ZINC000483428522 529181542 /nfs/dbraw/zinc/18/15/42/529181542.db2.gz OIGBRYLRBPHLEL-CQSZACIVSA-N 1 1 223.335 3.819 20 0 BHADMO CC(C)C[N@@H+](CCCF)Cc1ccccc1F ZINC000483428776 527939308 /nfs/dbraw/zinc/93/93/08/527939308.db2.gz OOUSDBUYMAKGCM-UHFFFAOYSA-N 1 1 241.325 3.643 20 0 BHADMO CC(C)[N@@H+](CCCF)Cc1cccc(Cl)c1 ZINC000483429032 528880587 /nfs/dbraw/zinc/88/05/87/528880587.db2.gz XTTGVDSRBCDZRT-UHFFFAOYSA-N 1 1 243.753 3.910 20 0 BHADMO Cc1cccc(C)c1C[N@@H+]1CCSCC[C@@H]1C ZINC000483429041 534665704 /nfs/dbraw/zinc/66/57/04/534665704.db2.gz XVYHBINDPNDBSA-AWEZNQCLSA-N 1 1 249.423 3.631 20 0 BHADMO Cc1cccc(C)c1C[N@@H+]1CCSCC[C@H]1C ZINC000483429042 534665998 /nfs/dbraw/zinc/66/59/98/534665998.db2.gz XVYHBINDPNDBSA-CQSZACIVSA-N 1 1 249.423 3.631 20 0 BHADMO Cc1cccc(C[N@H+](CCCF)CC(C)C)c1 ZINC000483429929 534705153 /nfs/dbraw/zinc/70/51/53/534705153.db2.gz HPEGQUQQEDKZFX-UHFFFAOYSA-N 1 1 237.362 3.813 20 0 BHADMO CC(C)CC[N@@H+](CCCF)C1CCCC1 ZINC000483430896 527719855 /nfs/dbraw/zinc/71/98/55/527719855.db2.gz XYUBJLFBYYCIMJ-UHFFFAOYSA-N 1 1 215.356 3.637 20 0 BHADMO CCCCC[N@H+]1CCc2c(F)cc(F)cc2C1 ZINC000483518033 528186398 /nfs/dbraw/zinc/18/63/98/528186398.db2.gz VBWYAQYWUHZUKA-UHFFFAOYSA-N 1 1 239.309 3.513 20 0 BHADMO CCCC[N@@H+](C)Cc1cc(OC)ccc1Cl ZINC000483518768 528359642 /nfs/dbraw/zinc/35/96/42/528359642.db2.gz JPXMVDWPQUBFPB-UHFFFAOYSA-N 1 1 241.762 3.581 20 0 BHADMO CCC[N@@H+](CC)Cc1cc(OC)ccc1Cl ZINC000483592459 528001183 /nfs/dbraw/zinc/00/11/83/528001183.db2.gz AMRPIXQWWXYWBG-UHFFFAOYSA-N 1 1 241.762 3.581 20 0 BHADMO CCCCC[N@H+]1CCc2c(F)ccc(F)c2C1 ZINC000483919387 528186127 /nfs/dbraw/zinc/18/61/27/528186127.db2.gz HNQQDBGIKWVOKA-UHFFFAOYSA-N 1 1 239.309 3.513 20 0 BHADMO CCCCC[N@H+]1CCS[C@@H]2CCCC[C@H]21 ZINC000483935258 528186440 /nfs/dbraw/zinc/18/64/40/528186440.db2.gz RZEXDVJHAHXGFL-CHWSQXEVSA-N 1 1 227.417 3.537 20 0 BHADMO CCCCC[N@H+]1CCS[C@H]2CCCC[C@H]21 ZINC000483935259 528185923 /nfs/dbraw/zinc/18/59/23/528185923.db2.gz RZEXDVJHAHXGFL-OLZOCXBDSA-N 1 1 227.417 3.537 20 0 BHADMO CCCCC[N@H+]1CCS[C@@H]2CCCC[C@@H]21 ZINC000483935260 528185553 /nfs/dbraw/zinc/18/55/53/528185553.db2.gz RZEXDVJHAHXGFL-QWHCGFSZSA-N 1 1 227.417 3.537 20 0 BHADMO CCCCC[N@H+]1CCS[C@H]2CCCC[C@@H]21 ZINC000483935261 528186662 /nfs/dbraw/zinc/18/66/62/528186662.db2.gz RZEXDVJHAHXGFL-STQMWFEESA-N 1 1 227.417 3.537 20 0 BHADMO CCCCC[C@H]1CCC[N@H+]1CCc1cccnc1 ZINC000483962099 528275285 /nfs/dbraw/zinc/27/52/85/528275285.db2.gz OCDNZFKPBPAFOE-INIZCTEOSA-N 1 1 246.398 3.669 20 0 BHADMO CCCCC[C@@H]1CCC[N@H+]1CCc1cccnc1 ZINC000483962101 528262695 /nfs/dbraw/zinc/26/26/95/528262695.db2.gz OCDNZFKPBPAFOE-MRXNPFEDSA-N 1 1 246.398 3.669 20 0 BHADMO CCCCC[N@@H+](CC)[C@H](C)c1cccc(O)c1 ZINC000483965013 528167114 /nfs/dbraw/zinc/16/71/14/528167114.db2.gz PBDCDWRVNOOUHE-CYBMUJFWSA-N 1 1 235.371 3.965 20 0 BHADMO CCCCC[N@@H+](CC)[C@@H](C)c1cccc(O)c1 ZINC000483965014 528167183 /nfs/dbraw/zinc/16/71/83/528167183.db2.gz PBDCDWRVNOOUHE-ZDUSSCGKSA-N 1 1 235.371 3.965 20 0 BHADMO CCCCC[N@H+]1CCc2ccc(F)c(F)c2C1 ZINC000483989117 528186538 /nfs/dbraw/zinc/18/65/38/528186538.db2.gz WJMQHSYIBXWUJZ-UHFFFAOYSA-N 1 1 239.309 3.513 20 0 BHADMO CC(C)[C@@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000484006319 528667942 /nfs/dbraw/zinc/66/79/42/528667942.db2.gz CIQSYOOBVZDFPI-GFCCVEGCSA-N 1 1 223.385 3.616 20 0 BHADMO CC(C)[C@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000484006376 527778184 /nfs/dbraw/zinc/77/81/84/527778184.db2.gz CIQSYOOBVZDFPI-LBPRGKRZSA-N 1 1 223.385 3.616 20 0 BHADMO CC(C)CCC[N@@H+](C)Cc1cccs1 ZINC000484012673 527703157 /nfs/dbraw/zinc/70/31/57/527703157.db2.gz DEBXDEYKNPXOMC-UHFFFAOYSA-N 1 1 211.374 3.616 20 0 BHADMO CC1(C)CCCC[N@@H+](Cc2cccs2)C1 ZINC000484018170 528913314 /nfs/dbraw/zinc/91/33/14/528913314.db2.gz XJLCEJHFKRMOSJ-UHFFFAOYSA-N 1 1 223.385 3.760 20 0 BHADMO c1csc(C[N@H+]2CCCC3(CCCC3)C2)c1 ZINC000484020860 534520783 /nfs/dbraw/zinc/52/07/83/534520783.db2.gz NDWLAPHGCHNPLW-UHFFFAOYSA-N 1 1 235.396 3.904 20 0 BHADMO CCCCC[N@@H+]([C@H](C)c1ccco1)C1CC1 ZINC000484066334 528182754 /nfs/dbraw/zinc/18/27/54/528182754.db2.gz GSSMCNLOQIJRJX-GFCCVEGCSA-N 1 1 221.344 3.995 20 0 BHADMO CCCCC[N@@H+]([C@@H](C)c1ccco1)C1CC1 ZINC000484066335 528183100 /nfs/dbraw/zinc/18/31/00/528183100.db2.gz GSSMCNLOQIJRJX-LBPRGKRZSA-N 1 1 221.344 3.995 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1cc(OC)ccc1Cl ZINC000484067705 529691093 /nfs/dbraw/zinc/69/10/93/529691093.db2.gz CMUUTCJDWBYGRN-JTQLQIEISA-N 1 1 241.762 3.579 20 0 BHADMO CC[C@@H](C)[N@@H+](C)Cc1cc(OC)ccc1Cl ZINC000484067706 529344869 /nfs/dbraw/zinc/34/48/69/529344869.db2.gz CMUUTCJDWBYGRN-SNVBAGLBSA-N 1 1 241.762 3.579 20 0 BHADMO CCCC[N@H+]1CC[C@H](C(F)(F)F)C(C)(C)C1 ZINC000484346237 528486614 /nfs/dbraw/zinc/48/66/14/528486614.db2.gz YQIKAABOYLAXTG-JTQLQIEISA-N 1 1 237.309 3.697 20 0 BHADMO CCCC[N@H+]1CC[C@@H](C(F)(F)F)C(C)(C)C1 ZINC000484346239 528486911 /nfs/dbraw/zinc/48/69/11/528486911.db2.gz YQIKAABOYLAXTG-SNVBAGLBSA-N 1 1 237.309 3.697 20 0 BHADMO CC1(C)C[N@@H+](CCC2CC2)CC[C@H]1C(F)(F)F ZINC000484346628 529116080 /nfs/dbraw/zinc/11/60/80/529116080.db2.gz YTKNPQCIMKHWNW-LLVKDONJSA-N 1 1 249.320 3.697 20 0 BHADMO CC1(C)C[N@@H+](CCC2CC2)CC[C@@H]1C(F)(F)F ZINC000484346630 529116096 /nfs/dbraw/zinc/11/60/96/529116096.db2.gz YTKNPQCIMKHWNW-NSHDSACASA-N 1 1 249.320 3.697 20 0 BHADMO CC(C)c1ccc(SC[C@@H]2CC[N@@H+](C)C2)cc1 ZINC000484500293 528127118 /nfs/dbraw/zinc/12/71/18/528127118.db2.gz KKYYYRXYVNRPCG-CYBMUJFWSA-N 1 1 249.423 3.854 20 0 BHADMO CC(C)c1ccc(SC[C@H]2CC[N@@H+](C)C2)cc1 ZINC000484500296 528127903 /nfs/dbraw/zinc/12/79/03/528127903.db2.gz KKYYYRXYVNRPCG-ZDUSSCGKSA-N 1 1 249.423 3.854 20 0 BHADMO CCCc1[nH+]ccn1CCCc1cccc(F)c1 ZINC000484665267 528769668 /nfs/dbraw/zinc/76/96/68/528769668.db2.gz UUQPYQOKFPCBKG-UHFFFAOYSA-N 1 1 246.329 3.608 20 0 BHADMO CCCC1CCC([N@@H+](C)CCCF)CC1 ZINC000484874494 528070131 /nfs/dbraw/zinc/07/01/31/528070131.db2.gz OOROFPPBYHBDNB-UHFFFAOYSA-N 1 1 215.356 3.637 20 0 BHADMO CC[N@H+](Cc1c(C)cc(C)cc1C)CC1CC1 ZINC000484992595 528755469 /nfs/dbraw/zinc/75/54/69/528755469.db2.gz FNBCRGMQLHNINA-UHFFFAOYSA-N 1 1 231.383 3.844 20 0 BHADMO FCCC[N@@H+](C1CC1)[C@H]1CCCc2ccccc21 ZINC000485040010 534430089 /nfs/dbraw/zinc/43/00/89/534430089.db2.gz KCWQWXZGTVYVCP-INIZCTEOSA-N 1 1 247.357 3.888 20 0 BHADMO FCCC[N@@H+](C1CC1)[C@@H]1CCCc2ccccc21 ZINC000485040026 534430137 /nfs/dbraw/zinc/43/01/37/534430137.db2.gz KCWQWXZGTVYVCP-MRXNPFEDSA-N 1 1 247.357 3.888 20 0 BHADMO CCC(C)(C)CC[N@H+]1CCc2ccc(O)cc2C1 ZINC000485072922 528504871 /nfs/dbraw/zinc/50/48/71/528504871.db2.gz GGQPEOLIHLTFEW-UHFFFAOYSA-N 1 1 247.382 3.577 20 0 BHADMO CC(C)CC[C@H]1CCCC[N@H+]1CCCF ZINC000485218834 527853467 /nfs/dbraw/zinc/85/34/67/527853467.db2.gz MZKHDALIJRPZQG-CYBMUJFWSA-N 1 1 215.356 3.637 20 0 BHADMO CC(C)CC[C@@H]1CCCC[N@H+]1CCCF ZINC000485218835 527815049 /nfs/dbraw/zinc/81/50/49/527815049.db2.gz MZKHDALIJRPZQG-ZDUSSCGKSA-N 1 1 215.356 3.637 20 0 BHADMO CC1=C[C@H](C)CN(c2cc[nH+]c3ccsc32)C1 ZINC000485420973 528142485 /nfs/dbraw/zinc/14/24/85/528142485.db2.gz FKAKMMKRRJIZAQ-JTQLQIEISA-N 1 1 244.363 3.699 20 0 BHADMO CC1=C[C@@H](C)CN(c2cc[nH+]c3ccsc32)C1 ZINC000485420975 528131160 /nfs/dbraw/zinc/13/11/60/528131160.db2.gz FKAKMMKRRJIZAQ-SNVBAGLBSA-N 1 1 244.363 3.699 20 0 BHADMO CC(C)CC[N@@H+]([C@H](C)c1ccco1)C1CC1 ZINC000485421870 527719986 /nfs/dbraw/zinc/71/99/86/527719986.db2.gz PVOMSSIZYFLLLZ-GFCCVEGCSA-N 1 1 221.344 3.851 20 0 BHADMO CC(C)CC[N@@H+]([C@@H](C)c1ccco1)C1CC1 ZINC000485421871 527719952 /nfs/dbraw/zinc/71/99/52/527719952.db2.gz PVOMSSIZYFLLLZ-LBPRGKRZSA-N 1 1 221.344 3.851 20 0 BHADMO CC[N@@H+](CCCc1cccc(F)c1)C1CCC1 ZINC000485455049 528472927 /nfs/dbraw/zinc/47/29/27/528472927.db2.gz BUVRILGEHMHPBK-UHFFFAOYSA-N 1 1 235.346 3.633 20 0 BHADMO C[N@H+]1CC[C@@H](CSC(C)(C)c2ccccc2)C1 ZINC000485492541 529794448 /nfs/dbraw/zinc/79/44/48/529794448.db2.gz PLYPFOHODFPTSO-CYBMUJFWSA-N 1 1 249.423 3.607 20 0 BHADMO C[N@H+]1CC[C@H](CSC(C)(C)c2ccccc2)C1 ZINC000485492542 529805026 /nfs/dbraw/zinc/80/50/26/529805026.db2.gz PLYPFOHODFPTSO-ZDUSSCGKSA-N 1 1 249.423 3.607 20 0 BHADMO Cc1ccccc1[C@@H](C)[N@@H+](C)CC1CCC1 ZINC000485673079 225256520 /nfs/dbraw/zinc/25/65/20/225256520.db2.gz QUXWFZGXFIDIAP-CYBMUJFWSA-N 1 1 217.356 3.788 20 0 BHADMO Cc1ccccc1[C@H](C)[N@@H+](C)CC1CCC1 ZINC000485673083 225256605 /nfs/dbraw/zinc/25/66/05/225256605.db2.gz QUXWFZGXFIDIAP-ZDUSSCGKSA-N 1 1 217.356 3.788 20 0 BHADMO CC(C)C[N@@H+](C)Cc1cc(F)cc(Cl)c1 ZINC000485695902 527914359 /nfs/dbraw/zinc/91/43/59/527914359.db2.gz QCWCZBGIWMRJSV-UHFFFAOYSA-N 1 1 229.726 3.567 20 0 BHADMO C[N@@H+](Cc1cc(F)cc(Cl)c1)C1CCCC1 ZINC000485700617 529979211 /nfs/dbraw/zinc/97/92/11/529979211.db2.gz YTUKYHGICKVKQL-UHFFFAOYSA-N 1 1 241.737 3.854 20 0 BHADMO CC[N@@H+](Cc1cc(F)cc(Cl)c1)C(C)C ZINC000485701150 528766351 /nfs/dbraw/zinc/76/63/51/528766351.db2.gz ZTEIVNMWAULNMV-UHFFFAOYSA-N 1 1 229.726 3.709 20 0 BHADMO CC(C)[N@@H+](Cc1cc(F)cc(Cl)c1)C1CC1 ZINC000485702098 528935711 /nfs/dbraw/zinc/93/57/11/528935711.db2.gz NKIUZCFLYHOPKB-UHFFFAOYSA-N 1 1 241.737 3.852 20 0 BHADMO CC[C@@H](C)[N@@H+](C)Cc1cc(F)cc(Cl)c1 ZINC000485702494 529345162 /nfs/dbraw/zinc/34/51/62/529345162.db2.gz BXBCOIQLIPEHBW-SECBINFHSA-N 1 1 229.726 3.709 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1cc(F)cc(Cl)c1 ZINC000485702495 529691376 /nfs/dbraw/zinc/69/13/76/529691376.db2.gz BXBCOIQLIPEHBW-VIFPVBQESA-N 1 1 229.726 3.709 20 0 BHADMO CCC[N@@H+](Cc1cc(F)cc(Cl)c1)C1CC1 ZINC000485702726 528131545 /nfs/dbraw/zinc/13/15/45/528131545.db2.gz QTOLRWKNFCLBJN-UHFFFAOYSA-N 1 1 241.737 3.854 20 0 BHADMO CC(C)[C@H]1CC[N@H+]1Cc1cc(F)cc(Cl)c1 ZINC000485709529 527804509 /nfs/dbraw/zinc/80/45/09/527804509.db2.gz KSKINCXZEMPKTJ-CYBMUJFWSA-N 1 1 241.737 3.709 20 0 BHADMO CC(C)[C@@H]1CC[N@H+]1Cc1cc(F)cc(Cl)c1 ZINC000485709531 528704145 /nfs/dbraw/zinc/70/41/45/528704145.db2.gz KSKINCXZEMPKTJ-ZDUSSCGKSA-N 1 1 241.737 3.709 20 0 BHADMO C[N@@H+](CCC1CC1)Cc1cc(F)cc(Cl)c1 ZINC000485711735 529876585 /nfs/dbraw/zinc/87/65/85/529876585.db2.gz KMQWFPAERNGMFJ-UHFFFAOYSA-N 1 1 241.737 3.711 20 0 BHADMO CC[N@H+](Cc1cc(F)cc(Cl)c1)CC1CC1 ZINC000485711790 528766328 /nfs/dbraw/zinc/76/63/28/528766328.db2.gz LDRCKLHCGOENFG-UHFFFAOYSA-N 1 1 241.737 3.711 20 0 BHADMO C[C@H](C1CC1)[N@@H+](C)Cc1cc(F)cc(Cl)c1 ZINC000485712232 225256974 /nfs/dbraw/zinc/25/69/74/225256974.db2.gz LUPPXXXUVDYHIH-SECBINFHSA-N 1 1 241.737 3.709 20 0 BHADMO C[C@@H](C1CC1)[N@@H+](C)Cc1cc(F)cc(Cl)c1 ZINC000485712233 225257448 /nfs/dbraw/zinc/25/74/48/225257448.db2.gz LUPPXXXUVDYHIH-VIFPVBQESA-N 1 1 241.737 3.709 20 0 BHADMO CCC[N@@H+](CC)Cc1cc(F)cc(Cl)c1 ZINC000485714170 528000308 /nfs/dbraw/zinc/00/03/08/528000308.db2.gz BVHXRNURGSWPSH-UHFFFAOYSA-N 1 1 229.726 3.711 20 0 BHADMO C[N@H+](Cc1cc(F)cc(Cl)c1)CC1CCC1 ZINC000485718029 529979259 /nfs/dbraw/zinc/97/92/59/529979259.db2.gz PTRFITDJQAGHIF-UHFFFAOYSA-N 1 1 241.737 3.711 20 0 BHADMO CC(C)[C@@H](C)[N@@H+](C)CCCc1cccc(F)c1 ZINC000485718146 528407316 /nfs/dbraw/zinc/40/73/16/528407316.db2.gz QNXCVOAIGVYWKV-CYBMUJFWSA-N 1 1 237.362 3.735 20 0 BHADMO CC(C)[C@H](C)[N@@H+](C)CCCc1cccc(F)c1 ZINC000485718151 528958052 /nfs/dbraw/zinc/95/80/52/528958052.db2.gz QNXCVOAIGVYWKV-ZDUSSCGKSA-N 1 1 237.362 3.735 20 0 BHADMO CC(C)[N@@H+](CCCc1cccc(F)c1)C1CC1 ZINC000485719335 528887498 /nfs/dbraw/zinc/88/74/98/528887498.db2.gz VHTGEFFLEUWBQL-UHFFFAOYSA-N 1 1 235.346 3.631 20 0 BHADMO CCCC[N@@H+](C)Cc1cc(F)cc(Cl)c1 ZINC000485720802 528359004 /nfs/dbraw/zinc/35/90/04/528359004.db2.gz RUEUZJWPJHNURF-UHFFFAOYSA-N 1 1 229.726 3.711 20 0 BHADMO CC1=CC[N@@H+](Cc2cc(F)cc(Cl)c2)CC1 ZINC000485720954 528122075 /nfs/dbraw/zinc/12/20/75/528122075.db2.gz SPAZZYSIRZSEIO-UHFFFAOYSA-N 1 1 239.721 3.631 20 0 BHADMO CC1=CC[N@H+](Cc2cc(F)cc(Cl)c2)CC1 ZINC000485720954 528122067 /nfs/dbraw/zinc/12/20/67/528122067.db2.gz SPAZZYSIRZSEIO-UHFFFAOYSA-N 1 1 239.721 3.631 20 0 BHADMO CC[N@@H+](Cc1cc(F)cc(Cl)c1)C1CCC1 ZINC000485728098 528767016 /nfs/dbraw/zinc/76/70/16/528767016.db2.gz AAQXNFKMKHRXQH-UHFFFAOYSA-N 1 1 241.737 3.854 20 0 BHADMO C[N@@H+](CCCc1cccc(F)c1)C1CCCC1 ZINC000485746896 529896514 /nfs/dbraw/zinc/89/65/14/529896514.db2.gz UGYXLWWKMCPVFJ-UHFFFAOYSA-N 1 1 235.346 3.633 20 0 BHADMO C[C@@H]1CCCC[N@H+]1CCCc1cccc(F)c1 ZINC000485776102 225258895 /nfs/dbraw/zinc/25/88/95/225258895.db2.gz WHWSRLVOGKQMQG-CYBMUJFWSA-N 1 1 235.346 3.633 20 0 BHADMO C[C@H]1CCCC[N@H+]1CCCc1cccc(F)c1 ZINC000485776103 225258400 /nfs/dbraw/zinc/25/84/00/225258400.db2.gz WHWSRLVOGKQMQG-ZDUSSCGKSA-N 1 1 235.346 3.633 20 0 BHADMO CC[N@H+]1C[C@H](c2ccccc2)[C@@H]2CCCC[C@H]21 ZINC000485860291 527992671 /nfs/dbraw/zinc/99/26/71/527992671.db2.gz OLAGZXDOVXLBCU-ARFHVFGLSA-N 1 1 229.367 3.665 20 0 BHADMO CC[N@H+]1C[C@H](c2ccccc2)[C@H]2CCCC[C@H]21 ZINC000485860292 527993579 /nfs/dbraw/zinc/99/35/79/527993579.db2.gz OLAGZXDOVXLBCU-BZUAXINKSA-N 1 1 229.367 3.665 20 0 BHADMO CC[N@H+]1C[C@H](c2ccccc2)[C@H]2CCCC[C@@H]21 ZINC000485860293 527993856 /nfs/dbraw/zinc/99/38/56/527993856.db2.gz OLAGZXDOVXLBCU-OAGGEKHMSA-N 1 1 229.367 3.665 20 0 BHADMO CC[N@H+]1C[C@H](c2ccccc2)[C@@H]2CCCC[C@@H]21 ZINC000485860294 527993112 /nfs/dbraw/zinc/99/31/12/527993112.db2.gz OLAGZXDOVXLBCU-XHSDSOJGSA-N 1 1 229.367 3.665 20 0 BHADMO C[C@@H]1CCCCC[N@H+]1CCCCC(F)(F)F ZINC000485881915 225260781 /nfs/dbraw/zinc/26/07/81/225260781.db2.gz MOWIBQWXIILVQO-LLVKDONJSA-N 1 1 237.309 3.984 20 0 BHADMO C[C@H]1CCCCC[N@H+]1CCCCC(F)(F)F ZINC000485881917 225260376 /nfs/dbraw/zinc/26/03/76/225260376.db2.gz MOWIBQWXIILVQO-NSHDSACASA-N 1 1 237.309 3.984 20 0 BHADMO C[C@@H]1CCCC[C@@H]1[N@@H+](C)C/C=C/c1ccncc1 ZINC000486241244 225262864 /nfs/dbraw/zinc/26/28/64/225262864.db2.gz BRJVUCXREGQEQB-HMQGTJFBSA-N 1 1 244.382 3.605 20 0 BHADMO C[C@@H]1CCCC[C@H]1[N@@H+](C)C/C=C\c1ccncc1 ZINC000486241272 533606788 /nfs/dbraw/zinc/60/67/88/533606788.db2.gz BRJVUCXREGQEQB-QAOXIVLQSA-N 1 1 244.382 3.605 20 0 BHADMO C[C@@H]1CCCC[C@@H]1[N@@H+](C)C/C=C\c1ccncc1 ZINC000486241274 225262981 /nfs/dbraw/zinc/26/29/81/225262981.db2.gz BRJVUCXREGQEQB-UYTOFJLZSA-N 1 1 244.382 3.605 20 0 BHADMO C[C@@H]1CCCC[C@H]1[N@@H+](C)C/C=C/c1ccncc1 ZINC000486241484 533607397 /nfs/dbraw/zinc/60/73/97/533607397.db2.gz BRJVUCXREGQEQB-WQELODFKSA-N 1 1 244.382 3.605 20 0 BHADMO C[N@@H+](CCc1cc(Cl)ccc1Cl)C1CC1 ZINC000486739206 529932660 /nfs/dbraw/zinc/93/26/60/529932660.db2.gz SHMGYLIDDMCKFZ-UHFFFAOYSA-N 1 1 244.165 3.630 20 0 BHADMO COCCCCC[N@H+]1CCC[C@H]1CCC(C)C ZINC000486781063 225268580 /nfs/dbraw/zinc/26/85/80/225268580.db2.gz WFJWESINHHKOKP-HNNXBMFYSA-N 1 1 241.419 3.704 20 0 BHADMO COCCCCC[N@H+]1CCC[C@@H]1CCC(C)C ZINC000486781064 225269488 /nfs/dbraw/zinc/26/94/88/225269488.db2.gz WFJWESINHHKOKP-OAHLLOKOSA-N 1 1 241.419 3.704 20 0 BHADMO CCCCC[C@@H]1CCC[N@H+]1C[C@@H]1CCCCO1 ZINC000486784158 528262173 /nfs/dbraw/zinc/26/21/73/528262173.db2.gz XGPUHJLXDIPLFI-CABCVRRESA-N 1 1 239.403 3.600 20 0 BHADMO CCCCC[C@H]1CCC[N@H+]1C[C@@H]1CCCCO1 ZINC000486784159 528275168 /nfs/dbraw/zinc/27/51/68/528275168.db2.gz XGPUHJLXDIPLFI-GJZGRUSLSA-N 1 1 239.403 3.600 20 0 BHADMO CCCCC[C@@H]1CCC[N@H+]1C[C@H]1CCCCO1 ZINC000486784160 528262294 /nfs/dbraw/zinc/26/22/94/528262294.db2.gz XGPUHJLXDIPLFI-HUUCEWRRSA-N 1 1 239.403 3.600 20 0 BHADMO CCCCC[C@H]1CCC[N@H+]1C[C@H]1CCCCO1 ZINC000486784161 528275084 /nfs/dbraw/zinc/27/50/84/528275084.db2.gz XGPUHJLXDIPLFI-LSDHHAIUSA-N 1 1 239.403 3.600 20 0 BHADMO CCC[C@@H](C)[C@H]1CCC[N@H+]1CCCSC ZINC000486787370 528906619 /nfs/dbraw/zinc/90/66/19/528906619.db2.gz LAKQHBGGONYLLD-CHWSQXEVSA-N 1 1 229.433 3.640 20 0 BHADMO CCC[C@@H](C)[C@@H]1CCC[N@H+]1CCCSC ZINC000486787375 528904094 /nfs/dbraw/zinc/90/40/94/528904094.db2.gz LAKQHBGGONYLLD-OLZOCXBDSA-N 1 1 229.433 3.640 20 0 BHADMO CCC[C@H](C)[C@H]1CCC[N@H+]1CCCSC ZINC000486787376 528082184 /nfs/dbraw/zinc/08/21/84/528082184.db2.gz LAKQHBGGONYLLD-QWHCGFSZSA-N 1 1 229.433 3.640 20 0 BHADMO CCC[C@H](C)[C@@H]1CCC[N@H+]1CCCSC ZINC000486787377 528074200 /nfs/dbraw/zinc/07/42/00/528074200.db2.gz LAKQHBGGONYLLD-STQMWFEESA-N 1 1 229.433 3.640 20 0 BHADMO CCC[C@@H](C)[C@@H]1CCC[N@H+]1CCCOC(C)C ZINC000486788754 528903514 /nfs/dbraw/zinc/90/35/14/528903514.db2.gz RGBPRAIMUYUPTC-CABCVRRESA-N 1 1 241.419 3.702 20 0 BHADMO CCC[C@H](C)[C@@H]1CCC[N@H+]1CCCOC(C)C ZINC000486788755 528073308 /nfs/dbraw/zinc/07/33/08/528073308.db2.gz RGBPRAIMUYUPTC-GJZGRUSLSA-N 1 1 241.419 3.702 20 0 BHADMO CCC[C@@H](C)[C@H]1CCC[N@H+]1CCCOC(C)C ZINC000486788756 528906460 /nfs/dbraw/zinc/90/64/60/528906460.db2.gz RGBPRAIMUYUPTC-HUUCEWRRSA-N 1 1 241.419 3.702 20 0 BHADMO CCC[C@H](C)[C@H]1CCC[N@H+]1CCCOC(C)C ZINC000486788757 528082093 /nfs/dbraw/zinc/08/20/93/528082093.db2.gz RGBPRAIMUYUPTC-LSDHHAIUSA-N 1 1 241.419 3.702 20 0 BHADMO FCCC[N@H+]1CCC[C@H]1CCC1CCCC1 ZINC000486788972 534432341 /nfs/dbraw/zinc/43/23/41/534432341.db2.gz PIQKLBZSYGPBHK-AWEZNQCLSA-N 1 1 227.367 3.781 20 0 BHADMO FCCC[N@H+]1CCC[C@@H]1CCC1CCCC1 ZINC000486788973 534432619 /nfs/dbraw/zinc/43/26/19/534432619.db2.gz PIQKLBZSYGPBHK-CQSZACIVSA-N 1 1 227.367 3.781 20 0 BHADMO CC(C)[N@@H+](CCC1CCCC1)CC(F)F ZINC000486791421 528880387 /nfs/dbraw/zinc/88/03/87/528880387.db2.gz NKWIAAHVKVFQRE-UHFFFAOYSA-N 1 1 219.319 3.542 20 0 BHADMO CC(C)[N@H+](CCC1CCCC1)CC(F)F ZINC000486791421 528880383 /nfs/dbraw/zinc/88/03/83/528880383.db2.gz NKWIAAHVKVFQRE-UHFFFAOYSA-N 1 1 219.319 3.542 20 0 BHADMO CC(C)CC[C@@H]1CCC[N@H+]1CCCOC(C)C ZINC000486791719 527820280 /nfs/dbraw/zinc/82/02/80/527820280.db2.gz PHUWXZSURCLLBT-HNNXBMFYSA-N 1 1 241.419 3.702 20 0 BHADMO CC(C)CC[C@H]1CCC[N@H+]1CCCOC(C)C ZINC000486791720 527857747 /nfs/dbraw/zinc/85/77/47/527857747.db2.gz PHUWXZSURCLLBT-OAHLLOKOSA-N 1 1 241.419 3.702 20 0 BHADMO FCCC[N@H+]1CCC[C@@H]1CCCc1ccccc1 ZINC000486796181 534431743 /nfs/dbraw/zinc/43/17/43/534431743.db2.gz APHXCCUXNSLVIR-INIZCTEOSA-N 1 1 249.373 3.833 20 0 BHADMO FCCC[N@H+]1CCC[C@H]1CCCc1ccccc1 ZINC000486796191 534431296 /nfs/dbraw/zinc/43/12/96/534431296.db2.gz APHXCCUXNSLVIR-MRXNPFEDSA-N 1 1 249.373 3.833 20 0 BHADMO CCCCC[C@H]1CCC[N@H+]1CCc1ccccn1 ZINC000486799034 528275366 /nfs/dbraw/zinc/27/53/66/528275366.db2.gz LWISNGNRMCWLRS-INIZCTEOSA-N 1 1 246.398 3.669 20 0 BHADMO CCCCC[C@@H]1CCC[N@H+]1CCc1ccccn1 ZINC000486799036 528262412 /nfs/dbraw/zinc/26/24/12/528262412.db2.gz LWISNGNRMCWLRS-MRXNPFEDSA-N 1 1 246.398 3.669 20 0 BHADMO CCCCC[C@H]1CCC[N@H+]1Cc1cc(C)on1 ZINC000486800117 528274544 /nfs/dbraw/zinc/27/45/44/528274544.db2.gz HZCDGWXGWBYKIE-AWEZNQCLSA-N 1 1 236.359 3.528 20 0 BHADMO CCCCC[C@@H]1CCC[N@H+]1Cc1cc(C)on1 ZINC000486800123 528262372 /nfs/dbraw/zinc/26/23/72/528262372.db2.gz HZCDGWXGWBYKIE-CQSZACIVSA-N 1 1 236.359 3.528 20 0 BHADMO CCCCC[C@H]1CCC[N@H+]1CCCCCOC ZINC000486800748 528274977 /nfs/dbraw/zinc/27/49/77/528274977.db2.gz SSXSJNHHTYCVSN-HNNXBMFYSA-N 1 1 241.419 3.848 20 0 BHADMO CCCCC[C@@H]1CCC[N@H+]1CCCCCOC ZINC000486800749 528262615 /nfs/dbraw/zinc/26/26/15/528262615.db2.gz SSXSJNHHTYCVSN-OAHLLOKOSA-N 1 1 241.419 3.848 20 0 BHADMO CCC(C)(C)CC[N@@H+](CC(F)F)C(C)C ZINC000486800985 528500562 /nfs/dbraw/zinc/50/05/62/528500562.db2.gz MCIVOQVLMOAHIC-UHFFFAOYSA-N 1 1 221.335 3.788 20 0 BHADMO CCC(C)(C)CC[N@H+](CC(F)F)C(C)C ZINC000486800985 528500557 /nfs/dbraw/zinc/50/05/57/528500557.db2.gz MCIVOQVLMOAHIC-UHFFFAOYSA-N 1 1 221.335 3.788 20 0 BHADMO CCCCC[C@@H]1CCC[N@H+]1CCCSC ZINC000486801547 528262047 /nfs/dbraw/zinc/26/20/47/528262047.db2.gz UZYQDKNJJIGELE-CYBMUJFWSA-N 1 1 229.433 3.784 20 0 BHADMO CCCCC[C@H]1CCC[N@H+]1CCCSC ZINC000486801548 528274715 /nfs/dbraw/zinc/27/47/15/528274715.db2.gz UZYQDKNJJIGELE-ZDUSSCGKSA-N 1 1 229.433 3.784 20 0 BHADMO CCC[C@@H](C)[C@@H]1CCC[N@H+]1CCCCCOC ZINC000486802577 528904341 /nfs/dbraw/zinc/90/43/41/528904341.db2.gz NODXJMJDIBKGMX-CABCVRRESA-N 1 1 241.419 3.704 20 0 BHADMO CCC[C@H](C)[C@@H]1CCC[N@H+]1CCCCCOC ZINC000486802579 528074334 /nfs/dbraw/zinc/07/43/34/528074334.db2.gz NODXJMJDIBKGMX-GJZGRUSLSA-N 1 1 241.419 3.704 20 0 BHADMO CCC[C@@H](C)[C@H]1CCC[N@H+]1CCCCCOC ZINC000486802581 528906406 /nfs/dbraw/zinc/90/64/06/528906406.db2.gz NODXJMJDIBKGMX-HUUCEWRRSA-N 1 1 241.419 3.704 20 0 BHADMO CCC[C@H](C)[C@H]1CCC[N@H+]1CCCCCOC ZINC000486802582 528080949 /nfs/dbraw/zinc/08/09/49/528080949.db2.gz NODXJMJDIBKGMX-LSDHHAIUSA-N 1 1 241.419 3.704 20 0 BHADMO CCCCC[C@H]1CCC[N@H+]1CCCOC(C)C ZINC000486807858 528275072 /nfs/dbraw/zinc/27/50/72/528275072.db2.gz ADPLGKSHHMLEEK-HNNXBMFYSA-N 1 1 241.419 3.846 20 0 BHADMO CCCCC[C@@H]1CCC[N@H+]1CCCOC(C)C ZINC000486807859 528262582 /nfs/dbraw/zinc/26/25/82/528262582.db2.gz ADPLGKSHHMLEEK-OAHLLOKOSA-N 1 1 241.419 3.846 20 0 BHADMO Cc1cc[nH+]c(N2CCC[C@H]2CCC(C)C)c1 ZINC000486878135 225270997 /nfs/dbraw/zinc/27/09/97/225270997.db2.gz HQRQZMNFQNOHEQ-AWEZNQCLSA-N 1 1 232.371 3.795 20 0 BHADMO Cc1cc[nH+]c(N2CCC[C@@H]2CCC(C)C)c1 ZINC000486878136 225271165 /nfs/dbraw/zinc/27/11/65/225271165.db2.gz HQRQZMNFQNOHEQ-CQSZACIVSA-N 1 1 232.371 3.795 20 0 BHADMO CCC[C@H](C)[C@@H]1CCCN1c1cc(C)cc[nH+]1 ZINC000486905699 528075893 /nfs/dbraw/zinc/07/58/93/528075893.db2.gz MWYIBXNACZMUEL-KBPBESRZSA-N 1 1 232.371 3.795 20 0 BHADMO CCC[C@@H](C)[C@@H]1CCCN1c1cc(C)cc[nH+]1 ZINC000486905700 528903642 /nfs/dbraw/zinc/90/36/42/528903642.db2.gz MWYIBXNACZMUEL-KGLIPLIRSA-N 1 1 232.371 3.795 20 0 BHADMO CCC[C@H](C)[C@H]1CCCN1c1cc(C)cc[nH+]1 ZINC000486905701 528081832 /nfs/dbraw/zinc/08/18/32/528081832.db2.gz MWYIBXNACZMUEL-UONOGXRCSA-N 1 1 232.371 3.795 20 0 BHADMO CCC[C@@H](C)[C@H]1CCCN1c1cc(C)cc[nH+]1 ZINC000486905702 528907799 /nfs/dbraw/zinc/90/77/99/528907799.db2.gz MWYIBXNACZMUEL-ZIAGYGMSSA-N 1 1 232.371 3.795 20 0 BHADMO CC[C@@H](C)C[N@@H+](C)[C@@H](C)c1cccc(F)c1 ZINC000487229175 398022404 /nfs/dbraw/zinc/02/24/04/398022404.db2.gz BUPGTUAAOBRAMC-NEPJUHHUSA-N 1 1 223.335 3.865 20 0 BHADMO CC[C@H](C)C[N@@H+](C)[C@H](C)c1cccc(F)c1 ZINC000487229177 398022504 /nfs/dbraw/zinc/02/25/04/398022504.db2.gz BUPGTUAAOBRAMC-NWDGAFQWSA-N 1 1 223.335 3.865 20 0 BHADMO CC[C@H](C)C[N@@H+](C)[C@@H](C)c1cccc(F)c1 ZINC000487229178 398022394 /nfs/dbraw/zinc/02/23/94/398022394.db2.gz BUPGTUAAOBRAMC-RYUDHWBXSA-N 1 1 223.335 3.865 20 0 BHADMO CC[C@@H](C)C[N@@H+](C)[C@H](C)c1cccc(F)c1 ZINC000487229179 398022573 /nfs/dbraw/zinc/02/25/73/398022573.db2.gz BUPGTUAAOBRAMC-VXGBXAGGSA-N 1 1 223.335 3.865 20 0 BHADMO CC[C@@H](C)C[N@@H+](C)[C@H](C)c1cccc(OC)c1 ZINC000487265484 529314221 /nfs/dbraw/zinc/31/42/21/529314221.db2.gz SRUBQFWUVHCNRF-CHWSQXEVSA-N 1 1 235.371 3.734 20 0 BHADMO CC[C@@H](C)C[N@@H+](C)[C@@H](C)c1cccc(OC)c1 ZINC000487265485 529314233 /nfs/dbraw/zinc/31/42/33/529314233.db2.gz SRUBQFWUVHCNRF-OLZOCXBDSA-N 1 1 235.371 3.734 20 0 BHADMO CC[C@H](C)C[N@@H+](C)[C@H](C)c1cccc(OC)c1 ZINC000487265488 529652081 /nfs/dbraw/zinc/65/20/81/529652081.db2.gz SRUBQFWUVHCNRF-QWHCGFSZSA-N 1 1 235.371 3.734 20 0 BHADMO CC[C@H](C)C[N@@H+](C)[C@@H](C)c1cccc(OC)c1 ZINC000487265489 529652033 /nfs/dbraw/zinc/65/20/33/529652033.db2.gz SRUBQFWUVHCNRF-STQMWFEESA-N 1 1 235.371 3.734 20 0 BHADMO Cc1ccccc1C[C@H](C)[N@@H+](C)Cc1ccco1 ZINC000487526554 225310789 /nfs/dbraw/zinc/31/07/89/225310789.db2.gz OLQAFDPKAHQBKV-AWEZNQCLSA-N 1 1 243.350 3.651 20 0 BHADMO Cc1ccccc1C[C@@H](C)[N@@H+](C)Cc1ccco1 ZINC000487526556 225310722 /nfs/dbraw/zinc/31/07/22/225310722.db2.gz OLQAFDPKAHQBKV-CQSZACIVSA-N 1 1 243.350 3.651 20 0 BHADMO Cc1[nH+]cn(Cc2ccc(C3CCC3)cc2)c1C ZINC000487865584 225327586 /nfs/dbraw/zinc/32/75/86/225327586.db2.gz ATUJPNQCYCTFJA-UHFFFAOYSA-N 1 1 240.350 3.816 20 0 BHADMO Cc1cccc([C@H](C)[N@H+]2CCC[C@H](C)C2)c1 ZINC000487958019 225334954 /nfs/dbraw/zinc/33/49/54/225334954.db2.gz XIWCXYYQZZVYEZ-KBPBESRZSA-N 1 1 217.356 3.788 20 0 BHADMO Cc1cccc([C@H](C)[N@H+]2CCC[C@@H](C)C2)c1 ZINC000487958021 225336586 /nfs/dbraw/zinc/33/65/86/225336586.db2.gz XIWCXYYQZZVYEZ-KGLIPLIRSA-N 1 1 217.356 3.788 20 0 BHADMO Cc1cccc([C@@H](C)[N@H+]2CCC[C@H](C)C2)c1 ZINC000487958023 225336724 /nfs/dbraw/zinc/33/67/24/225336724.db2.gz XIWCXYYQZZVYEZ-UONOGXRCSA-N 1 1 217.356 3.788 20 0 BHADMO Cc1cccc([C@@H](C)[N@H+]2CCC[C@@H](C)C2)c1 ZINC000487958024 225336945 /nfs/dbraw/zinc/33/69/45/225336945.db2.gz XIWCXYYQZZVYEZ-ZIAGYGMSSA-N 1 1 217.356 3.788 20 0 BHADMO Cc1ccc([C@@H](C)[N@@H+](C)CC2CCC2)cc1 ZINC000487958640 225337055 /nfs/dbraw/zinc/33/70/55/225337055.db2.gz OUAUAYKCBULGNH-CYBMUJFWSA-N 1 1 217.356 3.788 20 0 BHADMO Cc1ccc([C@H](C)[N@@H+](C)CC2CCC2)cc1 ZINC000487958642 225336373 /nfs/dbraw/zinc/33/63/73/225336373.db2.gz OUAUAYKCBULGNH-ZDUSSCGKSA-N 1 1 217.356 3.788 20 0 BHADMO CCCC[N@@H+](C)[C@@H](C)Cc1ccccc1C ZINC000487977215 528368012 /nfs/dbraw/zinc/36/80/12/528368012.db2.gz VUAHOFVUKFREDH-AWEZNQCLSA-N 1 1 219.372 3.658 20 0 BHADMO CCCC[N@@H+](C)[C@H](C)Cc1ccccc1C ZINC000487977216 528368696 /nfs/dbraw/zinc/36/86/96/528368696.db2.gz VUAHOFVUKFREDH-CQSZACIVSA-N 1 1 219.372 3.658 20 0 BHADMO Cc1cccc([C@@H](C)[N@@H+](C)CC2CCC2)c1 ZINC000487984209 225339077 /nfs/dbraw/zinc/33/90/77/225339077.db2.gz AWZBNAADLXXRQF-CYBMUJFWSA-N 1 1 217.356 3.788 20 0 BHADMO Cc1cccc([C@H](C)[N@@H+](C)CC2CCC2)c1 ZINC000487984210 225338298 /nfs/dbraw/zinc/33/82/98/225338298.db2.gz AWZBNAADLXXRQF-ZDUSSCGKSA-N 1 1 217.356 3.788 20 0 BHADMO Cc1ccc(C[C@H](C)[N@@H+](C)CC2CCC2)cc1 ZINC000487991775 225340455 /nfs/dbraw/zinc/34/04/55/225340455.db2.gz WASSCEXHZTZUPP-AWEZNQCLSA-N 1 1 231.383 3.658 20 0 BHADMO Cc1ccc(C[C@@H](C)[N@@H+](C)CC2CCC2)cc1 ZINC000487991777 534114481 /nfs/dbraw/zinc/11/44/81/534114481.db2.gz WASSCEXHZTZUPP-CQSZACIVSA-N 1 1 231.383 3.658 20 0 BHADMO CC[C@@H](Cc1ccccc1)[N@@H+](C)CC1CCC1 ZINC000488007865 529542024 /nfs/dbraw/zinc/54/20/24/529542024.db2.gz JUXOLNGPYJYQPW-INIZCTEOSA-N 1 1 231.383 3.740 20 0 BHADMO CC[C@H](Cc1ccccc1)[N@@H+](C)CC1CCC1 ZINC000488007866 529427316 /nfs/dbraw/zinc/42/73/16/529427316.db2.gz JUXOLNGPYJYQPW-MRXNPFEDSA-N 1 1 231.383 3.740 20 0 BHADMO Cc1cc(F)ccc1C[N@H+](C)[C@H]1C=CCCC1 ZINC000488009550 533877221 /nfs/dbraw/zinc/87/72/21/533877221.db2.gz NOBCUOYWPAGDHA-HNNXBMFYSA-N 1 1 233.330 3.675 20 0 BHADMO Cc1cc(F)ccc1C[N@H+](C)[C@@H]1C=CCCC1 ZINC000488009551 533877456 /nfs/dbraw/zinc/87/74/56/533877456.db2.gz NOBCUOYWPAGDHA-OAHLLOKOSA-N 1 1 233.330 3.675 20 0 BHADMO Cc1ccccc1C[C@H](C)[N@@H+](C)CC1CCC1 ZINC000488031276 225343335 /nfs/dbraw/zinc/34/33/35/225343335.db2.gz KSRZJOPZUPLIFC-AWEZNQCLSA-N 1 1 231.383 3.658 20 0 BHADMO Cc1ccccc1C[C@@H](C)[N@@H+](C)CC1CCC1 ZINC000488031277 225342132 /nfs/dbraw/zinc/34/21/32/225342132.db2.gz KSRZJOPZUPLIFC-CQSZACIVSA-N 1 1 231.383 3.658 20 0 BHADMO Cc1[nH+]ccn1Cc1ccc(C2CCC2)cc1 ZINC000488147526 225351257 /nfs/dbraw/zinc/35/12/57/225351257.db2.gz JGCXBEUDONZCKL-UHFFFAOYSA-N 1 1 226.323 3.507 20 0 BHADMO Cc1cccc([C@H](C)[N@H+]2CCSC[C@@H](C)C2)c1 ZINC000488163512 225351334 /nfs/dbraw/zinc/35/13/34/225351334.db2.gz OTXUJMRIYIWCGJ-KBPBESRZSA-N 1 1 249.423 3.741 20 0 BHADMO Cc1cccc([C@H](C)[N@H+]2CCSC[C@H](C)C2)c1 ZINC000488163514 225352475 /nfs/dbraw/zinc/35/24/75/225352475.db2.gz OTXUJMRIYIWCGJ-KGLIPLIRSA-N 1 1 249.423 3.741 20 0 BHADMO Cc1cccc([C@@H](C)[N@H+]2CCSC[C@@H](C)C2)c1 ZINC000488163516 225351703 /nfs/dbraw/zinc/35/17/03/225351703.db2.gz OTXUJMRIYIWCGJ-UONOGXRCSA-N 1 1 249.423 3.741 20 0 BHADMO Cc1cccc([C@@H](C)[N@H+]2CCSC[C@H](C)C2)c1 ZINC000488163517 225350959 /nfs/dbraw/zinc/35/09/59/225350959.db2.gz OTXUJMRIYIWCGJ-ZIAGYGMSSA-N 1 1 249.423 3.741 20 0 BHADMO Cc1ccccc1[C@@H](C)[N@H+]1CCSC[C@@H](C)C1 ZINC000488164306 225351169 /nfs/dbraw/zinc/35/11/69/225351169.db2.gz QAVHDDJBHSAMQH-GXTWGEPZSA-N 1 1 249.423 3.741 20 0 BHADMO Cc1ccccc1[C@H](C)[N@H+]1CCSC[C@@H](C)C1 ZINC000488164307 225350854 /nfs/dbraw/zinc/35/08/54/225350854.db2.gz QAVHDDJBHSAMQH-JSGCOSHPSA-N 1 1 249.423 3.741 20 0 BHADMO Cc1ccccc1[C@H](C)[N@H+]1CCSC[C@H](C)C1 ZINC000488164308 225351488 /nfs/dbraw/zinc/35/14/88/225351488.db2.gz QAVHDDJBHSAMQH-OCCSQVGLSA-N 1 1 249.423 3.741 20 0 BHADMO Cc1ccccc1[C@@H](C)[N@H+]1CCSC[C@H](C)C1 ZINC000488164310 225351144 /nfs/dbraw/zinc/35/11/44/225351144.db2.gz QAVHDDJBHSAMQH-TZMCWYRMSA-N 1 1 249.423 3.741 20 0 BHADMO CC[C@H](c1ccccc1)[N@H+]1CCSC[C@@H](C)C1 ZINC000488165930 529182161 /nfs/dbraw/zinc/18/21/61/529182161.db2.gz TXMVZNRBOWQGGG-DZGCQCFKSA-N 1 1 249.423 3.823 20 0 BHADMO CC[C@@H](c1ccccc1)[N@H+]1CCSC[C@H](C)C1 ZINC000488165931 529257276 /nfs/dbraw/zinc/25/72/76/529257276.db2.gz TXMVZNRBOWQGGG-HIFRSBDPSA-N 1 1 249.423 3.823 20 0 BHADMO CC[C@H](c1ccccc1)[N@H+]1CCSC[C@H](C)C1 ZINC000488165932 529182535 /nfs/dbraw/zinc/18/25/35/529182535.db2.gz TXMVZNRBOWQGGG-UKRRQHHQSA-N 1 1 249.423 3.823 20 0 BHADMO CC[C@@H](c1ccccc1)[N@H+]1CCSC[C@@H](C)C1 ZINC000488165933 529257328 /nfs/dbraw/zinc/25/73/28/529257328.db2.gz TXMVZNRBOWQGGG-ZFWWWQNUSA-N 1 1 249.423 3.823 20 0 BHADMO C[C@@H]1C[C@H]1C[N@H+]1CCC[C@@H]1c1cccs1 ZINC000488283962 534022227 /nfs/dbraw/zinc/02/22/27/534022227.db2.gz KODNQGQTNVOBLC-GRYCIOLGSA-N 1 1 221.369 3.541 20 0 BHADMO C[C@@H]1C[C@@H]1C[N@H+]1CCC[C@@H]1c1cccs1 ZINC000488283963 533718266 /nfs/dbraw/zinc/71/82/66/533718266.db2.gz KODNQGQTNVOBLC-IJLUTSLNSA-N 1 1 221.369 3.541 20 0 BHADMO C[C@@H]1C[C@@H]1C[N@H+]1CCC[C@H]1c1cccs1 ZINC000488283964 533720114 /nfs/dbraw/zinc/72/01/14/533720114.db2.gz KODNQGQTNVOBLC-UTUOFQBUSA-N 1 1 221.369 3.541 20 0 BHADMO C[C@@H]1C[C@H]1C[N@H+]1CCC[C@H]1c1cccs1 ZINC000488283965 229181216 /nfs/dbraw/zinc/18/12/16/229181216.db2.gz KODNQGQTNVOBLC-WOPDTQHZSA-N 1 1 221.369 3.541 20 0 BHADMO CC[N@H+](Cc1ccc(Cl)s1)C[C@H]1C[C@H]1C ZINC000488286113 528786893 /nfs/dbraw/zinc/78/68/93/528786893.db2.gz OXUUFHZSRCJDHY-NXEZZACHSA-N 1 1 243.803 3.879 20 0 BHADMO CC[N@H+](Cc1ccc(Cl)s1)C[C@@H]1C[C@@H]1C ZINC000488286114 528785810 /nfs/dbraw/zinc/78/58/10/528785810.db2.gz OXUUFHZSRCJDHY-UWVGGRQHSA-N 1 1 243.803 3.879 20 0 BHADMO CC[N@H+](Cc1ccc(Cl)s1)C[C@H]1C[C@@H]1C ZINC000488286115 528786421 /nfs/dbraw/zinc/78/64/21/528786421.db2.gz OXUUFHZSRCJDHY-VHSXEESVSA-N 1 1 243.803 3.879 20 0 BHADMO CC[N@H+](Cc1ccc(Cl)s1)C[C@@H]1C[C@H]1C ZINC000488286116 528787209 /nfs/dbraw/zinc/78/72/09/528787209.db2.gz OXUUFHZSRCJDHY-ZJUUUORDSA-N 1 1 243.803 3.879 20 0 BHADMO CC1(C)CC[N@@H+](Cc2cc3ccc(F)cc3[nH]2)C1 ZINC000488286431 529009827 /nfs/dbraw/zinc/00/98/27/529009827.db2.gz AIQOGEKSZGRQOS-UHFFFAOYSA-N 1 1 246.329 3.539 20 0 BHADMO CC[N@@H+](Cc1cc2ccc(F)cc2[nH]1)C(C)C ZINC000488286490 528768992 /nfs/dbraw/zinc/76/89/92/528768992.db2.gz AUHLAFNFIDNQEM-UHFFFAOYSA-N 1 1 234.318 3.537 20 0 BHADMO C[C@H](c1c(F)cccc1F)[N@@H+](C)C[C@H]1C[C@H]1C ZINC000488288072 225361750 /nfs/dbraw/zinc/36/17/50/225361750.db2.gz DAFZZPQGHOBSNS-GMTAPVOTSA-N 1 1 239.309 3.614 20 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DFRKVFQBKAWDDM-NFAWXSAZSA-N 1 1 247.382 3.734 20 0 BHADMO CC[N@@H+](C[C@@H]1C[C@@H]1C)[C@@H](C)c1cccc(OC)c1 ZINC000488288135 219872551 /nfs/dbraw/zinc/87/25/51/219872551.db2.gz DFRKVFQBKAWDDM-YDHLFZDLSA-N 1 1 247.382 3.734 20 0 BHADMO CC(C)[C@@H](C)[N@@H+](C)Cc1cc2ccc(F)cc2[nH]1 ZINC000488288592 528407515 /nfs/dbraw/zinc/40/75/15/528407515.db2.gz CYCBWFAIHVCGTD-LLVKDONJSA-N 1 1 248.345 3.783 20 0 BHADMO CC(C)[C@H](C)[N@@H+](C)Cc1cc2ccc(F)cc2[nH]1 ZINC000488288598 528959186 /nfs/dbraw/zinc/95/91/86/528959186.db2.gz CYCBWFAIHVCGTD-NSHDSACASA-N 1 1 248.345 3.783 20 0 BHADMO C[C@@H](c1ccccc1Cl)[N@@H+](C)C[C@H]1C[C@H]1C ZINC000488288628 225360993 /nfs/dbraw/zinc/36/09/93/225360993.db2.gz DTMCHDMALSXJLE-GRYCIOLGSA-N 1 1 237.774 3.989 20 0 BHADMO C[C@H](c1ccccc1Cl)[N@@H+](C)C[C@H]1C[C@H]1C ZINC000488288639 534139288 /nfs/dbraw/zinc/13/92/88/534139288.db2.gz DTMCHDMALSXJLE-IJLUTSLNSA-N 1 1 237.774 3.989 20 0 BHADMO C[C@H](c1ccccc1Cl)[N@@H+](C)C[C@@H]1C[C@H]1C ZINC000488288642 534138819 /nfs/dbraw/zinc/13/88/19/534138819.db2.gz DTMCHDMALSXJLE-UTUOFQBUSA-N 1 1 237.774 3.989 20 0 BHADMO C[C@@H](c1ccccc1Cl)[N@@H+](C)C[C@@H]1C[C@H]1C ZINC000488288644 225361813 /nfs/dbraw/zinc/36/18/13/225361813.db2.gz DTMCHDMALSXJLE-WOPDTQHZSA-N 1 1 237.774 3.989 20 0 BHADMO Cc1ccc([C@@H]2CCC[N@@H+]2C[C@H]2C[C@H]2C)cc1 ZINC000488288646 225361269 /nfs/dbraw/zinc/36/12/69/225361269.db2.gz UBIHJZZMBYREQV-BMFZPTHFSA-N 1 1 229.367 3.788 20 0 BHADMO Cc1ccc([C@@H]2CCC[N@@H+]2C[C@@H]2C[C@@H]2C)cc1 ZINC000488288649 225361414 /nfs/dbraw/zinc/36/14/14/225361414.db2.gz UBIHJZZMBYREQV-BPUTZDHNSA-N 1 1 229.367 3.788 20 0 BHADMO Cc1ccc([C@@H]2CCC[N@@H+]2C[C@H]2C[C@@H]2C)cc1 ZINC000488288652 225361108 /nfs/dbraw/zinc/36/11/08/225361108.db2.gz UBIHJZZMBYREQV-IMJJTQAJSA-N 1 1 229.367 3.788 20 0 BHADMO Cc1ccc([C@@H]2CCC[N@@H+]2C[C@@H]2C[C@H]2C)cc1 ZINC000488288655 225361499 /nfs/dbraw/zinc/36/14/99/225361499.db2.gz UBIHJZZMBYREQV-KBMXLJTQSA-N 1 1 229.367 3.788 20 0 BHADMO C[C@@H]1C[C@H]1C[N@@H+]1CC=C(c2ccc(F)cc2)CC1 ZINC000488291410 534017698 /nfs/dbraw/zinc/01/76/98/534017698.db2.gz XRAYOEPFHPDOPY-DOMZBBRYSA-N 1 1 245.341 3.571 20 0 BHADMO C[C@@H]1C[C@@H]1C[N@@H+]1CC=C(c2ccc(F)cc2)CC1 ZINC000488291411 533716782 /nfs/dbraw/zinc/71/67/82/533716782.db2.gz XRAYOEPFHPDOPY-IUODEOHRSA-N 1 1 245.341 3.571 20 0 BHADMO C[C@H]1C[C@@H]1C[N@@H+]1CC=C(c2ccc(F)cc2)CC1 ZINC000488291412 225361247 /nfs/dbraw/zinc/36/12/47/225361247.db2.gz XRAYOEPFHPDOPY-SWLSCSKDSA-N 1 1 245.341 3.571 20 0 BHADMO C[C@H]1C[C@H]1C[N@@H+]1CC=C(c2ccc(F)cc2)CC1 ZINC000488291413 225360549 /nfs/dbraw/zinc/36/05/49/225360549.db2.gz XRAYOEPFHPDOPY-WFASDCNBSA-N 1 1 245.341 3.571 20 0 BHADMO Cc1cc([NH+]2CCCC2)ccc1NC[C@H]1C[C@@H]1C ZINC000488291504 225361279 /nfs/dbraw/zinc/36/12/79/225361279.db2.gz HLMGMVOEIYZMKI-GXTWGEPZSA-N 1 1 244.382 3.663 20 0 BHADMO Cc1cc([NH+]2CCCC2)ccc1NC[C@@H]1C[C@@H]1C ZINC000488291505 225361599 /nfs/dbraw/zinc/36/15/99/225361599.db2.gz HLMGMVOEIYZMKI-JSGCOSHPSA-N 1 1 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C[C@H](c1cc(F)ccc1F)[N@@H+](C)C[C@@H]1C[C@H]1C ZINC000488314404 225368312 /nfs/dbraw/zinc/36/83/12/225368312.db2.gz YNMAIQBACBEDAQ-MXWKQRLJSA-N 1 1 239.309 3.614 20 0 BHADMO C[C@@H](c1cc(F)ccc1F)[N@@H+](C)C[C@H]1C[C@H]1C ZINC000488314405 534042427 /nfs/dbraw/zinc/04/24/27/534042427.db2.gz YNMAIQBACBEDAQ-OUAUKWLOSA-N 1 1 239.309 3.614 20 0 BHADMO C[C@@H](c1cc(F)ccc1F)[N@@H+](C)C[C@@H]1C[C@H]1C ZINC000488314406 534042721 /nfs/dbraw/zinc/04/27/21/534042721.db2.gz YNMAIQBACBEDAQ-VWYCJHECSA-N 1 1 239.309 3.614 20 0 BHADMO CCC[N@@H+](Cc1cc2ccc(F)cc2[nH]1)C1CC1 ZINC000488316259 398060996 /nfs/dbraw/zinc/06/09/96/398060996.db2.gz GBLPVYZFJILURA-UHFFFAOYSA-N 1 1 246.329 3.681 20 0 BHADMO C[C@@H]1C[C@H]1C[N@@H+](C)Cc1csc2ccccc12 ZINC000488317186 534019677 /nfs/dbraw/zinc/01/96/77/534019677.db2.gz SAAFPCWTTIYISU-NEPJUHHUSA-N 1 1 245.391 3.989 20 0 BHADMO C[C@H]1C[C@@H]1C[N@@H+](C)Cc1csc2ccccc12 ZINC000488317187 225371003 /nfs/dbraw/zinc/37/10/03/225371003.db2.gz SAAFPCWTTIYISU-NWDGAFQWSA-N 1 1 245.391 3.989 20 0 BHADMO C[C@H]1C[C@H]1C[N@@H+](C)Cc1csc2ccccc12 ZINC000488317188 225371632 /nfs/dbraw/zinc/37/16/32/225371632.db2.gz SAAFPCWTTIYISU-RYUDHWBXSA-N 1 1 245.391 3.989 20 0 BHADMO C[C@@H]1C[C@@H]1C[N@@H+](C)Cc1csc2ccccc12 ZINC000488317189 533714303 /nfs/dbraw/zinc/71/43/03/533714303.db2.gz SAAFPCWTTIYISU-VXGBXAGGSA-N 1 1 245.391 3.989 20 0 BHADMO C[C@@H]1C[C@@H]1C[N@@H+](Cc1ccco1)C1CCCC1 ZINC000488317338 533715651 /nfs/dbraw/zinc/71/56/51/533715651.db2.gz UXAORXCNZNHEDV-CHWSQXEVSA-N 1 1 233.355 3.680 20 0 BHADMO C[C@@H]1C[C@H]1C[N@@H+](Cc1ccco1)C1CCCC1 ZINC000488317339 534018780 /nfs/dbraw/zinc/01/87/80/534018780.db2.gz UXAORXCNZNHEDV-OLZOCXBDSA-N 1 1 233.355 3.680 20 0 BHADMO C[C@H]1C[C@@H]1C[N@@H+](Cc1ccco1)C1CCCC1 ZINC000488317340 225371747 /nfs/dbraw/zinc/37/17/47/225371747.db2.gz UXAORXCNZNHEDV-QWHCGFSZSA-N 1 1 233.355 3.680 20 0 BHADMO C[C@H]1C[C@H]1C[N@@H+](Cc1ccco1)C1CCCC1 ZINC000488317341 225372078 /nfs/dbraw/zinc/37/20/78/225372078.db2.gz UXAORXCNZNHEDV-STQMWFEESA-N 1 1 233.355 3.680 20 0 BHADMO CC1(C)CCC[N@H+]1Cc1cc2ccc(F)cc2[nH]1 ZINC000488317689 528943947 /nfs/dbraw/zinc/94/39/47/528943947.db2.gz VSOKTIDFGHZCOT-UHFFFAOYSA-N 1 1 246.329 3.681 20 0 BHADMO Cc1ccc(C[C@H](C)[N@@H+](C)C[C@@H]2C[C@@H]2C)cc1 ZINC000488319235 225371638 /nfs/dbraw/zinc/37/16/38/225371638.db2.gz BXEVVHNSVVJRTA-DZKIICNBSA-N 1 1 231.383 3.514 20 0 BHADMO Cc1ccc(C[C@H](C)[N@@H+](C)C[C@H]2C[C@H]2C)cc1 ZINC000488319238 225370786 /nfs/dbraw/zinc/37/07/86/225370786.db2.gz BXEVVHNSVVJRTA-IJEWVQPXSA-N 1 1 231.383 3.514 20 0 BHADMO Cc1ccc(C[C@H](C)[N@@H+](C)C[C@H]2C[C@@H]2C)cc1 ZINC000488319239 225371970 /nfs/dbraw/zinc/37/19/70/225371970.db2.gz BXEVVHNSVVJRTA-OFQRWUPVSA-N 1 1 231.383 3.514 20 0 BHADMO Cc1ccc(C[C@H](C)[N@@H+](C)C[C@@H]2C[C@H]2C)cc1 ZINC000488319241 225370548 /nfs/dbraw/zinc/37/05/48/225370548.db2.gz BXEVVHNSVVJRTA-YCPHGPKFSA-N 1 1 231.383 3.514 20 0 BHADMO C[C@@H]1CCCC[N@H+]1Cc1cc2ccc(F)cc2[nH]1 ZINC000488319433 534162385 /nfs/dbraw/zinc/16/23/85/534162385.db2.gz CNAFTLKYRNVAIC-LLVKDONJSA-N 1 1 246.329 3.681 20 0 BHADMO C[C@H]1CCCC[N@H+]1Cc1cc2ccc(F)cc2[nH]1 ZINC000488319435 225371410 /nfs/dbraw/zinc/37/14/10/225371410.db2.gz CNAFTLKYRNVAIC-NSHDSACASA-N 1 1 246.329 3.681 20 0 BHADMO C[N@@H+](Cc1cc2ccc(F)cc2[nH]1)CC(C)(C)C ZINC000488322121 529980672 /nfs/dbraw/zinc/98/06/72/529980672.db2.gz GGWYGEAIGYZVCI-UHFFFAOYSA-N 1 1 248.345 3.785 20 0 BHADMO C[N@H+](Cc1cc2ccc(F)cc2[nH]1)CC1CCC1 ZINC000488324813 529980780 /nfs/dbraw/zinc/98/07/80/529980780.db2.gz VVBINFWTDOSHGD-UHFFFAOYSA-N 1 1 246.329 3.539 20 0 BHADMO Cc1ccccc1[C@@H]1CCC[N@@H+]1C[C@@H]1C[C@@H]1C ZINC000488325549 225374018 /nfs/dbraw/zinc/37/40/18/225374018.db2.gz WRFLHPMVWCVXKC-DZKIICNBSA-N 1 1 229.367 3.788 20 0 BHADMO Cc1ccccc1[C@@H]1CCC[N@@H+]1C[C@H]1C[C@H]1C ZINC000488325550 225374080 /nfs/dbraw/zinc/37/40/80/225374080.db2.gz WRFLHPMVWCVXKC-FMKPAKJESA-N 1 1 229.367 3.788 20 0 BHADMO Cc1ccccc1[C@@H]1CCC[N@@H+]1C[C@H]1C[C@@H]1C ZINC000488325551 225372808 /nfs/dbraw/zinc/37/28/08/225372808.db2.gz WRFLHPMVWCVXKC-LZWOXQAQSA-N 1 1 229.367 3.788 20 0 BHADMO Cc1ccccc1[C@@H]1CCC[N@@H+]1C[C@@H]1C[C@H]1C ZINC000488325552 385748750 /nfs/dbraw/zinc/74/87/50/385748750.db2.gz WRFLHPMVWCVXKC-YCPHGPKFSA-N 1 1 229.367 3.788 20 0 BHADMO C[C@@H]1C[C@@H]1C[N@H+]1CCC[C@H]1c1cccc(F)c1 ZINC000488325776 533718182 /nfs/dbraw/zinc/71/81/82/533718182.db2.gz FPMYCALRVJIHAB-KYOSRNDESA-N 1 1 233.330 3.619 20 0 BHADMO C[C@@H]1C[C@H]1C[N@H+]1CCC[C@@H]1c1cccc(F)c1 ZINC000488325778 534020371 /nfs/dbraw/zinc/02/03/71/534020371.db2.gz FPMYCALRVJIHAB-OSAQELSMSA-N 1 1 233.330 3.619 20 0 BHADMO C[C@@H]1C[C@@H]1C[N@H+]1CCC[C@@H]1c1cccc(F)c1 ZINC000488325779 533718039 /nfs/dbraw/zinc/71/80/39/533718039.db2.gz FPMYCALRVJIHAB-UXIGCNINSA-N 1 1 233.330 3.619 20 0 BHADMO C[C@@H]1C[C@H]1C[N@H+]1CCC[C@H]1c1cccc(F)c1 ZINC000488325781 534020698 /nfs/dbraw/zinc/02/06/98/534020698.db2.gz FPMYCALRVJIHAB-ZLDLUXBVSA-N 1 1 233.330 3.619 20 0 BHADMO CCCC[N@@H+](CC)Cc1cc2ccc(F)cc2[nH]1 ZINC000488326166 528395317 /nfs/dbraw/zinc/39/53/17/528395317.db2.gz LAZDNQGMLOSACK-UHFFFAOYSA-N 1 1 248.345 3.929 20 0 BHADMO C[C@@H](C1CC1)[N@@H+](C)Cc1cc2ccc(F)cc2[nH]1 ZINC000488326479 225373242 /nfs/dbraw/zinc/37/32/42/225373242.db2.gz USHPAUJXDGGIMH-JTQLQIEISA-N 1 1 246.329 3.537 20 0 BHADMO C[C@H](C1CC1)[N@@H+](C)Cc1cc2ccc(F)cc2[nH]1 ZINC000488326481 225373474 /nfs/dbraw/zinc/37/34/74/225373474.db2.gz USHPAUJXDGGIMH-SNVBAGLBSA-N 1 1 246.329 3.537 20 0 BHADMO C[C@@H]1CC[N@@H+](Cc2cc3ccc(F)cc3[nH]2)[C@@H]1C ZINC000488329725 534036779 /nfs/dbraw/zinc/03/67/79/534036779.db2.gz GTWXBEHROSFGHL-GHMZBOCLSA-N 1 1 246.329 3.537 20 0 BHADMO C[C@@H]1CC[N@@H+](Cc2cc3ccc(F)cc3[nH]2)[C@H]1C ZINC000488329726 534037310 /nfs/dbraw/zinc/03/73/10/534037310.db2.gz GTWXBEHROSFGHL-MNOVXSKESA-N 1 1 246.329 3.537 20 0 BHADMO C[C@H]1CC[N@@H+](Cc2cc3ccc(F)cc3[nH]2)[C@H]1C ZINC000488329727 225375590 /nfs/dbraw/zinc/37/55/90/225375590.db2.gz GTWXBEHROSFGHL-QWRGUYRKSA-N 1 1 246.329 3.537 20 0 BHADMO C[C@@H]1[C@@H](C)CC[N@H+]1Cc1cc2ccc(F)cc2[nH]1 ZINC000488329728 534233086 /nfs/dbraw/zinc/23/30/86/534233086.db2.gz GTWXBEHROSFGHL-WDEREUQCSA-N 1 1 246.329 3.537 20 0 BHADMO C[N@@H+](CCC1CC1)Cc1cc2ccc(F)cc2[nH]1 ZINC000488331577 529876658 /nfs/dbraw/zinc/87/66/58/529876658.db2.gz MQGYFXIEVMORQZ-UHFFFAOYSA-N 1 1 246.329 3.539 20 0 BHADMO C[C@@H]1C[C@H]1C[N@@H+](C1CC1)[C@@H]1CCc2ccccc21 ZINC000488333976 534018630 /nfs/dbraw/zinc/01/86/30/534018630.db2.gz PYUINQYZUBYRMG-HACGYAERSA-N 1 1 241.378 3.794 20 0 BHADMO C[C@@H]1C[C@H]1C[N@@H+](C1CC1)[C@H]1CCc2ccccc21 ZINC000488333979 534017863 /nfs/dbraw/zinc/01/78/63/534017863.db2.gz PYUINQYZUBYRMG-IFIJOSMWSA-N 1 1 241.378 3.794 20 0 BHADMO C[C@@H]1C[C@@H]1C[N@@H+](C1CC1)[C@H]1CCc2ccccc21 ZINC000488333980 533714490 /nfs/dbraw/zinc/71/44/90/533714490.db2.gz PYUINQYZUBYRMG-MRRJBJDNSA-N 1 1 241.378 3.794 20 0 BHADMO C[C@@H]1C[C@@H]1C[N@@H+](C1CC1)[C@@H]1CCc2ccccc21 ZINC000488333981 533714333 /nfs/dbraw/zinc/71/43/33/533714333.db2.gz PYUINQYZUBYRMG-SUYBPPKGSA-N 1 1 241.378 3.794 20 0 BHADMO CC[C@H](Cc1ccccc1)[N@@H+](C)C[C@@H]1C[C@@H]1C ZINC000488334165 529427369 /nfs/dbraw/zinc/42/73/69/529427369.db2.gz MQFVEEFSGMDDBC-CWRNSKLLSA-N 1 1 231.383 3.596 20 0 BHADMO CC[C@H](Cc1ccccc1)[N@@H+](C)C[C@H]1C[C@H]1C ZINC000488334167 529427555 /nfs/dbraw/zinc/42/75/55/529427555.db2.gz MQFVEEFSGMDDBC-FVQBIDKESA-N 1 1 231.383 3.596 20 0 BHADMO CC[C@H](Cc1ccccc1)[N@@H+](C)C[C@H]1C[C@@H]1C ZINC000488334169 529427448 /nfs/dbraw/zinc/42/74/48/529427448.db2.gz MQFVEEFSGMDDBC-NUEKZKHPSA-N 1 1 231.383 3.596 20 0 BHADMO CC[C@H](Cc1ccccc1)[N@@H+](C)C[C@@H]1C[C@H]1C ZINC000488334170 529427663 /nfs/dbraw/zinc/42/76/63/529427663.db2.gz MQFVEEFSGMDDBC-VNQPRFMTSA-N 1 1 231.383 3.596 20 0 BHADMO C[C@@H]1C[C@H]1C[N@H+]1CCCCC[C@@H]1c1ccco1 ZINC000488336561 534020665 /nfs/dbraw/zinc/02/06/65/534020665.db2.gz ZNCDNWROQFLRCO-HZSPNIEDSA-N 1 1 233.355 3.853 20 0 BHADMO C[C@@H]1C[C@@H]1C[N@H+]1CCCCC[C@H]1c1ccco1 ZINC000488336562 533715579 /nfs/dbraw/zinc/71/55/79/533715579.db2.gz ZNCDNWROQFLRCO-MCIONIFRSA-N 1 1 233.355 3.853 20 0 BHADMO C[C@@H]1C[C@@H]1C[N@H+]1CCCCC[C@@H]1c1ccco1 ZINC000488336563 533716246 /nfs/dbraw/zinc/71/62/46/533716246.db2.gz ZNCDNWROQFLRCO-MGPQQGTHSA-N 1 1 233.355 3.853 20 0 BHADMO C[C@@H]1C[C@H]1C[N@H+]1CCCCC[C@H]1c1ccco1 ZINC000488336564 534020434 /nfs/dbraw/zinc/02/04/34/534020434.db2.gz ZNCDNWROQFLRCO-RDBSUJKOSA-N 1 1 233.355 3.853 20 0 BHADMO C[C@@H]1C[C@@H]1C[N@H+]1CCC[C@H]1c1ccc(F)cc1 ZINC000488338850 533720190 /nfs/dbraw/zinc/72/01/90/533720190.db2.gz WRIMHCHAWLYUTR-KYOSRNDESA-N 1 1 233.330 3.619 20 0 BHADMO C[C@@H]1C[C@H]1C[N@H+]1CCC[C@@H]1c1ccc(F)cc1 ZINC000488338852 534020679 /nfs/dbraw/zinc/02/06/79/534020679.db2.gz WRIMHCHAWLYUTR-OSAQELSMSA-N 1 1 233.330 3.619 20 0 BHADMO C[C@@H]1C[C@@H]1C[N@H+]1CCC[C@@H]1c1ccc(F)cc1 ZINC000488338854 533718131 /nfs/dbraw/zinc/71/81/31/533718131.db2.gz WRIMHCHAWLYUTR-UXIGCNINSA-N 1 1 233.330 3.619 20 0 BHADMO C[C@@H]1C[C@H]1C[N@H+]1CCC[C@H]1c1ccc(F)cc1 ZINC000488338855 534020939 /nfs/dbraw/zinc/02/09/39/534020939.db2.gz WRIMHCHAWLYUTR-ZLDLUXBVSA-N 1 1 233.330 3.619 20 0 BHADMO CC(C)[C@@H]1CC[N@H+]1Cc1cc2ccc(F)cc2[nH]1 ZINC000488339815 528704780 /nfs/dbraw/zinc/70/47/80/528704780.db2.gz YAYOSXYGBRECAL-HNNXBMFYSA-N 1 1 246.329 3.537 20 0 BHADMO CC(C)[C@H]1CC[N@H+]1Cc1cc2ccc(F)cc2[nH]1 ZINC000488339816 527805398 /nfs/dbraw/zinc/80/53/98/527805398.db2.gz YAYOSXYGBRECAL-OAHLLOKOSA-N 1 1 246.329 3.537 20 0 BHADMO CC[C@@H](C)C[N@@H+](C)Cc1cc2ccc(F)cc2[nH]1 ZINC000488340619 529314464 /nfs/dbraw/zinc/31/44/64/529314464.db2.gz SGNLBDQUIVHEHV-LLVKDONJSA-N 1 1 248.345 3.785 20 0 BHADMO CC[C@H](C)C[N@@H+](C)Cc1cc2ccc(F)cc2[nH]1 ZINC000488340620 529650957 /nfs/dbraw/zinc/65/09/57/529650957.db2.gz SGNLBDQUIVHEHV-NSHDSACASA-N 1 1 248.345 3.785 20 0 BHADMO C[C@@H]1C[C@@H]1C[N@H+]1C[C@@H](c2ccccc2)C[C@@H]1C ZINC000488342264 225380664 /nfs/dbraw/zinc/38/06/64/225380664.db2.gz BBMQDULUKSFJPF-CLWVCHIJSA-N 1 1 229.367 3.520 20 0 BHADMO C[C@@H]1C[C@@H]1C[N@H+]1C[C@H](c2ccccc2)C[C@@H]1C ZINC000488342265 225382314 /nfs/dbraw/zinc/38/23/14/225382314.db2.gz BBMQDULUKSFJPF-OCVGTWLNSA-N 1 1 229.367 3.520 20 0 BHADMO C[C@@H]1C[C@@H]1C[N@H+]1C[C@H](c2ccccc2)C[C@H]1C ZINC000488342266 225381976 /nfs/dbraw/zinc/38/19/76/225381976.db2.gz BBMQDULUKSFJPF-RRCSTGOVSA-N 1 1 229.367 3.520 20 0 BHADMO C[C@@H]1C[C@@H]1C[N@H+]1C[C@@H](c2ccccc2)C[C@H]1C ZINC000488342267 225381289 /nfs/dbraw/zinc/38/12/89/225381289.db2.gz BBMQDULUKSFJPF-XOUADPBQSA-N 1 1 229.367 3.520 20 0 BHADMO Cc1cccc([C@@H]2CCC[N@@H+]2C[C@H]2C[C@H]2C)c1 ZINC000488342624 225380960 /nfs/dbraw/zinc/38/09/60/225380960.db2.gz DTHVNPBVRLAJIU-BMFZPTHFSA-N 1 1 229.367 3.788 20 0 BHADMO Cc1cccc([C@@H]2CCC[N@@H+]2C[C@@H]2C[C@@H]2C)c1 ZINC000488342625 225382027 /nfs/dbraw/zinc/38/20/27/225382027.db2.gz DTHVNPBVRLAJIU-BPUTZDHNSA-N 1 1 229.367 3.788 20 0 BHADMO Cc1cccc([C@@H]2CCC[N@@H+]2C[C@H]2C[C@@H]2C)c1 ZINC000488342626 225382440 /nfs/dbraw/zinc/38/24/40/225382440.db2.gz DTHVNPBVRLAJIU-IMJJTQAJSA-N 1 1 229.367 3.788 20 0 BHADMO Cc1cccc([C@@H]2CCC[N@@H+]2C[C@@H]2C[C@H]2C)c1 ZINC000488342627 225381220 /nfs/dbraw/zinc/38/12/20/225381220.db2.gz DTHVNPBVRLAJIU-KBMXLJTQSA-N 1 1 229.367 3.788 20 0 BHADMO C[C@@H]1CC[C@H](C)[N@@H+]1Cc1cc2ccc(F)cc2[nH]1 ZINC000488348001 534228134 /nfs/dbraw/zinc/22/81/34/534228134.db2.gz ADWSJWSYJSXACA-PHIMTYICSA-N 1 1 246.329 3.680 20 0 BHADMO C[C@@H]1C[C@H]1C[N@H+]1CC[C@@H](C)C[C@H]1c1ccco1 ZINC000488348059 225380825 /nfs/dbraw/zinc/38/08/25/225380825.db2.gz ASBJNSLBYGQUBD-MQYQWHSLSA-N 1 1 233.355 3.709 20 0 BHADMO C[C@H]1C[C@H]1C[N@H+]1CC[C@@H](C)C[C@H]1c1ccco1 ZINC000488348060 225381094 /nfs/dbraw/zinc/38/10/94/225381094.db2.gz ASBJNSLBYGQUBD-RFGFWPKPSA-N 1 1 233.355 3.709 20 0 BHADMO C[C@@H]1C[C@H]1C[N@H+]1CC[C@@H](C)C[C@@H]1c1ccco1 ZINC000488348061 225381477 /nfs/dbraw/zinc/38/14/77/225381477.db2.gz ASBJNSLBYGQUBD-YIYPIFLZSA-N 1 1 233.355 3.709 20 0 BHADMO C[C@H]1C[C@H]1C[N@H+]1CC[C@@H](C)C[C@@H]1c1ccco1 ZINC000488348062 225380919 /nfs/dbraw/zinc/38/09/19/225380919.db2.gz ASBJNSLBYGQUBD-ZOBORPQBSA-N 1 1 233.355 3.709 20 0 BHADMO C[C@H]1C[C@H]1C[N@@H+](C)Cc1cc2ccccc2o1 ZINC000488348622 225380951 /nfs/dbraw/zinc/38/09/51/225380951.db2.gz BBNROERICCQGOB-AAEUAGOBSA-N 1 1 229.323 3.521 20 0 BHADMO C[C@@H]1C[C@@H]1C[N@@H+](C)Cc1cc2ccccc2o1 ZINC000488348625 533714707 /nfs/dbraw/zinc/71/47/07/533714707.db2.gz BBNROERICCQGOB-DGCLKSJQSA-N 1 1 229.323 3.521 20 0 BHADMO C[C@H]1C[C@@H]1C[N@@H+](C)Cc1cc2ccccc2o1 ZINC000488348627 225381171 /nfs/dbraw/zinc/38/11/71/225381171.db2.gz BBNROERICCQGOB-WCQYABFASA-N 1 1 229.323 3.521 20 0 BHADMO C[C@@H]1C[C@H]1C[N@@H+](C)Cc1cc2ccccc2o1 ZINC000488348629 534019366 /nfs/dbraw/zinc/01/93/66/534019366.db2.gz BBNROERICCQGOB-YPMHNXCESA-N 1 1 229.323 3.521 20 0 BHADMO C[C@@H](c1cccc(Cl)c1)[N@@H+](C)C[C@@H]1C[C@H]1C ZINC000488348714 534086018 /nfs/dbraw/zinc/08/60/18/534086018.db2.gz BLXMRYXMTSPKJI-MDZLAQPJSA-N 1 1 237.774 3.989 20 0 BHADMO C[C@H](c1cccc(Cl)c1)[N@@H+](C)C[C@H]1C[C@H]1C ZINC000488348715 534128285 /nfs/dbraw/zinc/12/82/85/534128285.db2.gz BLXMRYXMTSPKJI-NQBHXWOUSA-N 1 1 237.774 3.989 20 0 BHADMO C[C@@H](c1cccc(Cl)c1)[N@@H+](C)C[C@H]1C[C@H]1C ZINC000488348716 534085825 /nfs/dbraw/zinc/08/58/25/534085825.db2.gz BLXMRYXMTSPKJI-NTZNESFSSA-N 1 1 237.774 3.989 20 0 BHADMO C[C@H](c1cccc(Cl)c1)[N@@H+](C)C[C@@H]1C[C@H]1C ZINC000488348718 534127213 /nfs/dbraw/zinc/12/72/13/534127213.db2.gz BLXMRYXMTSPKJI-WZRBSPASSA-N 1 1 237.774 3.989 20 0 BHADMO CC[N@@H+](Cc1cc2ccc(F)cc2[nH]1)C1CCC1 ZINC000488349420 528768614 /nfs/dbraw/zinc/76/86/14/528768614.db2.gz OVLROICUDODQKP-UHFFFAOYSA-N 1 1 246.329 3.681 20 0 BHADMO C[C@@H]1C[C@H]1C[N@H+]1CCC[C@@H]1c1ccsc1 ZINC000488349993 534021493 /nfs/dbraw/zinc/02/14/93/534021493.db2.gz PCAIAWZPMWIQPR-KGYLQXTDSA-N 1 1 221.369 3.541 20 0 BHADMO C[C@@H]1C[C@@H]1C[N@H+]1CCC[C@@H]1c1ccsc1 ZINC000488349994 533718886 /nfs/dbraw/zinc/71/88/86/533718886.db2.gz PCAIAWZPMWIQPR-RAIGVLPGSA-N 1 1 221.369 3.541 20 0 BHADMO C[C@@H]1C[C@@H]1C[N@H+]1CCC[C@H]1c1ccsc1 ZINC000488349995 533717986 /nfs/dbraw/zinc/71/79/86/533717986.db2.gz PCAIAWZPMWIQPR-RTXFEEFZSA-N 1 1 221.369 3.541 20 0 BHADMO C[C@@H]1C[C@H]1C[N@H+]1CCC[C@H]1c1ccsc1 ZINC000488349996 225383502 /nfs/dbraw/zinc/38/35/02/225383502.db2.gz PCAIAWZPMWIQPR-WXHSDQCUSA-N 1 1 221.369 3.541 20 0 BHADMO CC[N@H+](Cc1cc2ccc(F)cc2[nH]1)CC1CC1 ZINC000488355928 528768082 /nfs/dbraw/zinc/76/80/82/528768082.db2.gz XZLHTZYMFUPMSY-UHFFFAOYSA-N 1 1 246.329 3.539 20 0 BHADMO Cc1ccc([C@@H]2CCC[N@@H+]2C[C@@H]2C[C@@H]2C)s1 ZINC000488357231 225385675 /nfs/dbraw/zinc/38/56/75/225385675.db2.gz VFIZPLLUDKBXMY-DRZSPHRISA-N 1 1 235.396 3.849 20 0 BHADMO Cc1ccc([C@@H]2CCC[N@@H+]2C[C@H]2C[C@H]2C)s1 ZINC000488357232 225385585 /nfs/dbraw/zinc/38/55/85/225385585.db2.gz VFIZPLLUDKBXMY-RTXFEEFZSA-N 1 1 235.396 3.849 20 0 BHADMO Cc1ccc([C@@H]2CCC[N@@H+]2C[C@H]2C[C@@H]2C)s1 ZINC000488357233 225385798 /nfs/dbraw/zinc/38/57/98/225385798.db2.gz VFIZPLLUDKBXMY-UHTWSYAYSA-N 1 1 235.396 3.849 20 0 BHADMO Cc1ccc([C@@H]2CCC[N@@H+]2C[C@@H]2C[C@H]2C)s1 ZINC000488357234 225385193 /nfs/dbraw/zinc/38/51/93/225385193.db2.gz VFIZPLLUDKBXMY-WXHSDQCUSA-N 1 1 235.396 3.849 20 0 BHADMO C[C@H](c1ccc(F)c(F)c1)[N@@H+](C)C[C@H]1C[C@H]1C ZINC000488357566 225385991 /nfs/dbraw/zinc/38/59/91/225385991.db2.gz VMKXYAILFRQDDM-CKYFFXLPSA-N 1 1 239.309 3.614 20 0 BHADMO C[C@H](c1ccc(F)c(F)c1)[N@@H+](C)C[C@@H]1C[C@H]1C ZINC000488357567 225385123 /nfs/dbraw/zinc/38/51/23/225385123.db2.gz VMKXYAILFRQDDM-FOGDFJRCSA-N 1 1 239.309 3.614 20 0 BHADMO C[C@@H](c1ccc(F)c(F)c1)[N@@H+](C)C[C@H]1C[C@H]1C ZINC000488357568 534054854 /nfs/dbraw/zinc/05/48/54/534054854.db2.gz VMKXYAILFRQDDM-JFGNBEQYSA-N 1 1 239.309 3.614 20 0 BHADMO C[C@@H](c1ccc(F)c(F)c1)[N@@H+](C)C[C@@H]1C[C@H]1C ZINC000488357569 534054946 /nfs/dbraw/zinc/05/49/46/534054946.db2.gz VMKXYAILFRQDDM-SCVCMEIPSA-N 1 1 239.309 3.614 20 0 BHADMO CC[C@@H]1CC[N@@H+](Cc2cc3ccc(F)cc3[nH]2)C1 ZINC000488357956 529327124 /nfs/dbraw/zinc/32/71/24/529327124.db2.gz QMPVXXDZMCPBFJ-LLVKDONJSA-N 1 1 246.329 3.539 20 0 BHADMO CC[C@H]1CC[N@@H+](Cc2cc3ccc(F)cc3[nH]2)C1 ZINC000488357959 529238782 /nfs/dbraw/zinc/23/87/82/529238782.db2.gz QMPVXXDZMCPBFJ-NSHDSACASA-N 1 1 246.329 3.539 20 0 BHADMO CC[C@H](C)[C@H](C)[N@@H+](C[C@@H]1C[C@@H]1C)C1CC1 ZINC000488360180 529238264 /nfs/dbraw/zinc/23/82/64/529238264.db2.gz WIROXXUPYBBJMP-CYDGBPFRSA-N 1 1 209.377 3.541 20 0 BHADMO CC[C@H](C)[C@H](C)[N@@H+](C[C@H]1C[C@H]1C)C1CC1 ZINC000488360181 529238049 /nfs/dbraw/zinc/23/80/49/529238049.db2.gz WIROXXUPYBBJMP-QNWHQSFQSA-N 1 1 209.377 3.541 20 0 BHADMO CC[C@H](C)[C@H](C)[N@@H+](C[C@@H]1C[C@H]1C)C1CC1 ZINC000488360182 529238224 /nfs/dbraw/zinc/23/82/24/529238224.db2.gz WIROXXUPYBBJMP-RNJOBUHISA-N 1 1 209.377 3.541 20 0 BHADMO CC[C@H](C)[C@H](C)[N@@H+](C[C@H]1C[C@@H]1C)C1CC1 ZINC000488360183 529238416 /nfs/dbraw/zinc/23/84/16/529238416.db2.gz WIROXXUPYBBJMP-ZDEQEGDKSA-N 1 1 209.377 3.541 20 0 BHADMO C[C@@H]1C[C@@H]1C[N@H+]1CC[C@H](c2ccccc2)[C@@H]1C ZINC000488361404 225387900 /nfs/dbraw/zinc/38/79/00/225387900.db2.gz YGJVVAKFCDEZOH-CLWVCHIJSA-N 1 1 229.367 3.520 20 0 BHADMO C[C@@H]1C[C@@H]1C[N@H+]1CC[C@@H](c2ccccc2)[C@@H]1C ZINC000488361405 533722537 /nfs/dbraw/zinc/72/25/37/533722537.db2.gz YGJVVAKFCDEZOH-OCVGTWLNSA-N 1 1 229.367 3.520 20 0 BHADMO C[C@@H]1C[C@@H]1C[N@H+]1CC[C@@H](c2ccccc2)[C@H]1C ZINC000488361407 533722270 /nfs/dbraw/zinc/72/22/70/533722270.db2.gz YGJVVAKFCDEZOH-RRCSTGOVSA-N 1 1 229.367 3.520 20 0 BHADMO C[C@@H]1C[C@@H]1C[N@H+]1CC[C@H](c2ccccc2)[C@H]1C ZINC000488361409 225387351 /nfs/dbraw/zinc/38/73/51/225387351.db2.gz YGJVVAKFCDEZOH-XOUADPBQSA-N 1 1 229.367 3.520 20 0 BHADMO CCCCOCC[N@H+]1CCC[C@@H]1CC(C)(C)C ZINC000488410234 528588891 /nfs/dbraw/zinc/58/88/91/528588891.db2.gz JHHBDTVCWGNOCX-CQSZACIVSA-N 1 1 241.419 3.704 20 0 BHADMO COc1ccc(C)[nH+]c1NC1CCC2(CC2)CC1 ZINC000488430598 225395465 /nfs/dbraw/zinc/39/54/65/225395465.db2.gz KECSZYCKOYTXAJ-UHFFFAOYSA-N 1 1 246.354 3.533 20 0 BHADMO CCc1ccc[nH+]c1NC1CCC2(CC2)CC1 ZINC000488469894 388181160 /nfs/dbraw/zinc/18/11/60/388181160.db2.gz BFHWILBLUVDWEI-UHFFFAOYSA-N 1 1 230.355 3.779 20 0 BHADMO CCC[N@@H+](CCc1cccs1)C[C@H]1C[C@H]1C ZINC000488508910 388183164 /nfs/dbraw/zinc/18/31/64/388183164.db2.gz BUKOHLFPNPUBQI-CHWSQXEVSA-N 1 1 237.412 3.659 20 0 BHADMO CCC[N@@H+](CCc1cccs1)C[C@@H]1C[C@H]1C ZINC000488508912 388183628 /nfs/dbraw/zinc/18/36/28/388183628.db2.gz BUKOHLFPNPUBQI-OLZOCXBDSA-N 1 1 237.412 3.659 20 0 BHADMO CCC[N@@H+](CCc1cccs1)C[C@H]1C[C@@H]1C ZINC000488508913 528115732 /nfs/dbraw/zinc/11/57/32/528115732.db2.gz BUKOHLFPNPUBQI-QWHCGFSZSA-N 1 1 237.412 3.659 20 0 BHADMO CCC[N@@H+](CCc1cccs1)C[C@@H]1C[C@@H]1C ZINC000488508915 388183449 /nfs/dbraw/zinc/18/34/49/388183449.db2.gz BUKOHLFPNPUBQI-STQMWFEESA-N 1 1 237.412 3.659 20 0 BHADMO CC[N@@H+](C[C@@H]1C[C@H]1C)[C@H](C)Cc1ccsc1 ZINC000488525921 388183829 /nfs/dbraw/zinc/18/38/29/388183829.db2.gz YXXBHFUVRWZIAM-BZPMIXESSA-N 1 1 237.412 3.657 20 0 BHADMO CC[N@@H+](C[C@@H]1C[C@H]1C)[C@@H](C)Cc1ccsc1 ZINC000488525922 388182748 /nfs/dbraw/zinc/18/27/48/388182748.db2.gz YXXBHFUVRWZIAM-DYEKYZERSA-N 1 1 237.412 3.657 20 0 BHADMO CC[N@@H+](C[C@@H]1C[C@@H]1C)[C@@H](C)Cc1ccsc1 ZINC000488525923 388183077 /nfs/dbraw/zinc/18/30/77/388183077.db2.gz YXXBHFUVRWZIAM-OBJOEFQTSA-N 1 1 237.412 3.657 20 0 BHADMO CC[N@@H+](C[C@@H]1C[C@@H]1C)[C@H](C)Cc1ccsc1 ZINC000488525924 388183442 /nfs/dbraw/zinc/18/34/42/388183442.db2.gz YXXBHFUVRWZIAM-SCRDCRAPSA-N 1 1 237.412 3.657 20 0 BHADMO CC[N@H+](Cc1c[nH]c2ccccc12)C[C@H]1C[C@H]1C ZINC000488548344 388186568 /nfs/dbraw/zinc/18/65/68/388186568.db2.gz UHFCZKHBNMHGBN-CHWSQXEVSA-N 1 1 242.366 3.646 20 0 BHADMO CC[N@H+](Cc1c[nH]c2ccccc12)C[C@@H]1C[C@H]1C ZINC000488548345 388186049 /nfs/dbraw/zinc/18/60/49/388186049.db2.gz UHFCZKHBNMHGBN-OLZOCXBDSA-N 1 1 242.366 3.646 20 0 BHADMO CC[N@H+](Cc1c[nH]c2ccccc12)C[C@H]1C[C@@H]1C ZINC000488548348 385828300 /nfs/dbraw/zinc/82/83/00/385828300.db2.gz UHFCZKHBNMHGBN-QWHCGFSZSA-N 1 1 242.366 3.646 20 0 BHADMO CC[N@H+](Cc1c[nH]c2ccccc12)C[C@@H]1C[C@@H]1C ZINC000488548354 385828273 /nfs/dbraw/zinc/82/82/73/385828273.db2.gz UHFCZKHBNMHGBN-STQMWFEESA-N 1 1 242.366 3.646 20 0 BHADMO Cc1ccoc1C[N@H+](C)Cc1ccc(F)cc1C ZINC000488551088 388187084 /nfs/dbraw/zinc/18/70/84/388187084.db2.gz ZXRHLCMETLHXSR-UHFFFAOYSA-N 1 1 247.313 3.668 20 0 BHADMO C[C@@H]1C[C@@H]1C[N@H+]1CC[C@@H](C(F)(F)F)C(C)(C)C1 ZINC000488595635 533722893 /nfs/dbraw/zinc/72/28/93/533722893.db2.gz XYADDUWIVFXHAK-GMTAPVOTSA-N 1 1 249.320 3.553 20 0 BHADMO C[C@@H]1C[C@@H]1C[N@H+]1CC[C@H](C(F)(F)F)C(C)(C)C1 ZINC000488595636 388189901 /nfs/dbraw/zinc/18/99/01/388189901.db2.gz XYADDUWIVFXHAK-MXWKQRLJSA-N 1 1 249.320 3.553 20 0 BHADMO C[C@@H]1C[C@H]1C[N@H+]1CC[C@@H](C(F)(F)F)C(C)(C)C1 ZINC000488595638 388190326 /nfs/dbraw/zinc/19/03/26/388190326.db2.gz XYADDUWIVFXHAK-OUAUKWLOSA-N 1 1 249.320 3.553 20 0 BHADMO C[C@@H]1C[C@H]1C[N@H+]1CC[C@H](C(F)(F)F)C(C)(C)C1 ZINC000488595640 388190201 /nfs/dbraw/zinc/19/02/01/388190201.db2.gz XYADDUWIVFXHAK-VWYCJHECSA-N 1 1 249.320 3.553 20 0 BHADMO CC[N@@H+](C)[C@H](c1ccccc1C)C(C)C ZINC000488674230 388191063 /nfs/dbraw/zinc/19/10/63/388191063.db2.gz SYXKLSJMZDDGNW-AWEZNQCLSA-N 1 1 205.345 3.644 20 0 BHADMO CC[N@@H+](C)[C@@H](c1ccccc1C)C(C)C ZINC000488674244 388191025 /nfs/dbraw/zinc/19/10/25/388191025.db2.gz SYXKLSJMZDDGNW-CQSZACIVSA-N 1 1 205.345 3.644 20 0 BHADMO CC[C@@H](c1ccccc1)[N@@H+](CC)C[C@H]1CCCO1 ZINC000488700369 529256461 /nfs/dbraw/zinc/25/64/61/529256461.db2.gz NVEKGNDRIPARBO-CVEARBPZSA-N 1 1 247.382 3.639 20 0 BHADMO CC[C@@H](c1ccccc1)[N@@H+](CC)C[C@@H]1CCCO1 ZINC000488700371 388191557 /nfs/dbraw/zinc/19/15/57/388191557.db2.gz NVEKGNDRIPARBO-HOTGVXAUSA-N 1 1 247.382 3.639 20 0 BHADMO CC[C@H](c1ccccc1)[N@@H+](CC)C[C@H]1CCCO1 ZINC000488700373 388191814 /nfs/dbraw/zinc/19/18/14/388191814.db2.gz NVEKGNDRIPARBO-HZPDHXFCSA-N 1 1 247.382 3.639 20 0 BHADMO CC[C@H](c1ccccc1)[N@@H+](CC)C[C@@H]1CCCO1 ZINC000488700376 388191899 /nfs/dbraw/zinc/19/18/99/388191899.db2.gz NVEKGNDRIPARBO-JKSUJKDBSA-N 1 1 247.382 3.639 20 0 BHADMO Cc1ccoc1CNc1cc[nH+]c2ccsc21 ZINC000488705077 388191939 /nfs/dbraw/zinc/19/19/39/388191939.db2.gz OHZHFBFKRGUEJV-UHFFFAOYSA-N 1 1 244.319 3.810 20 0 BHADMO COCCC[N@@H+](C)[C@H](c1ccccc1C)C(C)C ZINC000488725323 388192656 /nfs/dbraw/zinc/19/26/56/388192656.db2.gz LCJWIEVPETUQMH-INIZCTEOSA-N 1 1 249.398 3.660 20 0 BHADMO COCCC[N@@H+](C)[C@@H](c1ccccc1C)C(C)C ZINC000488725324 388193143 /nfs/dbraw/zinc/19/31/43/388193143.db2.gz LCJWIEVPETUQMH-MRXNPFEDSA-N 1 1 249.398 3.660 20 0 BHADMO CCC[N@@H+](CC)[C@H](C)c1cccc(C)c1 ZINC000488760469 388194821 /nfs/dbraw/zinc/19/48/21/388194821.db2.gz MDFBOABDOYGDAZ-CYBMUJFWSA-N 1 1 205.345 3.788 20 0 BHADMO CCC[N@@H+](CC)[C@@H](C)c1cccc(C)c1 ZINC000488760470 388195059 /nfs/dbraw/zinc/19/50/59/388195059.db2.gz MDFBOABDOYGDAZ-ZDUSSCGKSA-N 1 1 205.345 3.788 20 0 BHADMO CCC[N@@H+](CC)Cc1ccc(OC)c(Cl)c1 ZINC000488764886 388195063 /nfs/dbraw/zinc/19/50/63/388195063.db2.gz VCFDAXIYJHVEIW-UHFFFAOYSA-N 1 1 241.762 3.581 20 0 BHADMO CCC[N@@H+](CC)[C@H](C)c1ncc(C(C)(C)C)o1 ZINC000488789690 388195171 /nfs/dbraw/zinc/19/51/71/388195171.db2.gz FATIHADILCYYQJ-LLVKDONJSA-N 1 1 238.375 3.765 20 0 BHADMO CCC[N@@H+](CC)[C@@H](C)c1ncc(C(C)(C)C)o1 ZINC000488789691 388194790 /nfs/dbraw/zinc/19/47/90/388194790.db2.gz FATIHADILCYYQJ-NSHDSACASA-N 1 1 238.375 3.765 20 0 BHADMO CCC[N@@H+](CC)[C@H]1CCc2ccc(F)cc21 ZINC000488793240 388196089 /nfs/dbraw/zinc/19/60/89/388196089.db2.gz PGCFPIQHXJOQFZ-AWEZNQCLSA-N 1 1 221.319 3.545 20 0 BHADMO CCC[N@@H+](CC)[C@@H]1CCc2ccc(F)cc21 ZINC000488793243 388195791 /nfs/dbraw/zinc/19/57/91/388195791.db2.gz PGCFPIQHXJOQFZ-CQSZACIVSA-N 1 1 221.319 3.545 20 0 BHADMO CCC[N@@H+](C)[C@H](C)c1ccc2c(c1)CCC2 ZINC000488824825 388196716 /nfs/dbraw/zinc/19/67/16/388196716.db2.gz JEMPWYGJUQRCNP-GFCCVEGCSA-N 1 1 217.356 3.578 20 0 BHADMO CCC[N@@H+](C)[C@@H](C)c1ccc2c(c1)CCC2 ZINC000488824829 388196900 /nfs/dbraw/zinc/19/69/00/388196900.db2.gz JEMPWYGJUQRCNP-LBPRGKRZSA-N 1 1 217.356 3.578 20 0 BHADMO CCC[N@@H+](C)[C@@H]1CCc2c1cccc2Cl ZINC000488829718 388196816 /nfs/dbraw/zinc/19/68/16/388196816.db2.gz QSNWKOPOUIVNSB-CYBMUJFWSA-N 1 1 223.747 3.669 20 0 BHADMO CCC[N@@H+](C)[C@H]1CCc2c1cccc2Cl ZINC000488829719 388196579 /nfs/dbraw/zinc/19/65/79/388196579.db2.gz QSNWKOPOUIVNSB-ZDUSSCGKSA-N 1 1 223.747 3.669 20 0 BHADMO C[C@H]([N@@H+](C)CCCc1ccccc1)C1(C)CC1 ZINC000489073013 388203863 /nfs/dbraw/zinc/20/38/63/388203863.db2.gz LGSLYLUVEPIXGH-AWEZNQCLSA-N 1 1 231.383 3.740 20 0 BHADMO C[C@@H]([N@@H+](C)CCCc1ccccc1)C1(C)CC1 ZINC000489073014 388202746 /nfs/dbraw/zinc/20/27/46/388202746.db2.gz LGSLYLUVEPIXGH-CQSZACIVSA-N 1 1 231.383 3.740 20 0 BHADMO CC[C@H]1CCC[N@H+]1CCCc1cccc(F)c1 ZINC000489105428 388204252 /nfs/dbraw/zinc/20/42/52/388204252.db2.gz ZGQYKWJHNNNLSW-HNNXBMFYSA-N 1 1 235.346 3.633 20 0 BHADMO CC[C@@H]1CCC[N@H+]1CCCc1cccc(F)c1 ZINC000489105429 388204222 /nfs/dbraw/zinc/20/42/22/388204222.db2.gz ZGQYKWJHNNNLSW-OAHLLOKOSA-N 1 1 235.346 3.633 20 0 BHADMO C[N@@H+](CCCc1cccc(F)c1)CC(C)(C)C ZINC000489143724 388204681 /nfs/dbraw/zinc/20/46/81/388204681.db2.gz ZWFZRXBFCSRXBA-UHFFFAOYSA-N 1 1 237.362 3.736 20 0 BHADMO COc1ccc(C[N@@H+](C)CC2CCCC2)cc1C ZINC000489146058 388204607 /nfs/dbraw/zinc/20/46/07/388204607.db2.gz FIJAGCYTZPTOHB-UHFFFAOYSA-N 1 1 247.382 3.626 20 0 BHADMO CCC[N@@H+](CCCc1cccc(F)c1)C1CC1 ZINC000489151979 388205402 /nfs/dbraw/zinc/20/54/02/388205402.db2.gz HYKUKNOGBFEZFP-UHFFFAOYSA-N 1 1 235.346 3.633 20 0 BHADMO CC1(C)CCC[N@H+]1CCCc1cccc(F)c1 ZINC000489210027 388205943 /nfs/dbraw/zinc/20/59/43/388205943.db2.gz ZYQLPBHJCPTMPG-UHFFFAOYSA-N 1 1 235.346 3.633 20 0 BHADMO CC[C@@H](c1ccccc1)[N@@H+](CC)CC1CC1 ZINC000489284542 388206624 /nfs/dbraw/zinc/20/66/24/388206624.db2.gz BQDCMYXOQOBQRI-HNNXBMFYSA-N 1 1 217.356 3.870 20 0 BHADMO CC[C@H](c1ccccc1)[N@@H+](CC)CC1CC1 ZINC000489284543 388206674 /nfs/dbraw/zinc/20/66/74/388206674.db2.gz BQDCMYXOQOBQRI-OAHLLOKOSA-N 1 1 217.356 3.870 20 0 BHADMO CC[N@@H+](CC1CC1)[C@@H](C)c1ccc(F)c(F)c1 ZINC000489322474 388207822 /nfs/dbraw/zinc/20/78/22/388207822.db2.gz CTOBLDBYIHKANB-JTQLQIEISA-N 1 1 239.309 3.758 20 0 BHADMO CC[N@@H+](CC1CC1)[C@H](C)c1ccc(F)c(F)c1 ZINC000489322482 388207397 /nfs/dbraw/zinc/20/73/97/388207397.db2.gz CTOBLDBYIHKANB-SNVBAGLBSA-N 1 1 239.309 3.758 20 0 BHADMO CC[N@@H+](CC1CC1)[C@H]1CCc2ccc(F)cc21 ZINC000489330420 388208006 /nfs/dbraw/zinc/20/80/06/388208006.db2.gz NYIQSHQWXWYMOI-HNNXBMFYSA-N 1 1 233.330 3.545 20 0 BHADMO CC[N@@H+](CC1CC1)[C@@H]1CCc2ccc(F)cc21 ZINC000489330422 388207886 /nfs/dbraw/zinc/20/78/86/388207886.db2.gz NYIQSHQWXWYMOI-OAHLLOKOSA-N 1 1 233.330 3.545 20 0 BHADMO CC[N@@H+](CC1CC1)[C@@H](C)c1cc(F)ccc1F ZINC000489336468 388208681 /nfs/dbraw/zinc/20/86/81/388208681.db2.gz WINCOKWLFNYCCQ-JTQLQIEISA-N 1 1 239.309 3.758 20 0 BHADMO CC[N@@H+](CC1CC1)[C@H](C)c1cc(F)ccc1F ZINC000489336470 388208572 /nfs/dbraw/zinc/20/85/72/388208572.db2.gz WINCOKWLFNYCCQ-SNVBAGLBSA-N 1 1 239.309 3.758 20 0 BHADMO CC[N@@H+](CC1CC1)[C@@H](C)CCc1ccccc1 ZINC000489359778 388209132 /nfs/dbraw/zinc/20/91/32/388209132.db2.gz KHCNJAIKIKIQLN-AWEZNQCLSA-N 1 1 231.383 3.740 20 0 BHADMO CC[N@@H+](CC1CC1)[C@H](C)CCc1ccccc1 ZINC000489359781 388209391 /nfs/dbraw/zinc/20/93/91/388209391.db2.gz KHCNJAIKIKIQLN-CQSZACIVSA-N 1 1 231.383 3.740 20 0 BHADMO CC[N@@H+](CC1CC1)[C@H]1CCCc2ccccc21 ZINC000489363329 388209915 /nfs/dbraw/zinc/20/99/15/388209915.db2.gz PSOJMZUODGAUHN-INIZCTEOSA-N 1 1 229.367 3.796 20 0 BHADMO CC[N@@H+](CC1CC1)[C@@H]1CCCc2ccccc21 ZINC000489363332 388209769 /nfs/dbraw/zinc/20/97/69/388209769.db2.gz PSOJMZUODGAUHN-MRXNPFEDSA-N 1 1 229.367 3.796 20 0 BHADMO CC[N@@H+](CC1CC1)[C@H](C)c1cccc(C)c1 ZINC000489385917 388210726 /nfs/dbraw/zinc/21/07/26/388210726.db2.gz HNHGHBIKTVFXOW-CYBMUJFWSA-N 1 1 217.356 3.788 20 0 BHADMO CC[N@@H+](CC1CC1)[C@@H](C)c1cccc(C)c1 ZINC000489385918 388210555 /nfs/dbraw/zinc/21/05/55/388210555.db2.gz HNHGHBIKTVFXOW-ZDUSSCGKSA-N 1 1 217.356 3.788 20 0 BHADMO CC[N@@H+](CC1CC1)[C@@H](C)c1ccc(F)cc1F ZINC000489386536 388210574 /nfs/dbraw/zinc/21/05/74/388210574.db2.gz ILLOBIRTUHESIJ-JTQLQIEISA-N 1 1 239.309 3.758 20 0 BHADMO CC[N@@H+](CC1CC1)[C@H](C)c1ccc(F)cc1F ZINC000489386537 388210571 /nfs/dbraw/zinc/21/05/71/388210571.db2.gz ILLOBIRTUHESIJ-SNVBAGLBSA-N 1 1 239.309 3.758 20 0 BHADMO C[N@@H+](Cc1ccc(Cl)s1)[C@@H]1CC1(C)C ZINC000489394791 388210641 /nfs/dbraw/zinc/21/06/41/388210641.db2.gz CLBOWEXWMUMKOW-SECBINFHSA-N 1 1 229.776 3.632 20 0 BHADMO C[N@@H+](Cc1ccc(Cl)s1)[C@H]1CC1(C)C ZINC000489394793 388211049 /nfs/dbraw/zinc/21/10/49/388211049.db2.gz CLBOWEXWMUMKOW-VIFPVBQESA-N 1 1 229.776 3.632 20 0 BHADMO CC[N@@H+](CC1CC1)[C@H](C)c1ccccc1C ZINC000489425043 398024044 /nfs/dbraw/zinc/02/40/44/398024044.db2.gz REXHXIMCCSGNGN-CYBMUJFWSA-N 1 1 217.356 3.788 20 0 BHADMO CC[N@@H+](CC1CC1)[C@@H](C)c1ccccc1C ZINC000489425045 398024147 /nfs/dbraw/zinc/02/41/47/398024147.db2.gz REXHXIMCCSGNGN-ZDUSSCGKSA-N 1 1 217.356 3.788 20 0 BHADMO Cc1cc(C[N@H+](C)[C@@H]2CC2(C)C)c(C)s1 ZINC000489430394 398024915 /nfs/dbraw/zinc/02/49/15/398024915.db2.gz GAYQOIJFEDBPJP-GFCCVEGCSA-N 1 1 223.385 3.595 20 0 BHADMO Cc1cc(C[N@H+](C)[C@H]2CC2(C)C)c(C)s1 ZINC000489430406 398024830 /nfs/dbraw/zinc/02/48/30/398024830.db2.gz GAYQOIJFEDBPJP-LBPRGKRZSA-N 1 1 223.385 3.595 20 0 BHADMO C[C@@H](C[N@@H+](C)[C@@H]1CC1(C)C)c1ccccc1 ZINC000489433146 388214183 /nfs/dbraw/zinc/21/41/83/388214183.db2.gz IVGUHUMDRGXCHY-GXTWGEPZSA-N 1 1 217.356 3.520 20 0 BHADMO C[C@@H](C[N@@H+](C)[C@H]1CC1(C)C)c1ccccc1 ZINC000489433148 388213490 /nfs/dbraw/zinc/21/34/90/388213490.db2.gz IVGUHUMDRGXCHY-JSGCOSHPSA-N 1 1 217.356 3.520 20 0 BHADMO C[C@H](C[N@@H+](C)[C@H]1CC1(C)C)c1ccccc1 ZINC000489433150 388214078 /nfs/dbraw/zinc/21/40/78/388214078.db2.gz IVGUHUMDRGXCHY-OCCSQVGLSA-N 1 1 217.356 3.520 20 0 BHADMO C[C@H](C[N@@H+](C)[C@@H]1CC1(C)C)c1ccccc1 ZINC000489433152 388214081 /nfs/dbraw/zinc/21/40/81/388214081.db2.gz IVGUHUMDRGXCHY-TZMCWYRMSA-N 1 1 217.356 3.520 20 0 BHADMO CSc1ccc(C[N@@H+](C)[C@@H]2CC2(C)C)cc1 ZINC000489441963 388215059 /nfs/dbraw/zinc/21/50/59/388215059.db2.gz UKMIWCBMRJFWRR-CYBMUJFWSA-N 1 1 235.396 3.639 20 0 BHADMO CSc1ccc(C[N@@H+](C)[C@H]2CC2(C)C)cc1 ZINC000489441964 388214832 /nfs/dbraw/zinc/21/48/32/388214832.db2.gz UKMIWCBMRJFWRR-ZDUSSCGKSA-N 1 1 235.396 3.639 20 0 BHADMO CC[N@@H+](CC1CC1)[C@@H](C)c1c(F)cccc1F ZINC000489455994 388216543 /nfs/dbraw/zinc/21/65/43/388216543.db2.gz JZXAIHHGAOGRJY-JTQLQIEISA-N 1 1 239.309 3.758 20 0 BHADMO CC[N@@H+](CC1CC1)[C@H](C)c1c(F)cccc1F ZINC000489455995 388216219 /nfs/dbraw/zinc/21/62/19/388216219.db2.gz JZXAIHHGAOGRJY-SNVBAGLBSA-N 1 1 239.309 3.758 20 0 BHADMO C[N@@H+](CCCCOc1ccccc1)[C@H]1CC1(C)C ZINC000489462980 388215712 /nfs/dbraw/zinc/21/57/12/388215712.db2.gz ZBGUVJKRGNUIIE-HNNXBMFYSA-N 1 1 247.382 3.576 20 0 BHADMO C[N@@H+](CCCCOc1ccccc1)[C@@H]1CC1(C)C ZINC000489462981 388216079 /nfs/dbraw/zinc/21/60/79/388216079.db2.gz ZBGUVJKRGNUIIE-OAHLLOKOSA-N 1 1 247.382 3.576 20 0 BHADMO C[N@@H+](Cc1cc2ccccc2o1)[C@H]1CC1(C)C ZINC000489464587 388215761 /nfs/dbraw/zinc/21/57/61/388215761.db2.gz KTNOSBHGGDTXEQ-AWEZNQCLSA-N 1 1 229.323 3.663 20 0 BHADMO C[N@@H+](Cc1cc2ccccc2o1)[C@@H]1CC1(C)C ZINC000489464588 388216035 /nfs/dbraw/zinc/21/60/35/388216035.db2.gz KTNOSBHGGDTXEQ-CQSZACIVSA-N 1 1 229.323 3.663 20 0 BHADMO C[N@@H+](Cc1cccc(F)c1)C1(C)CCCC1 ZINC000489823272 388225122 /nfs/dbraw/zinc/22/51/22/388225122.db2.gz AYVKKKXUOHSWNY-UHFFFAOYSA-N 1 1 221.319 3.590 20 0 BHADMO C[N@@H+](Cc1nc2ccccc2o1)C1(C)CCCC1 ZINC000489830984 388225004 /nfs/dbraw/zinc/22/50/04/388225004.db2.gz MYVCDGBPMUMMPR-UHFFFAOYSA-N 1 1 244.338 3.592 20 0 BHADMO Cc1ccccc1C[N@H+](C)C1(C)CCCC1 ZINC000489840487 388226040 /nfs/dbraw/zinc/22/60/40/388226040.db2.gz JWMIYMLCZSAVOK-UHFFFAOYSA-N 1 1 217.356 3.760 20 0 BHADMO C[N@@H+](Cc1cccc(F)c1F)C1(C)CCCC1 ZINC000489842703 388225884 /nfs/dbraw/zinc/22/58/84/388225884.db2.gz LXABAZIINDSFNU-UHFFFAOYSA-N 1 1 239.309 3.729 20 0 BHADMO CCOc1ccc(C[N@@H+](C)C2(C)CCCC2)cc1 ZINC000489844778 388226192 /nfs/dbraw/zinc/22/61/92/388226192.db2.gz VMCRCJWXDRFIAF-UHFFFAOYSA-N 1 1 247.382 3.850 20 0 BHADMO C[N@@H+](Cc1ccc(F)cc1)C1(C)CCCC1 ZINC000489846762 388225957 /nfs/dbraw/zinc/22/59/57/388225957.db2.gz CPRGNPNATOLYLX-UHFFFAOYSA-N 1 1 221.319 3.590 20 0 BHADMO C[N@@H+](CCc1ccccc1F)C1(C)CCCC1 ZINC000489852426 388226569 /nfs/dbraw/zinc/22/65/69/388226569.db2.gz RABRLOVCWRCKEH-UHFFFAOYSA-N 1 1 235.346 3.633 20 0 BHADMO Cc1nc(C[N@H+](C)C2(C)CCCC2)sc1C ZINC000489855304 388226157 /nfs/dbraw/zinc/22/61/57/388226157.db2.gz ISPHWUWTIRNFNW-UHFFFAOYSA-N 1 1 238.400 3.524 20 0 BHADMO Cc1ccc(C[N@H+](C)C2(C)CCCC2)cc1 ZINC000489859284 388226091 /nfs/dbraw/zinc/22/60/91/388226091.db2.gz LUFCATIOWAZHHL-UHFFFAOYSA-N 1 1 217.356 3.760 20 0 BHADMO C[N@@H+](Cc1ccc(F)c(F)c1)C1(C)CCCC1 ZINC000489868432 388227064 /nfs/dbraw/zinc/22/70/64/388227064.db2.gz ZNEKSYUQHNQQEX-UHFFFAOYSA-N 1 1 239.309 3.729 20 0 BHADMO COc1ccc(CC[N@@H+](C)C2(C)CCCC2)cc1 ZINC000489869988 388227279 /nfs/dbraw/zinc/22/72/79/388227279.db2.gz HZPBWCVRPRBHLX-UHFFFAOYSA-N 1 1 247.382 3.502 20 0 BHADMO C[N@@H+](Cc1ncc(Cl)s1)C1(C)CCCC1 ZINC000489870103 388226923 /nfs/dbraw/zinc/22/69/23/388226923.db2.gz INYMNQLDOAXQJB-UHFFFAOYSA-N 1 1 244.791 3.561 20 0 BHADMO C[N@@H+](Cc1c(F)cccc1F)C1(C)CCCC1 ZINC000489870684 388226755 /nfs/dbraw/zinc/22/67/55/388226755.db2.gz JIMNLXCQGCICMO-UHFFFAOYSA-N 1 1 239.309 3.729 20 0 BHADMO Cc1cccc(C[N@H+](C)C2(C)CCCC2)c1 ZINC000489877664 388227310 /nfs/dbraw/zinc/22/73/10/388227310.db2.gz VAFHPXGICYGFOT-UHFFFAOYSA-N 1 1 217.356 3.760 20 0 BHADMO Cc1cc[nH+]c(N2CCC(C)(C(C)C)CC2)c1 ZINC000489877959 388226846 /nfs/dbraw/zinc/22/68/46/388226846.db2.gz AEZDIOXLSQHMCL-UHFFFAOYSA-N 1 1 232.371 3.653 20 0 BHADMO C[N@@H+](C/C=C/c1ccccc1)C1(C)CCCC1 ZINC000489882057 388227048 /nfs/dbraw/zinc/22/70/48/388227048.db2.gz GOOHIIRLOREJHF-DHZHZOJOSA-N 1 1 229.367 3.964 20 0 BHADMO C[N@@H+](C/C=C\c1ccccc1)C1(C)CCCC1 ZINC000489882058 388227522 /nfs/dbraw/zinc/22/75/22/388227522.db2.gz GOOHIIRLOREJHF-FLIBITNWSA-N 1 1 229.367 3.964 20 0 BHADMO COc1ccc(C)cc1C[N@@H+](C)C1(C)CCCC1 ZINC000489885851 388226843 /nfs/dbraw/zinc/22/68/43/388226843.db2.gz LYAZOGJAPADDGP-UHFFFAOYSA-N 1 1 247.382 3.768 20 0 BHADMO C[N@@H+](Cc1ccccc1F)C1(C)CCCC1 ZINC000489886468 388226768 /nfs/dbraw/zinc/22/67/68/388226768.db2.gz MNMWIIGYLPMVBE-UHFFFAOYSA-N 1 1 221.319 3.590 20 0 BHADMO Cc1nc(C)c(C[N@H+](C)C2(C)CCCC2)s1 ZINC000489886872 388226901 /nfs/dbraw/zinc/22/69/01/388226901.db2.gz PLSQAYKOYFMKKZ-UHFFFAOYSA-N 1 1 238.400 3.524 20 0 BHADMO C[N@@H+](Cc1cccs1)C1(C)CCCC1 ZINC000489887672 388227202 /nfs/dbraw/zinc/22/72/02/388227202.db2.gz QHSIKWAYIUQQGI-UHFFFAOYSA-N 1 1 209.358 3.513 20 0 BHADMO Cc1cccc(N2CCC(C)(C(C)C)CC2)[nH+]1 ZINC000489890114 388227273 /nfs/dbraw/zinc/22/72/73/388227273.db2.gz DDYWISBOEGXUAK-UHFFFAOYSA-N 1 1 232.371 3.653 20 0 BHADMO C[N@@H+](Cc1cc(F)ccc1F)C1(C)CCCC1 ZINC000489895485 388227943 /nfs/dbraw/zinc/22/79/43/388227943.db2.gz HFYGDVFRKMUANY-UHFFFAOYSA-N 1 1 239.309 3.729 20 0 BHADMO C[N@@H+](Cc1ccc(F)cc1F)C1(C)CCCC1 ZINC000489896562 388227668 /nfs/dbraw/zinc/22/76/68/388227668.db2.gz JXNWZODQUQMOCW-UHFFFAOYSA-N 1 1 239.309 3.729 20 0 BHADMO CCC(C)(C)[N@@H+](C)CCCc1cccc(F)c1 ZINC000490013312 388230410 /nfs/dbraw/zinc/23/04/10/388230410.db2.gz LTIPXLMSSXAIAI-UHFFFAOYSA-N 1 1 237.362 3.879 20 0 BHADMO CSCC[N@H+]1C[C@H](c2ccc(C)cc2)C[C@@H]1C ZINC000490031184 388231086 /nfs/dbraw/zinc/23/10/86/388231086.db2.gz KXXRNMXTMKVGDE-DZGCQCFKSA-N 1 1 249.423 3.536 20 0 BHADMO CSCC[N@H+]1C[C@@H](c2ccc(C)cc2)C[C@H]1C ZINC000490031185 388231446 /nfs/dbraw/zinc/23/14/46/388231446.db2.gz KXXRNMXTMKVGDE-HIFRSBDPSA-N 1 1 249.423 3.536 20 0 BHADMO CSCC[N@H+]1C[C@H](c2ccc(C)cc2)C[C@H]1C ZINC000490031186 388231641 /nfs/dbraw/zinc/23/16/41/388231641.db2.gz KXXRNMXTMKVGDE-UKRRQHHQSA-N 1 1 249.423 3.536 20 0 BHADMO CSCC[N@H+]1C[C@@H](c2ccc(C)cc2)C[C@@H]1C ZINC000490031187 388231149 /nfs/dbraw/zinc/23/11/49/388231149.db2.gz KXXRNMXTMKVGDE-ZFWWWQNUSA-N 1 1 249.423 3.536 20 0 BHADMO CCC[N@H+]1C[C@H](c2ccc(C)cc2)C[C@@H]1C ZINC000490033628 528327133 /nfs/dbraw/zinc/32/71/33/528327133.db2.gz PYOQZUHDFLPFEI-DZGCQCFKSA-N 1 1 217.356 3.583 20 0 BHADMO CCC[N@H+]1C[C@@H](c2ccc(C)cc2)C[C@H]1C ZINC000490033629 388231530 /nfs/dbraw/zinc/23/15/30/388231530.db2.gz PYOQZUHDFLPFEI-HIFRSBDPSA-N 1 1 217.356 3.583 20 0 BHADMO CCC[N@H+]1C[C@H](c2ccc(C)cc2)C[C@H]1C ZINC000490033630 388231549 /nfs/dbraw/zinc/23/15/49/388231549.db2.gz PYOQZUHDFLPFEI-UKRRQHHQSA-N 1 1 217.356 3.583 20 0 BHADMO CCC[N@H+]1C[C@@H](c2ccc(C)cc2)C[C@@H]1C ZINC000490033631 388231469 /nfs/dbraw/zinc/23/14/69/388231469.db2.gz PYOQZUHDFLPFEI-ZFWWWQNUSA-N 1 1 217.356 3.583 20 0 BHADMO C[C@@H]([N@@H+](C)CCCc1cccc(F)c1)C1(C)CC1 ZINC000490040076 388231219 /nfs/dbraw/zinc/23/12/19/388231219.db2.gz PDDKINXCEJPXRN-CYBMUJFWSA-N 1 1 249.373 3.879 20 0 BHADMO C[C@H]([N@@H+](C)CCCc1cccc(F)c1)C1(C)CC1 ZINC000490040078 388231332 /nfs/dbraw/zinc/23/13/32/388231332.db2.gz PDDKINXCEJPXRN-ZDUSSCGKSA-N 1 1 249.373 3.879 20 0 BHADMO Cc1ccc([C@@H]2C[C@H](C)[N@@H+](C(C)C)C2)cc1 ZINC000490045978 388232199 /nfs/dbraw/zinc/23/21/99/388232199.db2.gz BTASKCFMIRPNMB-DZGCQCFKSA-N 1 1 217.356 3.581 20 0 BHADMO Cc1ccc([C@H]2C[C@@H](C)[N@@H+](C(C)C)C2)cc1 ZINC000490045981 388231990 /nfs/dbraw/zinc/23/19/90/388231990.db2.gz BTASKCFMIRPNMB-HIFRSBDPSA-N 1 1 217.356 3.581 20 0 BHADMO Cc1ccc([C@@H]2C[C@@H](C)[N@@H+](C(C)C)C2)cc1 ZINC000490045985 388231939 /nfs/dbraw/zinc/23/19/39/388231939.db2.gz BTASKCFMIRPNMB-UKRRQHHQSA-N 1 1 217.356 3.581 20 0 BHADMO Cc1ccc([C@H]2C[C@H](C)[N@@H+](C(C)C)C2)cc1 ZINC000490045990 388232241 /nfs/dbraw/zinc/23/22/41/388232241.db2.gz BTASKCFMIRPNMB-ZFWWWQNUSA-N 1 1 217.356 3.581 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)CCc1ccc(F)c(F)c1 ZINC000490075532 388233728 /nfs/dbraw/zinc/23/37/28/388233728.db2.gz YJXSLAMWBUOBQK-LLVKDONJSA-N 1 1 241.325 3.628 20 0 BHADMO CCC[C@H](C)[N@@H+](C)CCc1ccc(F)c(F)c1 ZINC000490075535 388233384 /nfs/dbraw/zinc/23/33/84/388233384.db2.gz YJXSLAMWBUOBQK-NSHDSACASA-N 1 1 241.325 3.628 20 0 BHADMO Cc1ccc([C@@H]2C[C@H](C)[N@H+](CCCF)C2)cc1 ZINC000490081340 388234976 /nfs/dbraw/zinc/23/49/76/388234976.db2.gz SZAAAHFKJOPPQH-DZGCQCFKSA-N 1 1 235.346 3.532 20 0 BHADMO Cc1ccc([C@H]2C[C@@H](C)[N@H+](CCCF)C2)cc1 ZINC000490081342 388234464 /nfs/dbraw/zinc/23/44/64/388234464.db2.gz SZAAAHFKJOPPQH-HIFRSBDPSA-N 1 1 235.346 3.532 20 0 BHADMO Cc1ccc([C@@H]2C[C@@H](C)[N@H+](CCCF)C2)cc1 ZINC000490081344 388234631 /nfs/dbraw/zinc/23/46/31/388234631.db2.gz SZAAAHFKJOPPQH-UKRRQHHQSA-N 1 1 235.346 3.532 20 0 BHADMO Cc1ccc([C@H]2C[C@H](C)[N@H+](CCCF)C2)cc1 ZINC000490081346 388234583 /nfs/dbraw/zinc/23/45/83/388234583.db2.gz SZAAAHFKJOPPQH-ZFWWWQNUSA-N 1 1 235.346 3.532 20 0 BHADMO Fc1cccc(CCC[N@H+]2CCC3(CCC3)C2)c1 ZINC000490090404 388234468 /nfs/dbraw/zinc/23/44/68/388234468.db2.gz QIVUKRQILJBUFF-UHFFFAOYSA-N 1 1 247.357 3.634 20 0 BHADMO C[C@@H]1CC[C@H](C)[N@@H+]1CCCc1cccc(F)c1 ZINC000490091072 388234220 /nfs/dbraw/zinc/23/42/20/388234220.db2.gz RZPKSGKLZJZIHJ-BETUJISGSA-N 1 1 235.346 3.631 20 0 BHADMO Cc1ccc([C@H]2C[C@H](C)[N@H+](CC3CC3)C2)cc1 ZINC000490092387 388234109 /nfs/dbraw/zinc/23/41/09/388234109.db2.gz MYBKZLWNZPSTKY-BBRMVZONSA-N 1 1 229.367 3.583 20 0 BHADMO Cc1ccc([C@H]2C[C@@H](C)[N@H+](CC3CC3)C2)cc1 ZINC000490092388 388234644 /nfs/dbraw/zinc/23/46/44/388234644.db2.gz MYBKZLWNZPSTKY-CJNGLKHVSA-N 1 1 229.367 3.583 20 0 BHADMO Cc1ccc([C@@H]2C[C@@H](C)[N@H+](CC3CC3)C2)cc1 ZINC000490092389 388234688 /nfs/dbraw/zinc/23/46/88/388234688.db2.gz MYBKZLWNZPSTKY-CZUORRHYSA-N 1 1 229.367 3.583 20 0 BHADMO Cc1ccc([C@@H]2C[C@H](C)[N@H+](CC3CC3)C2)cc1 ZINC000490092390 388234326 /nfs/dbraw/zinc/23/43/26/388234326.db2.gz MYBKZLWNZPSTKY-XJKSGUPXSA-N 1 1 229.367 3.583 20 0 BHADMO C[N@@H+](CCCc1ccccc1)C1(C)CCCC1 ZINC000490104723 388235691 /nfs/dbraw/zinc/23/56/91/388235691.db2.gz ORTPTUMTPDUEPX-UHFFFAOYSA-N 1 1 231.383 3.884 20 0 BHADMO C[C@H]([N@@H+](C)CCCOc1ccccc1)C1(C)CC1 ZINC000490121879 388235085 /nfs/dbraw/zinc/23/50/85/388235085.db2.gz ZSKNAOWINKHPCN-AWEZNQCLSA-N 1 1 247.382 3.576 20 0 BHADMO C[C@@H]([N@@H+](C)CCCOc1ccccc1)C1(C)CC1 ZINC000490121880 388235104 /nfs/dbraw/zinc/23/51/04/388235104.db2.gz ZSKNAOWINKHPCN-CQSZACIVSA-N 1 1 247.382 3.576 20 0 BHADMO CCCC[N@@H+](CC)CCc1ccc(F)c(F)c1 ZINC000490132739 388235355 /nfs/dbraw/zinc/23/53/55/388235355.db2.gz KZXWQIFJBKAFLN-UHFFFAOYSA-N 1 1 241.325 3.629 20 0 BHADMO C[N@@H+](Cc1cc(F)cc(F)c1)C1(C)CCCC1 ZINC000490133029 388235255 /nfs/dbraw/zinc/23/52/55/388235255.db2.gz NTGCKFBKEJBZFI-UHFFFAOYSA-N 1 1 239.309 3.729 20 0 BHADMO C[N@@H+](CCCCOC(C)(C)C)C1(C)CCCC1 ZINC000490137866 388235287 /nfs/dbraw/zinc/23/52/87/388235287.db2.gz CEHYRSKTDSEZFN-UHFFFAOYSA-N 1 1 241.419 3.846 20 0 BHADMO C[N@@H+](CCCc1ccsc1)C1(C)CCCC1 ZINC000490139601 529897028 /nfs/dbraw/zinc/89/70/28/529897028.db2.gz MIGKRGHCLUZKEZ-UHFFFAOYSA-N 1 1 237.412 3.945 20 0 BHADMO CN(C)c1ccccc1C[N@@H+](C)C1(C)CCCC1 ZINC000490176841 388236494 /nfs/dbraw/zinc/23/64/94/388236494.db2.gz SFOOYBGGAGIYIW-UHFFFAOYSA-N 1 1 246.398 3.517 20 0 BHADMO C[N@@H+](CCCCC(F)(F)F)C1(C)CCCC1 ZINC000490216148 388236390 /nfs/dbraw/zinc/23/63/90/388236390.db2.gz LYWXEWYAGUIQOA-UHFFFAOYSA-N 1 1 237.309 3.984 20 0 BHADMO COCc1cccc(C[N@@H+](C)C2(C)CCCC2)c1 ZINC000490232396 388236547 /nfs/dbraw/zinc/23/65/47/388236547.db2.gz VROYHCIYGWJDQC-UHFFFAOYSA-N 1 1 247.382 3.598 20 0 BHADMO C[N@@H+](CC1CC1)[C@H]1CCc2c1cccc2Cl ZINC000490302429 388237330 /nfs/dbraw/zinc/23/73/30/388237330.db2.gz SNAKTSDPEPSJNO-AWEZNQCLSA-N 1 1 235.758 3.669 20 0 BHADMO C[N@@H+](CC1CC1)[C@@H]1CCc2c1cccc2Cl ZINC000490302436 388236907 /nfs/dbraw/zinc/23/69/07/388236907.db2.gz SNAKTSDPEPSJNO-CQSZACIVSA-N 1 1 235.758 3.669 20 0 BHADMO C[C@H](c1ccc2c(c1)CCC2)[N@@H+](C)CC1CC1 ZINC000490305176 388237230 /nfs/dbraw/zinc/23/72/30/388237230.db2.gz DEAYLKUJTDYNCN-GFCCVEGCSA-N 1 1 229.367 3.578 20 0 BHADMO C[C@@H](c1ccc2c(c1)CCC2)[N@@H+](C)CC1CC1 ZINC000490305178 388237232 /nfs/dbraw/zinc/23/72/32/388237232.db2.gz DEAYLKUJTDYNCN-LBPRGKRZSA-N 1 1 229.367 3.578 20 0 BHADMO Cc1ccc(F)cc1C[N@H+](C(C)C)C1CCC1 ZINC000490430248 388238428 /nfs/dbraw/zinc/23/84/28/388238428.db2.gz GRXIFSHYWXIRRH-UHFFFAOYSA-N 1 1 235.346 3.897 20 0 BHADMO CCCC[C@@H](C)[N@@H+](C)Cc1ccoc1C ZINC000490463280 388239107 /nfs/dbraw/zinc/23/91/07/388239107.db2.gz HZMUBVDTTVZYOI-LLVKDONJSA-N 1 1 209.333 3.599 20 0 BHADMO CCCC[C@H](C)[N@@H+](C)Cc1ccoc1C ZINC000490463282 388239222 /nfs/dbraw/zinc/23/92/22/388239222.db2.gz HZMUBVDTTVZYOI-NSHDSACASA-N 1 1 209.333 3.599 20 0 BHADMO CCOCC[N@@H+](C)[C@H](c1ccccc1C)C(C)C ZINC000490589446 388241150 /nfs/dbraw/zinc/24/11/50/388241150.db2.gz MCSGJABPAOCWLM-INIZCTEOSA-N 1 1 249.398 3.660 20 0 BHADMO CCOCC[N@@H+](C)[C@@H](c1ccccc1C)C(C)C ZINC000490589455 528715191 /nfs/dbraw/zinc/71/51/91/528715191.db2.gz MCSGJABPAOCWLM-MRXNPFEDSA-N 1 1 249.398 3.660 20 0 BHADMO COCCCCC[N@@H+](CC(C)C)C1CCCC1 ZINC000491024964 225579005 /nfs/dbraw/zinc/57/90/05/225579005.db2.gz AVPGJSATHGCLJO-UHFFFAOYSA-N 1 1 241.419 3.704 20 0 BHADMO CC(C)C[N@@H+](CCCOC(C)C)C1CCCC1 ZINC000491025962 388265886 /nfs/dbraw/zinc/26/58/86/388265886.db2.gz FCZCSEUFTCBLMU-UHFFFAOYSA-N 1 1 241.419 3.702 20 0 BHADMO CC[C@@H](c1ccccc1)[N@@H+](C)CCCOC(C)C ZINC000491047617 384785473 /nfs/dbraw/zinc/78/54/73/384785473.db2.gz HFQLKMLTSCKSSI-INIZCTEOSA-N 1 1 249.398 3.885 20 0 BHADMO CC[C@H](c1ccccc1)[N@@H+](C)CCCOC(C)C ZINC000491047618 529180406 /nfs/dbraw/zinc/18/04/06/529180406.db2.gz HFQLKMLTSCKSSI-MRXNPFEDSA-N 1 1 249.398 3.885 20 0 BHADMO CC(C)OCCC[N@H+]1CCC[C@H]1CC(C)(C)C ZINC000491055091 538489792 /nfs/dbraw/zinc/48/97/92/538489792.db2.gz FGMWELJJUBPVEF-AWEZNQCLSA-N 1 1 241.419 3.702 20 0 BHADMO CC(C)OCCC[N@H+]1CCC[C@@H]1CC(C)(C)C ZINC000491055093 538489798 /nfs/dbraw/zinc/48/97/98/538489798.db2.gz FGMWELJJUBPVEF-CQSZACIVSA-N 1 1 241.419 3.702 20 0 BHADMO COCCCCC[N@H+]1CCC[C@H]1CC(C)(C)C ZINC000491060369 362847885 /nfs/dbraw/zinc/84/78/85/362847885.db2.gz WSNPMUHSKYVADV-AWEZNQCLSA-N 1 1 241.419 3.704 20 0 BHADMO COCCCCC[N@H+]1CCC[C@@H]1CC(C)(C)C ZINC000491060371 362847983 /nfs/dbraw/zinc/84/79/83/362847983.db2.gz WSNPMUHSKYVADV-CQSZACIVSA-N 1 1 241.419 3.704 20 0 BHADMO CCC[N@@H+](Cc1cc(F)ccc1C)C1CC1 ZINC000491061243 528132324 /nfs/dbraw/zinc/13/23/24/528132324.db2.gz QLIPVSWPECUZEP-UHFFFAOYSA-N 1 1 221.319 3.509 20 0 BHADMO Cc1ccc(F)cc1C[N@H+](C)C1CCCC1 ZINC000491063863 534158685 /nfs/dbraw/zinc/15/86/85/534158685.db2.gz FACBUJWGUYSVSZ-UHFFFAOYSA-N 1 1 221.319 3.509 20 0 BHADMO Cc1ccc(F)cc1C[N@H+](C)[C@H](C)C(C)C ZINC000491065566 534158204 /nfs/dbraw/zinc/15/82/04/534158204.db2.gz LGRHEARXYFZMPA-GFCCVEGCSA-N 1 1 223.335 3.610 20 0 BHADMO Cc1ccc(F)cc1C[N@H+](C)[C@@H](C)C(C)C ZINC000491065568 534158844 /nfs/dbraw/zinc/15/88/44/534158844.db2.gz LGRHEARXYFZMPA-LBPRGKRZSA-N 1 1 223.335 3.610 20 0 BHADMO CC(C)OCCC[N@@H+](C)CCC1CCCCC1 ZINC000491076641 388268332 /nfs/dbraw/zinc/26/83/32/388268332.db2.gz PLELUVGJOPBOQR-UHFFFAOYSA-N 1 1 241.419 3.704 20 0 BHADMO c1c2ccccc2oc1C[N@H+]1CC[C@H](C2CC2)C1 ZINC000491106599 225588159 /nfs/dbraw/zinc/58/81/59/225588159.db2.gz AQRUEPWLZHOKEM-AWEZNQCLSA-N 1 1 241.334 3.665 20 0 BHADMO c1c2ccccc2oc1C[N@H+]1CC[C@@H](C2CC2)C1 ZINC000491106602 388270328 /nfs/dbraw/zinc/27/03/28/388270328.db2.gz AQRUEPWLZHOKEM-CQSZACIVSA-N 1 1 241.334 3.665 20 0 BHADMO Cc1ccc(F)cc1C[N@@H+](C)Cc1cccs1 ZINC000491107022 388270110 /nfs/dbraw/zinc/27/01/10/388270110.db2.gz DHRSVTYKKITKPN-UHFFFAOYSA-N 1 1 249.354 3.828 20 0 BHADMO C[C@H](c1ccc(F)cc1)[N@H+]1CC[C@@H](C2CC2)C1 ZINC000491109489 388269999 /nfs/dbraw/zinc/26/99/99/388269999.db2.gz KNXXNZRXOSZFMW-BXUZGUMPSA-N 1 1 233.330 3.619 20 0 BHADMO C[C@@H](c1ccc(F)cc1)[N@H+]1CC[C@H](C2CC2)C1 ZINC000491109490 388270270 /nfs/dbraw/zinc/27/02/70/388270270.db2.gz KNXXNZRXOSZFMW-FZMZJTMJSA-N 1 1 233.330 3.619 20 0 BHADMO C[C@H](c1ccc(F)cc1)[N@H+]1CC[C@H](C2CC2)C1 ZINC000491109491 388270153 /nfs/dbraw/zinc/27/01/53/388270153.db2.gz KNXXNZRXOSZFMW-RISCZKNCSA-N 1 1 233.330 3.619 20 0 BHADMO C[C@@H](c1ccc(F)cc1)[N@H+]1CC[C@@H](C2CC2)C1 ZINC000491109492 388270559 /nfs/dbraw/zinc/27/05/59/388270559.db2.gz KNXXNZRXOSZFMW-SMDDNHRTSA-N 1 1 233.330 3.619 20 0 BHADMO Cc1ccc(F)cc1C[N@H+]([C@H](C)C1CC1)C1CC1 ZINC000491110734 388270372 /nfs/dbraw/zinc/27/03/72/388270372.db2.gz DNBQIEARLBIIGP-GFCCVEGCSA-N 1 1 247.357 3.897 20 0 BHADMO Cc1ccc(F)cc1C[N@H+]([C@@H](C)C1CC1)C1CC1 ZINC000491110736 388270346 /nfs/dbraw/zinc/27/03/46/388270346.db2.gz DNBQIEARLBIIGP-LBPRGKRZSA-N 1 1 247.357 3.897 20 0 BHADMO Cc1ccc(F)cc1C[N@H+](C)CC(C)(C)C ZINC000491111257 388270254 /nfs/dbraw/zinc/27/02/54/388270254.db2.gz FVCWYFKVFFBLJE-UHFFFAOYSA-N 1 1 223.335 3.612 20 0 BHADMO C[C@H](c1cccc(F)c1)[N@H+]1CC[C@@H](C2CC2)C1 ZINC000491112105 388270486 /nfs/dbraw/zinc/27/04/86/388270486.db2.gz XCLGRSNJWAUBGP-BXUZGUMPSA-N 1 1 233.330 3.619 20 0 BHADMO C[C@@H](c1cccc(F)c1)[N@H+]1CC[C@H](C2CC2)C1 ZINC000491112106 388270339 /nfs/dbraw/zinc/27/03/39/388270339.db2.gz XCLGRSNJWAUBGP-FZMZJTMJSA-N 1 1 233.330 3.619 20 0 BHADMO C[C@H](c1cccc(F)c1)[N@H+]1CC[C@H](C2CC2)C1 ZINC000491112108 388270068 /nfs/dbraw/zinc/27/00/68/388270068.db2.gz XCLGRSNJWAUBGP-RISCZKNCSA-N 1 1 233.330 3.619 20 0 BHADMO C[C@@H](c1cccc(F)c1)[N@H+]1CC[C@@H](C2CC2)C1 ZINC000491112109 388270283 /nfs/dbraw/zinc/27/02/83/388270283.db2.gz XCLGRSNJWAUBGP-SMDDNHRTSA-N 1 1 233.330 3.619 20 0 BHADMO CCCCC[N@@H+](C[C@H]1CCO[C@H](C)C1)C(C)C ZINC000491114412 388270424 /nfs/dbraw/zinc/27/04/24/388270424.db2.gz PBILCFHPMRKZID-CABCVRRESA-N 1 1 241.419 3.702 20 0 BHADMO CCCCC[N@@H+](C[C@H]1CCO[C@@H](C)C1)C(C)C ZINC000491114413 388270083 /nfs/dbraw/zinc/27/00/83/388270083.db2.gz PBILCFHPMRKZID-GJZGRUSLSA-N 1 1 241.419 3.702 20 0 BHADMO CCCCC[N@@H+](C[C@@H]1CCO[C@H](C)C1)C(C)C ZINC000491114414 388269464 /nfs/dbraw/zinc/26/94/64/388269464.db2.gz PBILCFHPMRKZID-HUUCEWRRSA-N 1 1 241.419 3.702 20 0 BHADMO CCCCC[N@@H+](C[C@@H]1CCO[C@@H](C)C1)C(C)C ZINC000491114415 388269552 /nfs/dbraw/zinc/26/95/52/388269552.db2.gz PBILCFHPMRKZID-LSDHHAIUSA-N 1 1 241.419 3.702 20 0 BHADMO CCC(CC)C[N@@H+](CC)C[C@@H]1CCO[C@@H](C)C1 ZINC000491115868 388270429 /nfs/dbraw/zinc/27/04/29/388270429.db2.gz SUMFHEMRPBZCOW-DZGCQCFKSA-N 1 1 241.419 3.560 20 0 BHADMO CCC(CC)C[N@@H+](CC)C[C@H]1CCO[C@H](C)C1 ZINC000491115872 388270608 /nfs/dbraw/zinc/27/06/08/388270608.db2.gz SUMFHEMRPBZCOW-HIFRSBDPSA-N 1 1 241.419 3.560 20 0 BHADMO CCC(CC)C[N@@H+](CC)C[C@@H]1CCO[C@H](C)C1 ZINC000491115873 388270510 /nfs/dbraw/zinc/27/05/10/388270510.db2.gz SUMFHEMRPBZCOW-UKRRQHHQSA-N 1 1 241.419 3.560 20 0 BHADMO CCC(CC)C[N@@H+](CC)C[C@H]1CCO[C@@H](C)C1 ZINC000491115876 388270355 /nfs/dbraw/zinc/27/03/55/388270355.db2.gz SUMFHEMRPBZCOW-ZFWWWQNUSA-N 1 1 241.419 3.560 20 0 BHADMO CC[C@@H](c1ccccc1)[N@H+]1CC[C@@H](C2CC2)C1 ZINC000491117853 388270533 /nfs/dbraw/zinc/27/05/33/388270533.db2.gz PUJXTGVRQYYGPN-CVEARBPZSA-N 1 1 229.367 3.870 20 0 BHADMO CC[C@@H](c1ccccc1)[N@H+]1CC[C@H](C2CC2)C1 ZINC000491117858 388270312 /nfs/dbraw/zinc/27/03/12/388270312.db2.gz PUJXTGVRQYYGPN-HOTGVXAUSA-N 1 1 229.367 3.870 20 0 BHADMO CC[C@H](c1ccccc1)[N@H+]1CC[C@@H](C2CC2)C1 ZINC000491117859 388270492 /nfs/dbraw/zinc/27/04/92/388270492.db2.gz PUJXTGVRQYYGPN-HZPDHXFCSA-N 1 1 229.367 3.870 20 0 BHADMO CC[C@H](c1ccccc1)[N@H+]1CC[C@H](C2CC2)C1 ZINC000491117860 388270563 /nfs/dbraw/zinc/27/05/63/388270563.db2.gz PUJXTGVRQYYGPN-JKSUJKDBSA-N 1 1 229.367 3.870 20 0 BHADMO c1ccc(SCC[N@H+]2CC[C@H](C3CC3)C2)cc1 ZINC000491133959 388272777 /nfs/dbraw/zinc/27/27/77/388272777.db2.gz UUSLJYFVCYHWRO-AWEZNQCLSA-N 1 1 247.407 3.511 20 0 BHADMO c1ccc(SCC[N@H+]2CC[C@@H](C3CC3)C2)cc1 ZINC000491133968 388272668 /nfs/dbraw/zinc/27/26/68/388272668.db2.gz UUSLJYFVCYHWRO-CQSZACIVSA-N 1 1 247.407 3.511 20 0 BHADMO CSCCC[N@@H+](C(C)C)C1CCCCC1 ZINC000491134060 388272612 /nfs/dbraw/zinc/27/26/12/388272612.db2.gz VBIANYLZKSYFAU-UHFFFAOYSA-N 1 1 229.433 3.783 20 0 BHADMO Clc1ccccc1C[N@H+]1CC[C@@H](C2CC2)C1 ZINC000491134870 388272878 /nfs/dbraw/zinc/27/28/78/388272878.db2.gz XHRBDKQSMPOLMS-GFCCVEGCSA-N 1 1 235.758 3.572 20 0 BHADMO Clc1ccccc1C[N@H+]1CC[C@H](C2CC2)C1 ZINC000491134876 388272741 /nfs/dbraw/zinc/27/27/41/388272741.db2.gz XHRBDKQSMPOLMS-LBPRGKRZSA-N 1 1 235.758 3.572 20 0 BHADMO CSc1ccc(C[N@H+]2CC[C@H](C3CC3)C2)cc1 ZINC000491135904 388272921 /nfs/dbraw/zinc/27/29/21/388272921.db2.gz ZVTWHGSVLNNQCL-AWEZNQCLSA-N 1 1 247.407 3.640 20 0 BHADMO CSc1ccc(C[N@H+]2CC[C@@H](C3CC3)C2)cc1 ZINC000491135906 388272771 /nfs/dbraw/zinc/27/27/71/388272771.db2.gz ZVTWHGSVLNNQCL-CQSZACIVSA-N 1 1 247.407 3.640 20 0 BHADMO Cc1ccc(F)cc1C[N@H+](C)C(C1CC1)C1CC1 ZINC000491139595 388272567 /nfs/dbraw/zinc/27/25/67/388272567.db2.gz QTTPGBWIWRXBPW-UHFFFAOYSA-N 1 1 247.357 3.755 20 0 BHADMO Cc1ccccc1[C@H](C)[N@H+]1CC[C@@H](C2CC2)C1 ZINC000491141290 388272563 /nfs/dbraw/zinc/27/25/63/388272563.db2.gz QUOOGLZHUGHVDS-DZGCQCFKSA-N 1 1 229.367 3.788 20 0 BHADMO Cc1ccccc1[C@@H](C)[N@H+]1CC[C@H](C2CC2)C1 ZINC000491141293 388272857 /nfs/dbraw/zinc/27/28/57/388272857.db2.gz QUOOGLZHUGHVDS-HIFRSBDPSA-N 1 1 229.367 3.788 20 0 BHADMO Cc1ccccc1[C@@H](C)[N@H+]1CC[C@@H](C2CC2)C1 ZINC000491141915 388272912 /nfs/dbraw/zinc/27/29/12/388272912.db2.gz QUOOGLZHUGHVDS-UKRRQHHQSA-N 1 1 229.367 3.788 20 0 BHADMO Cc1ccccc1[C@H](C)[N@H+]1CC[C@H](C2CC2)C1 ZINC000491141918 388272758 /nfs/dbraw/zinc/27/27/58/388272758.db2.gz QUOOGLZHUGHVDS-ZFWWWQNUSA-N 1 1 229.367 3.788 20 0 BHADMO Clc1ccc(C[N@H+]2CC[C@H](C3CC3)C2)s1 ZINC000491142509 388272710 /nfs/dbraw/zinc/27/27/10/388272710.db2.gz ZJWDWMFHAUEIBU-JTQLQIEISA-N 1 1 241.787 3.633 20 0 BHADMO Clc1ccc(C[N@H+]2CC[C@@H](C3CC3)C2)s1 ZINC000491142525 388272442 /nfs/dbraw/zinc/27/24/42/388272442.db2.gz ZJWDWMFHAUEIBU-SNVBAGLBSA-N 1 1 241.787 3.633 20 0 BHADMO CC[C@H]1CCC[N@H+]1Cc1cc(F)ccc1C ZINC000491147633 388273658 /nfs/dbraw/zinc/27/36/58/388273658.db2.gz PXHXSBQJIXLTOK-AWEZNQCLSA-N 1 1 221.319 3.509 20 0 BHADMO CC[C@@H]1CCC[N@H+]1Cc1cc(F)ccc1C ZINC000491147634 388273384 /nfs/dbraw/zinc/27/33/84/388273384.db2.gz PXHXSBQJIXLTOK-CQSZACIVSA-N 1 1 221.319 3.509 20 0 BHADMO Clc1cccc(C[N@H+]2CC[C@@H](C3CC3)C2)c1 ZINC000491160656 229192345 /nfs/dbraw/zinc/19/23/45/229192345.db2.gz IRJMBHRSGYJEEG-CYBMUJFWSA-N 1 1 235.758 3.572 20 0 BHADMO Clc1cccc(C[N@H+]2CC[C@H](C3CC3)C2)c1 ZINC000491160657 229192310 /nfs/dbraw/zinc/19/23/10/229192310.db2.gz IRJMBHRSGYJEEG-ZDUSSCGKSA-N 1 1 235.758 3.572 20 0 BHADMO C[C@@H](C[N@H+]1CC[C@H](C2CC2)C1)c1ccccc1 ZINC000491162391 388273775 /nfs/dbraw/zinc/27/37/75/388273775.db2.gz NSJJXYZFYZBBHL-BBRMVZONSA-N 1 1 229.367 3.522 20 0 BHADMO C[C@H](C[N@H+]1CC[C@H](C2CC2)C1)c1ccccc1 ZINC000491162392 388273625 /nfs/dbraw/zinc/27/36/25/388273625.db2.gz NSJJXYZFYZBBHL-CJNGLKHVSA-N 1 1 229.367 3.522 20 0 BHADMO C[C@H](C[N@H+]1CC[C@@H](C2CC2)C1)c1ccccc1 ZINC000491162393 388273380 /nfs/dbraw/zinc/27/33/80/388273380.db2.gz NSJJXYZFYZBBHL-CZUORRHYSA-N 1 1 229.367 3.522 20 0 BHADMO C[C@@H](C[N@H+]1CC[C@@H](C2CC2)C1)c1ccccc1 ZINC000491162394 388273580 /nfs/dbraw/zinc/27/35/80/388273580.db2.gz NSJJXYZFYZBBHL-XJKSGUPXSA-N 1 1 229.367 3.522 20 0 BHADMO CC(C)OCCC[N@@H+](C(C)C)C1CCCCC1 ZINC000491172180 388274510 /nfs/dbraw/zinc/27/45/10/388274510.db2.gz BYCMJPIDVFQQOK-UHFFFAOYSA-N 1 1 241.419 3.845 20 0 BHADMO C[C@H](CCc1ccccc1)[N@H+]1CC[C@H](C2CC2)C1 ZINC000491173489 388274180 /nfs/dbraw/zinc/27/41/80/388274180.db2.gz MMEMNXZTXZSZEE-PBHICJAKSA-N 1 1 243.394 3.740 20 0 BHADMO C[C@H](CCc1ccccc1)[N@H+]1CC[C@@H](C2CC2)C1 ZINC000491173508 388274559 /nfs/dbraw/zinc/27/45/59/388274559.db2.gz MMEMNXZTXZSZEE-RHSMWYFYSA-N 1 1 243.394 3.740 20 0 BHADMO C[C@@H](CCc1ccccc1)[N@H+]1CC[C@@H](C2CC2)C1 ZINC000491173511 388274254 /nfs/dbraw/zinc/27/42/54/388274254.db2.gz MMEMNXZTXZSZEE-WMLDXEAASA-N 1 1 243.394 3.740 20 0 BHADMO C[C@@H](CCc1ccccc1)[N@H+]1CC[C@H](C2CC2)C1 ZINC000491173513 388274004 /nfs/dbraw/zinc/27/40/04/388274004.db2.gz MMEMNXZTXZSZEE-YOEHRIQHSA-N 1 1 243.394 3.740 20 0 BHADMO Cc1cccc([C@H](C)[N@H+]2CC[C@H](C3CC3)C2)c1 ZINC000491174095 388274176 /nfs/dbraw/zinc/27/41/76/388274176.db2.gz PIAHITUTUQAIAZ-BBRMVZONSA-N 1 1 229.367 3.788 20 0 BHADMO Cc1cccc([C@@H](C)[N@H+]2CC[C@H](C3CC3)C2)c1 ZINC000491174096 388273984 /nfs/dbraw/zinc/27/39/84/388273984.db2.gz PIAHITUTUQAIAZ-CJNGLKHVSA-N 1 1 229.367 3.788 20 0 BHADMO Cc1cccc([C@@H](C)[N@H+]2CC[C@@H](C3CC3)C2)c1 ZINC000491174097 388274327 /nfs/dbraw/zinc/27/43/27/388274327.db2.gz PIAHITUTUQAIAZ-CZUORRHYSA-N 1 1 229.367 3.788 20 0 BHADMO Cc1cccc([C@H](C)[N@H+]2CC[C@@H](C3CC3)C2)c1 ZINC000491174098 388273970 /nfs/dbraw/zinc/27/39/70/388273970.db2.gz PIAHITUTUQAIAZ-XJKSGUPXSA-N 1 1 229.367 3.788 20 0 BHADMO CC(C)[N@@H+](CCC(F)(F)F)C1CCCCC1 ZINC000491175004 388274588 /nfs/dbraw/zinc/27/45/88/388274588.db2.gz UBVCQFUISIZMHG-UHFFFAOYSA-N 1 1 237.309 3.982 20 0 BHADMO c1ccc2c(c1)CCC[C@H]2[N@H+]1CC[C@H](C2CC2)C1 ZINC000491187147 388275644 /nfs/dbraw/zinc/27/56/44/388275644.db2.gz QKVBCTZHJGEBKY-DOTOQJQBSA-N 1 1 241.378 3.796 20 0 BHADMO c1ccc2c(c1)CCC[C@H]2[N@H+]1CC[C@@H](C2CC2)C1 ZINC000491187148 388275479 /nfs/dbraw/zinc/27/54/79/388275479.db2.gz QKVBCTZHJGEBKY-NVXWUHKLSA-N 1 1 241.378 3.796 20 0 BHADMO c1ccc2c(c1)CCC[C@@H]2[N@H+]1CC[C@H](C2CC2)C1 ZINC000491187149 388275549 /nfs/dbraw/zinc/27/55/49/388275549.db2.gz QKVBCTZHJGEBKY-RDJZCZTQSA-N 1 1 241.378 3.796 20 0 BHADMO c1ccc2c(c1)CCC[C@@H]2[N@H+]1CC[C@@H](C2CC2)C1 ZINC000491187150 388276109 /nfs/dbraw/zinc/27/61/09/388276109.db2.gz QKVBCTZHJGEBKY-WBVHZDCISA-N 1 1 241.378 3.796 20 0 BHADMO CCC(C)(C)[N@@H+](C)Cc1cc(F)ccc1C ZINC000491217210 388278034 /nfs/dbraw/zinc/27/80/34/388278034.db2.gz NUWBZLBVJFLRIA-UHFFFAOYSA-N 1 1 223.335 3.755 20 0 BHADMO Cc1cc(C)cc(C[N@H+]2CC[C@H](C3CC3)C2)c1 ZINC000491230936 388278788 /nfs/dbraw/zinc/27/87/88/388278788.db2.gz DAPMNBVGEDPWLX-INIZCTEOSA-N 1 1 229.367 3.535 20 0 BHADMO Cc1cc(C)cc(C[N@H+]2CC[C@@H](C3CC3)C2)c1 ZINC000491230940 388278668 /nfs/dbraw/zinc/27/86/68/388278668.db2.gz DAPMNBVGEDPWLX-MRXNPFEDSA-N 1 1 229.367 3.535 20 0 BHADMO Fc1ccc2c(c1)[C@@H]([N@H+]1CC[C@H](C3CC3)C1)CC2 ZINC000491232407 388278493 /nfs/dbraw/zinc/27/84/93/388278493.db2.gz MEHDHTQLYABIHX-BBRMVZONSA-N 1 1 245.341 3.545 20 0 BHADMO Fc1ccc2c(c1)[C@@H]([N@H+]1CC[C@@H](C3CC3)C1)CC2 ZINC000491232408 388278551 /nfs/dbraw/zinc/27/85/51/388278551.db2.gz MEHDHTQLYABIHX-CJNGLKHVSA-N 1 1 245.341 3.545 20 0 BHADMO Fc1ccc2c(c1)[C@H]([N@H+]1CC[C@@H](C3CC3)C1)CC2 ZINC000491232409 388278391 /nfs/dbraw/zinc/27/83/91/388278391.db2.gz MEHDHTQLYABIHX-CZUORRHYSA-N 1 1 245.341 3.545 20 0 BHADMO Fc1ccc2c(c1)[C@H]([N@H+]1CC[C@H](C3CC3)C1)CC2 ZINC000491232410 388278412 /nfs/dbraw/zinc/27/84/12/388278412.db2.gz MEHDHTQLYABIHX-XJKSGUPXSA-N 1 1 245.341 3.545 20 0 BHADMO C[C@@H](c1ccccc1F)[N@H+]1CC[C@H](C2CC2)C1 ZINC000491255365 388280908 /nfs/dbraw/zinc/28/09/08/388280908.db2.gz NJNNSWZANKQAEB-AAEUAGOBSA-N 1 1 233.330 3.619 20 0 BHADMO C[C@H](c1ccccc1F)[N@H+]1CC[C@@H](C2CC2)C1 ZINC000491255374 388280884 /nfs/dbraw/zinc/28/08/84/388280884.db2.gz NJNNSWZANKQAEB-DGCLKSJQSA-N 1 1 233.330 3.619 20 0 BHADMO C[C@@H](c1ccccc1F)[N@H+]1CC[C@@H](C2CC2)C1 ZINC000491255376 388280831 /nfs/dbraw/zinc/28/08/31/388280831.db2.gz NJNNSWZANKQAEB-WCQYABFASA-N 1 1 233.330 3.619 20 0 BHADMO C[C@H](c1ccccc1F)[N@H+]1CC[C@H](C2CC2)C1 ZINC000491255378 388280879 /nfs/dbraw/zinc/28/08/79/388280879.db2.gz NJNNSWZANKQAEB-YPMHNXCESA-N 1 1 233.330 3.619 20 0 BHADMO CC(C)[N@@H+](CCC1CC1)C1CCCCC1 ZINC000491276338 388281228 /nfs/dbraw/zinc/28/12/28/388281228.db2.gz DNXKXYZFVWFWQW-UHFFFAOYSA-N 1 1 209.377 3.830 20 0 BHADMO Cc1cccc(C)c1C[N@H+]1CC[C@H](C2CC2)C1 ZINC000491280468 388281733 /nfs/dbraw/zinc/28/17/33/388281733.db2.gz ZPTQJLFOQLKEIR-HNNXBMFYSA-N 1 1 229.367 3.535 20 0 BHADMO Cc1cccc(C)c1C[N@H+]1CC[C@@H](C2CC2)C1 ZINC000491280469 388282101 /nfs/dbraw/zinc/28/21/01/388282101.db2.gz ZPTQJLFOQLKEIR-OAHLLOKOSA-N 1 1 229.367 3.535 20 0 BHADMO CC(C)[N@@H+](CC1CCC1)C1CCCCC1 ZINC000491287889 388282319 /nfs/dbraw/zinc/28/23/19/388282319.db2.gz BVHBUESHSRCKHA-UHFFFAOYSA-N 1 1 209.377 3.830 20 0 BHADMO CCSCC[N@@H+](C(C)C)C1CCCCC1 ZINC000491289910 388283211 /nfs/dbraw/zinc/28/32/11/388283211.db2.gz UPVRSDJRJWANTL-UHFFFAOYSA-N 1 1 229.433 3.783 20 0 BHADMO Clc1ccc(C[N@H+]2CC[C@@H](C3CC3)C2)cc1 ZINC000491300304 388284012 /nfs/dbraw/zinc/28/40/12/388284012.db2.gz HINRKWSOOKQAHC-CYBMUJFWSA-N 1 1 235.758 3.572 20 0 BHADMO Clc1ccc(C[N@H+]2CC[C@H](C3CC3)C2)cc1 ZINC000491300305 388283817 /nfs/dbraw/zinc/28/38/17/388283817.db2.gz HINRKWSOOKQAHC-ZDUSSCGKSA-N 1 1 235.758 3.572 20 0 BHADMO Cc1ccc(C)c(C[N@H+]2CC[C@H](C3CC3)C2)c1 ZINC000491300980 411392442 /nfs/dbraw/zinc/39/24/42/411392442.db2.gz QPMMZYNUXDNWBO-HNNXBMFYSA-N 1 1 229.367 3.535 20 0 BHADMO Cc1ccc(C)c(C[N@H+]2CC[C@@H](C3CC3)C2)c1 ZINC000491300981 411392223 /nfs/dbraw/zinc/39/22/23/411392223.db2.gz QPMMZYNUXDNWBO-OAHLLOKOSA-N 1 1 229.367 3.535 20 0 BHADMO CC[C@@H]1C[N@H+]([C@H](C)c2cccc(C)c2)C[C@@H](C)O1 ZINC000491357703 388288099 /nfs/dbraw/zinc/28/80/99/388288099.db2.gz AZDIDKAPJVEKLC-IIAWOOMASA-N 1 1 247.382 3.555 20 0 BHADMO CC[C@@H]1C[N@H+]([C@@H](C)c2cccc(C)c2)C[C@@H](C)O1 ZINC000491357704 388287964 /nfs/dbraw/zinc/28/79/64/388287964.db2.gz AZDIDKAPJVEKLC-IJEWVQPXSA-N 1 1 247.382 3.555 20 0 BHADMO CC[C@@H]1C[N@H+]([C@@H](C)c2cccc(C)c2)C[C@H](C)O1 ZINC000491357705 388287934 /nfs/dbraw/zinc/28/79/34/388287934.db2.gz AZDIDKAPJVEKLC-OFQRWUPVSA-N 1 1 247.382 3.555 20 0 BHADMO CC[C@@H]1C[N@H+]([C@H](C)c2cccc(C)c2)C[C@H](C)O1 ZINC000491357706 388288151 /nfs/dbraw/zinc/28/81/51/388288151.db2.gz AZDIDKAPJVEKLC-SQWLQELKSA-N 1 1 247.382 3.555 20 0 BHADMO C[C@H]1CC[N@H+]([C@H]2CCc3c2cccc3Cl)C1 ZINC000491358173 388288273 /nfs/dbraw/zinc/28/82/73/388288273.db2.gz DFZIZQWZRMYFDY-HZMBPMFUSA-N 1 1 235.758 3.669 20 0 BHADMO C[C@H]1CC[N@H+]([C@@H]2CCc3c2cccc3Cl)C1 ZINC000491358174 388288250 /nfs/dbraw/zinc/28/82/50/388288250.db2.gz DFZIZQWZRMYFDY-IINYFYTJSA-N 1 1 235.758 3.669 20 0 BHADMO C[C@@H]1CC[N@H+]([C@@H]2CCc3c2cccc3Cl)C1 ZINC000491358175 388288241 /nfs/dbraw/zinc/28/82/41/388288241.db2.gz DFZIZQWZRMYFDY-QMTHXVAHSA-N 1 1 235.758 3.669 20 0 BHADMO C[C@@H]1CC[N@H+]([C@H]2CCc3c2cccc3Cl)C1 ZINC000491358176 388288175 /nfs/dbraw/zinc/28/81/75/388288175.db2.gz DFZIZQWZRMYFDY-YGRLFVJLSA-N 1 1 235.758 3.669 20 0 BHADMO C[C@H](c1ccc2c(c1)CCC2)[N@H+]1CC[C@@H](C)C1 ZINC000491375835 388289672 /nfs/dbraw/zinc/28/96/72/388289672.db2.gz PAEDZLQJZAFVLI-CHWSQXEVSA-N 1 1 229.367 3.578 20 0 BHADMO C[C@@H](c1ccc2c(c1)CCC2)[N@H+]1CC[C@@H](C)C1 ZINC000491375836 388289629 /nfs/dbraw/zinc/28/96/29/388289629.db2.gz PAEDZLQJZAFVLI-OLZOCXBDSA-N 1 1 229.367 3.578 20 0 BHADMO C[C@H](c1ccc2c(c1)CCC2)[N@H+]1CC[C@H](C)C1 ZINC000491376133 388289796 /nfs/dbraw/zinc/28/97/96/388289796.db2.gz PAEDZLQJZAFVLI-QWHCGFSZSA-N 1 1 229.367 3.578 20 0 BHADMO C[C@@H](c1ccc2c(c1)CCC2)[N@H+]1CC[C@H](C)C1 ZINC000491376134 388289624 /nfs/dbraw/zinc/28/96/24/388289624.db2.gz PAEDZLQJZAFVLI-STQMWFEESA-N 1 1 229.367 3.578 20 0 BHADMO Cc1cccc([C@H](C)[N@H+]2C[C@H](C)OC(C)(C)C2)c1 ZINC000491377346 388289693 /nfs/dbraw/zinc/28/96/93/388289693.db2.gz WXRLJQSOKLFROW-KBPBESRZSA-N 1 1 247.382 3.555 20 0 BHADMO Cc1cccc([C@H](C)[N@H+]2C[C@@H](C)OC(C)(C)C2)c1 ZINC000491377347 388289925 /nfs/dbraw/zinc/28/99/25/388289925.db2.gz WXRLJQSOKLFROW-KGLIPLIRSA-N 1 1 247.382 3.555 20 0 BHADMO Cc1cccc([C@@H](C)[N@H+]2C[C@H](C)OC(C)(C)C2)c1 ZINC000491377348 388289686 /nfs/dbraw/zinc/28/96/86/388289686.db2.gz WXRLJQSOKLFROW-UONOGXRCSA-N 1 1 247.382 3.555 20 0 BHADMO Cc1cccc([C@@H](C)[N@H+]2C[C@@H](C)OC(C)(C)C2)c1 ZINC000491377349 225646596 /nfs/dbraw/zinc/64/65/96/225646596.db2.gz WXRLJQSOKLFROW-ZIAGYGMSSA-N 1 1 247.382 3.555 20 0 BHADMO CC[C@@H]1CCCC[C@H]1[N@@H+](C)CCC(F)(F)F ZINC000491397755 388291813 /nfs/dbraw/zinc/29/18/13/388291813.db2.gz DPMJWRBPSHVKAU-GHMZBOCLSA-N 1 1 237.309 3.839 20 0 BHADMO CC[C@@H]1CCCC[C@@H]1[N@@H+](C)CCC(F)(F)F ZINC000491397756 388291764 /nfs/dbraw/zinc/29/17/64/388291764.db2.gz DPMJWRBPSHVKAU-MNOVXSKESA-N 1 1 237.309 3.839 20 0 BHADMO CC[C@H]1CCCC[C@@H]1[N@@H+](C)CCC(F)(F)F ZINC000491397757 388292081 /nfs/dbraw/zinc/29/20/81/388292081.db2.gz DPMJWRBPSHVKAU-QWRGUYRKSA-N 1 1 237.309 3.839 20 0 BHADMO CC[C@H]1CCCC[C@H]1[N@@H+](C)CCC(F)(F)F ZINC000491397758 388291807 /nfs/dbraw/zinc/29/18/07/388291807.db2.gz DPMJWRBPSHVKAU-WDEREUQCSA-N 1 1 237.309 3.839 20 0 BHADMO CCc1cccc(F)c1C[NH2+]Cc1occc1C ZINC000491419279 388293529 /nfs/dbraw/zinc/29/35/29/388293529.db2.gz WTIPRIIBWJARCN-UHFFFAOYSA-N 1 1 247.313 3.579 20 0 BHADMO Cc1ccc(F)cc1C[N@@H+]1CCCC[C@H]1C ZINC000491857626 388325063 /nfs/dbraw/zinc/32/50/63/388325063.db2.gz ZCKIICMQAOWQMI-GFCCVEGCSA-N 1 1 221.319 3.509 20 0 BHADMO Cc1ccc(F)cc1C[N@@H+]1CCCC[C@@H]1C ZINC000491857627 388324851 /nfs/dbraw/zinc/32/48/51/388324851.db2.gz ZCKIICMQAOWQMI-LBPRGKRZSA-N 1 1 221.319 3.509 20 0 BHADMO Cc1ccc(F)cc1C[N@@H+](C)Cc1ccccc1 ZINC000491954162 388329616 /nfs/dbraw/zinc/32/96/16/388329616.db2.gz CRMVNARQXOVJGK-UHFFFAOYSA-N 1 1 243.325 3.766 20 0 BHADMO CCCC[N@@H+](C)Cc1ccc([C@H]2C[C@@H]2C)o1 ZINC000492054152 388333195 /nfs/dbraw/zinc/33/31/95/388333195.db2.gz KCFPHEZZILSEHO-AAEUAGOBSA-N 1 1 221.344 3.635 20 0 BHADMO CCCC[N@@H+](C)Cc1ccc([C@@H]2C[C@H]2C)o1 ZINC000492054153 388333144 /nfs/dbraw/zinc/33/31/44/388333144.db2.gz KCFPHEZZILSEHO-DGCLKSJQSA-N 1 1 221.344 3.635 20 0 BHADMO CCCC[N@@H+](C)Cc1ccc([C@@H]2C[C@@H]2C)o1 ZINC000492054154 388333044 /nfs/dbraw/zinc/33/30/44/388333044.db2.gz KCFPHEZZILSEHO-WCQYABFASA-N 1 1 221.344 3.635 20 0 BHADMO CCCC[N@@H+](C)Cc1ccc([C@H]2C[C@H]2C)o1 ZINC000492054155 388333062 /nfs/dbraw/zinc/33/30/62/388333062.db2.gz KCFPHEZZILSEHO-YPMHNXCESA-N 1 1 221.344 3.635 20 0 BHADMO CCC[N@@H+](CCCOC(C)C)Cc1ccccc1 ZINC000492056487 388333138 /nfs/dbraw/zinc/33/31/38/388333138.db2.gz WZGYXPCBRSNCAY-UHFFFAOYSA-N 1 1 249.398 3.714 20 0 BHADMO Cc1ccc(C[N@H+](C)CCCOC(C)C)c(C)c1 ZINC000492093594 533871815 /nfs/dbraw/zinc/87/18/15/533871815.db2.gz GKGRPCDMQWOKDJ-UHFFFAOYSA-N 1 1 249.398 3.550 20 0 BHADMO CCCC[N@@H+](C)[C@@H](C)c1ccc(C)cc1 ZINC000492166592 388337152 /nfs/dbraw/zinc/33/71/52/388337152.db2.gz FLLRUFRYESDDBC-ZDUSSCGKSA-N 1 1 205.345 3.788 20 0 BHADMO CCC(CC)C[N@@H+](CC)CCCOC(C)C ZINC000492170133 388337326 /nfs/dbraw/zinc/33/73/26/388337326.db2.gz UOUIUFGWOWWRRM-UHFFFAOYSA-N 1 1 229.408 3.560 20 0 BHADMO Cc1ccc([C@H](C)[N@H+](C)CCCOC(C)C)cc1 ZINC000492170962 388337236 /nfs/dbraw/zinc/33/72/36/388337236.db2.gz YLHDRYAKAJHEFA-HNNXBMFYSA-N 1 1 249.398 3.803 20 0 BHADMO Cc1ccc([C@@H](C)[N@H+](C)CCCOC(C)C)cc1 ZINC000492170964 388337349 /nfs/dbraw/zinc/33/73/49/388337349.db2.gz YLHDRYAKAJHEFA-OAHLLOKOSA-N 1 1 249.398 3.803 20 0 BHADMO CC[N@@H+](CCCOC(C)C)Cc1ccccc1C ZINC000492194989 388338103 /nfs/dbraw/zinc/33/81/03/388338103.db2.gz NBYWFHGBDOMGGI-UHFFFAOYSA-N 1 1 249.398 3.632 20 0 BHADMO Cc1ccccc1[C@H](C)[N@H+](C)CCCOC(C)C ZINC000492210575 388338331 /nfs/dbraw/zinc/33/83/31/388338331.db2.gz YBNBRMUXJGLHRP-HNNXBMFYSA-N 1 1 249.398 3.803 20 0 BHADMO Cc1ccccc1[C@@H](C)[N@H+](C)CCCOC(C)C ZINC000492210576 225957014 /nfs/dbraw/zinc/95/70/14/225957014.db2.gz YBNBRMUXJGLHRP-OAHLLOKOSA-N 1 1 249.398 3.803 20 0 BHADMO CCCCC[N@@H+](CCCOC(C)C)C(C)C ZINC000492219691 388338530 /nfs/dbraw/zinc/33/85/30/388338530.db2.gz JSERALINLOHRJA-UHFFFAOYSA-N 1 1 229.408 3.702 20 0 BHADMO CCCC[N@@H+](C)CCc1ccc(Cl)cc1 ZINC000492308334 388341166 /nfs/dbraw/zinc/34/11/66/388341166.db2.gz LMKJKVUFTRUKJI-UHFFFAOYSA-N 1 1 225.763 3.614 20 0 BHADMO C[N@H+](CCc1ccc(Cl)cc1)CCC1CC1 ZINC000492421121 388343891 /nfs/dbraw/zinc/34/38/91/388343891.db2.gz GYTBGYDRPFQELA-UHFFFAOYSA-N 1 1 237.774 3.614 20 0 BHADMO C[N@@H+](CCc1ccc(Cl)cc1)CC1CCC1 ZINC000492469909 529932796 /nfs/dbraw/zinc/93/27/96/529932796.db2.gz YSRYXIHTBCMEOW-UHFFFAOYSA-N 1 1 237.774 3.614 20 0 BHADMO FC1=CCC[N@@H+](Cc2ccc3ccccc3c2)C1 ZINC000492685402 226037977 /nfs/dbraw/zinc/03/79/77/226037977.db2.gz VKOVPEOHLUDJOA-UHFFFAOYSA-N 1 1 241.309 3.899 20 0 BHADMO FC1=CCC[N@H+](Cc2ccc3ccccc3c2)C1 ZINC000492685402 226037974 /nfs/dbraw/zinc/03/79/74/226037974.db2.gz VKOVPEOHLUDJOA-UHFFFAOYSA-N 1 1 241.309 3.899 20 0 BHADMO FC1=CCC[N@@H+](CCC2CCCCC2)C1 ZINC000492727174 226042761 /nfs/dbraw/zinc/04/27/61/226042761.db2.gz GQRXJMLGSNKVTR-UHFFFAOYSA-N 1 1 211.324 3.516 20 0 BHADMO C[C@H](C1CCC1)[N@@H+](C)CCCc1cccc(F)c1 ZINC000492877812 533585455 /nfs/dbraw/zinc/58/54/55/533585455.db2.gz MHHWAKRJJSTKDQ-CYBMUJFWSA-N 1 1 249.373 3.879 20 0 BHADMO C[C@@H](C1CCC1)[N@@H+](C)CCCc1cccc(F)c1 ZINC000492877813 533385187 /nfs/dbraw/zinc/38/51/87/533385187.db2.gz MHHWAKRJJSTKDQ-ZDUSSCGKSA-N 1 1 249.373 3.879 20 0 BHADMO C[C@H](CCc1ccccc1)[N@H+]1CCC=C(F)C1 ZINC000492973962 533992749 /nfs/dbraw/zinc/99/27/49/533992749.db2.gz VFFPCOSJEFBXKD-CYBMUJFWSA-N 1 1 233.330 3.567 20 0 BHADMO C[C@@H](CCc1ccccc1)[N@H+]1CCC=C(F)C1 ZINC000492973963 533673927 /nfs/dbraw/zinc/67/39/27/533673927.db2.gz VFFPCOSJEFBXKD-ZDUSSCGKSA-N 1 1 233.330 3.567 20 0 BHADMO CCCCC[N@@H+](C)Cc1cccc2[nH]ccc21 ZINC000494008982 528164683 /nfs/dbraw/zinc/16/46/83/528164683.db2.gz YYJQCDAXYIXEEZ-UHFFFAOYSA-N 1 1 230.355 3.790 20 0 BHADMO CC[C@H](c1ccccc1)[N@H+]1CCS[C@@H](C)CC1 ZINC000494019335 529182676 /nfs/dbraw/zinc/18/26/76/529182676.db2.gz TZLDYLLCYOAHMZ-DZGCQCFKSA-N 1 1 249.423 3.965 20 0 BHADMO CC[C@@H](c1ccccc1)[N@H+]1CCS[C@H](C)CC1 ZINC000494019336 529257063 /nfs/dbraw/zinc/25/70/63/529257063.db2.gz TZLDYLLCYOAHMZ-HIFRSBDPSA-N 1 1 249.423 3.965 20 0 BHADMO CC[C@H](c1ccccc1)[N@H+]1CCS[C@H](C)CC1 ZINC000494019337 529182105 /nfs/dbraw/zinc/18/21/05/529182105.db2.gz TZLDYLLCYOAHMZ-UKRRQHHQSA-N 1 1 249.423 3.965 20 0 BHADMO CC[C@@H](c1ccccc1)[N@H+]1CCS[C@@H](C)CC1 ZINC000494019338 529257023 /nfs/dbraw/zinc/25/70/23/529257023.db2.gz TZLDYLLCYOAHMZ-ZFWWWQNUSA-N 1 1 249.423 3.965 20 0 BHADMO CC/C=C\CC[N@@H+](C)Cc1cccc2[nH]ccc21 ZINC000494040521 528787289 /nfs/dbraw/zinc/78/72/89/528787289.db2.gz XXNMTMZQKMVTMJ-PLNGDYQASA-N 1 1 242.366 3.956 20 0 BHADMO CC/C=C/CC[N@@H+](C)Cc1cccc2[nH]ccc21 ZINC000494040526 528768294 /nfs/dbraw/zinc/76/82/94/528768294.db2.gz XXNMTMZQKMVTMJ-SNAWJCMRSA-N 1 1 242.366 3.956 20 0 BHADMO CCc1ccc(C[N@H+]2CCS[C@H](C)CC2)cc1 ZINC000494088950 529642568 /nfs/dbraw/zinc/64/25/68/529642568.db2.gz KZROTBUUIGKKTR-CYBMUJFWSA-N 1 1 249.423 3.576 20 0 BHADMO CCc1ccc(C[N@H+]2CCS[C@@H](C)CC2)cc1 ZINC000494088951 529642446 /nfs/dbraw/zinc/64/24/46/529642446.db2.gz KZROTBUUIGKKTR-ZDUSSCGKSA-N 1 1 249.423 3.576 20 0 BHADMO C[N@@H+](Cc1cccc2[nH]ccc21)[C@H]1C=CCCC1 ZINC000494117762 529996071 /nfs/dbraw/zinc/99/60/71/529996071.db2.gz WVFYYKVGSSXCAP-AWEZNQCLSA-N 1 1 240.350 3.708 20 0 BHADMO C[N@@H+](Cc1cccc2[nH]ccc21)[C@@H]1C=CCCC1 ZINC000494117763 529996407 /nfs/dbraw/zinc/99/64/07/529996407.db2.gz WVFYYKVGSSXCAP-CQSZACIVSA-N 1 1 240.350 3.708 20 0 BHADMO Cc1ccccc1[C@H](C)[N@H+]1CCS[C@@H](C)CC1 ZINC000494129418 226261439 /nfs/dbraw/zinc/26/14/39/226261439.db2.gz YDZGNHMAAFMOMK-KBPBESRZSA-N 1 1 249.423 3.883 20 0 BHADMO Cc1ccccc1[C@H](C)[N@H+]1CCS[C@H](C)CC1 ZINC000494129419 226261396 /nfs/dbraw/zinc/26/13/96/226261396.db2.gz YDZGNHMAAFMOMK-KGLIPLIRSA-N 1 1 249.423 3.883 20 0 BHADMO Cc1ccccc1[C@@H](C)[N@H+]1CCS[C@@H](C)CC1 ZINC000494129420 226261364 /nfs/dbraw/zinc/26/13/64/226261364.db2.gz YDZGNHMAAFMOMK-UONOGXRCSA-N 1 1 249.423 3.883 20 0 BHADMO Cc1ccccc1[C@@H](C)[N@H+]1CCS[C@H](C)CC1 ZINC000494129421 226261520 /nfs/dbraw/zinc/26/15/20/226261520.db2.gz YDZGNHMAAFMOMK-ZIAGYGMSSA-N 1 1 249.423 3.883 20 0 BHADMO CCc1cccc(C[N@H+]2CCS[C@H](C)CC2)c1 ZINC000494137118 529169357 /nfs/dbraw/zinc/16/93/57/529169357.db2.gz OKUGPEXCNNZODD-CYBMUJFWSA-N 1 1 249.423 3.576 20 0 BHADMO CCc1cccc(C[N@H+]2CCS[C@@H](C)CC2)c1 ZINC000494137119 529169694 /nfs/dbraw/zinc/16/96/94/529169694.db2.gz OKUGPEXCNNZODD-ZDUSSCGKSA-N 1 1 249.423 3.576 20 0 BHADMO Cc1cccc([C@H](C)[N@H+]2CCS[C@@H](C)CC2)c1 ZINC000494137827 226261384 /nfs/dbraw/zinc/26/13/84/226261384.db2.gz UPOBGMRGZITNJE-KBPBESRZSA-N 1 1 249.423 3.883 20 0 BHADMO Cc1cccc([C@H](C)[N@H+]2CCS[C@H](C)CC2)c1 ZINC000494137828 226261413 /nfs/dbraw/zinc/26/14/13/226261413.db2.gz UPOBGMRGZITNJE-KGLIPLIRSA-N 1 1 249.423 3.883 20 0 BHADMO Cc1cccc([C@@H](C)[N@H+]2CCS[C@@H](C)CC2)c1 ZINC000494137829 226261318 /nfs/dbraw/zinc/26/13/18/226261318.db2.gz UPOBGMRGZITNJE-UONOGXRCSA-N 1 1 249.423 3.883 20 0 BHADMO Cc1cccc([C@@H](C)[N@H+]2CCS[C@H](C)CC2)c1 ZINC000494137830 226261435 /nfs/dbraw/zinc/26/14/35/226261435.db2.gz UPOBGMRGZITNJE-ZIAGYGMSSA-N 1 1 249.423 3.883 20 0 BHADMO Cc1cccc(C)c1C[N@H+]1CCS[C@@H](C)CC1 ZINC000494138215 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/nfs/dbraw/zinc/66/84/03/533668403.db2.gz SCQDOSHHDMFJEE-AWEZNQCLSA-N 1 1 249.423 3.631 20 0 BHADMO Cc1ccc(C)c(C[N@H+]2CCS[C@H](C)CC2)c1 ZINC000494146279 533668611 /nfs/dbraw/zinc/66/86/11/533668611.db2.gz SCQDOSHHDMFJEE-CQSZACIVSA-N 1 1 249.423 3.631 20 0 BHADMO CCc1ccccc1C[N@H+]1CCS[C@H](C)CC1 ZINC000494151691 529579629 /nfs/dbraw/zinc/57/96/29/529579629.db2.gz DOHXQHUJJOTGHO-CYBMUJFWSA-N 1 1 249.423 3.576 20 0 BHADMO CCc1ccccc1C[N@H+]1CCS[C@@H](C)CC1 ZINC000494151692 529580105 /nfs/dbraw/zinc/58/01/05/529580105.db2.gz DOHXQHUJJOTGHO-ZDUSSCGKSA-N 1 1 249.423 3.576 20 0 BHADMO CCSCC[N@@H+](C)C/C(C)=C\c1ccccc1 ZINC000494262659 529178697 /nfs/dbraw/zinc/17/86/97/529178697.db2.gz QIPPBKIJUPWPKP-OWBHPGMISA-N 1 1 249.423 3.775 20 0 BHADMO CCSCC[N@@H+](C)C/C(C)=C/c1ccccc1 ZINC000494262660 529178789 /nfs/dbraw/zinc/17/87/89/529178789.db2.gz QIPPBKIJUPWPKP-WYMLVPIESA-N 1 1 249.423 3.775 20 0 BHADMO C/C(=C/c1ccccc1)C[N@@H+](C)CC1CCC1 ZINC000494294037 527504899 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CCCCC[C@@H]1CCC[N@H+]1C[C@@H]1CCSC1 ZINC000494941807 528262214 /nfs/dbraw/zinc/26/22/14/528262214.db2.gz POYFBGUJQCBDPQ-UONOGXRCSA-N 1 1 241.444 3.784 20 0 BHADMO CCCCC[C@@H]1CCC[N@H+]1C[C@H]1CCSC1 ZINC000494941808 528262478 /nfs/dbraw/zinc/26/24/78/528262478.db2.gz POYFBGUJQCBDPQ-ZIAGYGMSSA-N 1 1 241.444 3.784 20 0 BHADMO CCn1cccc1C[N@@H+](C)[C@@H](C)c1ccccc1 ZINC000494942820 529547050 /nfs/dbraw/zinc/54/70/50/529547050.db2.gz RZYIMDIVDGUMJJ-AWEZNQCLSA-N 1 1 242.366 3.701 20 0 BHADMO CCn1cccc1C[N@@H+](C)[C@H](C)c1ccccc1 ZINC000494942821 529547287 /nfs/dbraw/zinc/54/72/87/529547287.db2.gz RZYIMDIVDGUMJJ-CQSZACIVSA-N 1 1 242.366 3.701 20 0 BHADMO CC(C)[C@@H]1CCCC[N@H+]1C/C=C/c1ccncc1 ZINC000494947580 528649711 /nfs/dbraw/zinc/64/97/11/528649711.db2.gz KRMSJMSWSSLUSG-JFDDCEBESA-N 1 1 244.382 3.605 20 0 BHADMO CC(C)[C@@H]1CCCC[N@H+]1C/C=C\c1ccncc1 ZINC000494947581 528649532 /nfs/dbraw/zinc/64/95/32/528649532.db2.gz KRMSJMSWSSLUSG-KJPDOMRESA-N 1 1 244.382 3.605 20 0 BHADMO CC(C)[C@H]1CCCC[N@H+]1C/C=C\c1ccncc1 ZINC000494947582 527760723 /nfs/dbraw/zinc/76/07/23/527760723.db2.gz KRMSJMSWSSLUSG-OGZRUICASA-N 1 1 244.382 3.605 20 0 BHADMO CC(C)[C@H]1CCCC[N@H+]1C/C=C/c1ccncc1 ZINC000494947583 527760462 /nfs/dbraw/zinc/76/04/62/527760462.db2.gz KRMSJMSWSSLUSG-SQRWCISFSA-N 1 1 244.382 3.605 20 0 BHADMO C[N@@H+](CCC1CCCCC1)C[C@@H]1CCSC1 ZINC000494949509 529877701 /nfs/dbraw/zinc/87/77/01/529877701.db2.gz MFAMNZKHZQIOIE-AWEZNQCLSA-N 1 1 241.444 3.642 20 0 BHADMO C[N@@H+](CCC1CCCCC1)C[C@H]1CCSC1 ZINC000494949510 529877522 /nfs/dbraw/zinc/87/75/22/529877522.db2.gz MFAMNZKHZQIOIE-CQSZACIVSA-N 1 1 241.444 3.642 20 0 BHADMO C[C@@H]1C[C@H](C)[N@@H+](Cc2cc(Cl)cs2)C1 ZINC000494956487 226272661 /nfs/dbraw/zinc/27/26/61/226272661.db2.gz MQYFVIRVRFMZKA-BDAKNGLRSA-N 1 1 229.776 3.632 20 0 BHADMO C[C@@H]1C[C@H](C)C[N@@H+]1Cc1cc(Cl)cs1 ZINC000494956488 533806009 /nfs/dbraw/zinc/80/60/09/533806009.db2.gz MQYFVIRVRFMZKA-DTWKUNHWSA-N 1 1 229.776 3.632 20 0 BHADMO C[C@H]1C[C@H](C)[N@@H+](Cc2cc(Cl)cs2)C1 ZINC000494956489 226272687 /nfs/dbraw/zinc/27/26/87/226272687.db2.gz MQYFVIRVRFMZKA-IUCAKERBSA-N 1 1 229.776 3.632 20 0 BHADMO C[C@@H]1C[C@@H](C)[N@@H+](Cc2cc(Cl)cs2)C1 ZINC000494956490 226272351 /nfs/dbraw/zinc/27/23/51/226272351.db2.gz MQYFVIRVRFMZKA-RKDXNWHRSA-N 1 1 229.776 3.632 20 0 BHADMO CC(C)C[N@@H+](C[C@H]1CCSC1)CC(C)(C)C ZINC000494962393 527944770 /nfs/dbraw/zinc/94/47/70/527944770.db2.gz UYFGHBJOVWESMS-CYBMUJFWSA-N 1 1 243.460 3.744 20 0 BHADMO CC(C)C[N@@H+](C[C@@H]1CCSC1)CC(C)(C)C ZINC000494962394 527943212 /nfs/dbraw/zinc/94/32/12/527943212.db2.gz UYFGHBJOVWESMS-ZDUSSCGKSA-N 1 1 243.460 3.744 20 0 BHADMO CC[C@@H](C)C[N@@H+](C)Cc1cc(Cl)cs1 ZINC000494964482 529314091 /nfs/dbraw/zinc/31/40/91/529314091.db2.gz PTKWWRLYSHPVPY-SECBINFHSA-N 1 1 231.792 3.879 20 0 BHADMO CC[C@H](C)C[N@@H+](C)Cc1cc(Cl)cs1 ZINC000494964483 529651243 /nfs/dbraw/zinc/65/12/43/529651243.db2.gz PTKWWRLYSHPVPY-VIFPVBQESA-N 1 1 231.792 3.879 20 0 BHADMO CC(C)(C)C[C@H]1CCC[N@H+]1C[C@H]1CCSC1 ZINC000494964890 527703763 /nfs/dbraw/zinc/70/37/63/527703763.db2.gz TYXGHVVRMWVDJD-CHWSQXEVSA-N 1 1 241.444 3.640 20 0 BHADMO CC(C)(C)C[C@@H]1CCC[N@H+]1C[C@H]1CCSC1 ZINC000494964891 527698481 /nfs/dbraw/zinc/69/84/81/527698481.db2.gz TYXGHVVRMWVDJD-OLZOCXBDSA-N 1 1 241.444 3.640 20 0 BHADMO CC(C)(C)C[C@H]1CCC[N@H+]1C[C@@H]1CCSC1 ZINC000494964892 527703916 /nfs/dbraw/zinc/70/39/16/527703916.db2.gz TYXGHVVRMWVDJD-QWHCGFSZSA-N 1 1 241.444 3.640 20 0 BHADMO CC(C)(C)C[C@@H]1CCC[N@H+]1C[C@@H]1CCSC1 ZINC000494964893 527698698 /nfs/dbraw/zinc/69/86/98/527698698.db2.gz TYXGHVVRMWVDJD-STQMWFEESA-N 1 1 241.444 3.640 20 0 BHADMO CC[C@@H]1CCCCC[N@H+]1C/C=C/c1ccncc1 ZINC000494970353 529267486 /nfs/dbraw/zinc/26/74/86/529267486.db2.gz HIMKTYXJXWQJJL-FYCOFBDGSA-N 1 1 244.382 3.749 20 0 BHADMO CC[C@H]1CCCCC[N@H+]1C/C=C/c1ccncc1 ZINC000494970354 529196533 /nfs/dbraw/zinc/19/65/33/529196533.db2.gz HIMKTYXJXWQJJL-MOEXGYKKSA-N 1 1 244.382 3.749 20 0 BHADMO CC[C@@H]1CCCCC[N@H+]1C/C=C\c1ccncc1 ZINC000494970356 529267781 /nfs/dbraw/zinc/26/77/81/529267781.db2.gz HIMKTYXJXWQJJL-MWWKQMNYSA-N 1 1 244.382 3.749 20 0 BHADMO CC[C@H]1CCCCC[N@H+]1C/C=C\c1ccncc1 ZINC000494970358 529196397 /nfs/dbraw/zinc/19/63/97/529196397.db2.gz HIMKTYXJXWQJJL-WLMCBFPDSA-N 1 1 244.382 3.749 20 0 BHADMO CC[C@H]1CCC[N@H+]1Cc1cc(Cl)cs1 ZINC000494973285 529220564 /nfs/dbraw/zinc/22/05/64/529220564.db2.gz HPBXROOYIDJGHK-JTQLQIEISA-N 1 1 229.776 3.776 20 0 BHADMO CC[C@@H]1CCC[N@H+]1Cc1cc(Cl)cs1 ZINC000494973287 529301838 /nfs/dbraw/zinc/30/18/38/529301838.db2.gz HPBXROOYIDJGHK-SNVBAGLBSA-N 1 1 229.776 3.776 20 0 BHADMO CC1(C)CCC[N@@H+](C/C=C/c2ccncc2)CC1 ZINC000494973731 528931392 /nfs/dbraw/zinc/93/13/92/528931392.db2.gz IFCYLLJBKFHZSF-HWKANZROSA-N 1 1 244.382 3.607 20 0 BHADMO CC1(C)CCC[N@@H+](C/C=C\c2ccncc2)CC1 ZINC000494973733 528932223 /nfs/dbraw/zinc/93/22/23/528932223.db2.gz IFCYLLJBKFHZSF-HYXAFXHYSA-N 1 1 244.382 3.607 20 0 BHADMO CC[C@]1(C)CCC[N@@H+](C/C=C\c2ccncc2)C1 ZINC000494977192 529395244 /nfs/dbraw/zinc/39/52/44/529395244.db2.gz GZZVKNZFYAYUTD-DQOPKJQZSA-N 1 1 244.382 3.607 20 0 BHADMO CC[C@@]1(C)CCC[N@@H+](C/C=C\c2ccncc2)C1 ZINC000494977194 529523088 /nfs/dbraw/zinc/52/30/88/529523088.db2.gz GZZVKNZFYAYUTD-LEXSJLIMSA-N 1 1 244.382 3.607 20 0 BHADMO CC[C@]1(C)CCC[N@@H+](C/C=C/c2ccncc2)C1 ZINC000494977196 529395408 /nfs/dbraw/zinc/39/54/08/529395408.db2.gz GZZVKNZFYAYUTD-MQDFFIGUSA-N 1 1 244.382 3.607 20 0 BHADMO CC[C@@]1(C)CCC[N@@H+](C/C=C/c2ccncc2)C1 ZINC000494977197 529523431 /nfs/dbraw/zinc/52/34/31/529523431.db2.gz GZZVKNZFYAYUTD-NBUZRDOWSA-N 1 1 244.382 3.607 20 0 BHADMO CCC(C)(C)[C@H]1CCC[N@H+]1C[C@H]1CCSC1 ZINC000494979031 528600384 /nfs/dbraw/zinc/60/03/84/528600384.db2.gz VFTHDUIRQSIJDV-CHWSQXEVSA-N 1 1 241.444 3.640 20 0 BHADMO CCC(C)(C)[C@@H]1CCC[N@H+]1C[C@H]1CCSC1 ZINC000494979033 528598598 /nfs/dbraw/zinc/59/85/98/528598598.db2.gz VFTHDUIRQSIJDV-OLZOCXBDSA-N 1 1 241.444 3.640 20 0 BHADMO CCC(C)(C)[C@H]1CCC[N@H+]1C[C@@H]1CCSC1 ZINC000494979034 528600047 /nfs/dbraw/zinc/60/00/47/528600047.db2.gz VFTHDUIRQSIJDV-QWHCGFSZSA-N 1 1 241.444 3.640 20 0 BHADMO CCC(C)(C)[C@@H]1CCC[N@H+]1C[C@@H]1CCSC1 ZINC000494979036 528598635 /nfs/dbraw/zinc/59/86/35/528598635.db2.gz VFTHDUIRQSIJDV-STQMWFEESA-N 1 1 241.444 3.640 20 0 BHADMO CC[C@@H]1CC[N@@H+](Cc2cc(Cl)cs2)C1 ZINC000494980644 529326632 /nfs/dbraw/zinc/32/66/32/529326632.db2.gz OWQPJZVUVGKYAK-SECBINFHSA-N 1 1 229.776 3.633 20 0 BHADMO CC[C@H]1CC[N@@H+](Cc2cc(Cl)cs2)C1 ZINC000494980646 529238745 /nfs/dbraw/zinc/23/87/45/529238745.db2.gz OWQPJZVUVGKYAK-VIFPVBQESA-N 1 1 229.776 3.633 20 0 BHADMO C[C@@H]1CC[N@@H+](Cc2cc(Cl)cs2)[C@H]1C ZINC000494981391 226273500 /nfs/dbraw/zinc/27/35/00/226273500.db2.gz SRELMIAAVAEDNW-BDAKNGLRSA-N 1 1 229.776 3.632 20 0 BHADMO C[C@@H]1[C@@H](C)CC[N@H+]1Cc1cc(Cl)cs1 ZINC000494981392 534233325 /nfs/dbraw/zinc/23/33/25/534233325.db2.gz SRELMIAAVAEDNW-DTWKUNHWSA-N 1 1 229.776 3.632 20 0 BHADMO C[C@H]1CC[N@@H+](Cc2cc(Cl)cs2)[C@H]1C ZINC000494981393 226273901 /nfs/dbraw/zinc/27/39/01/226273901.db2.gz SRELMIAAVAEDNW-IUCAKERBSA-N 1 1 229.776 3.632 20 0 BHADMO C[C@@H]1CC[N@@H+](Cc2cc(Cl)cs2)[C@@H]1C ZINC000494981394 226273612 /nfs/dbraw/zinc/27/36/12/226273612.db2.gz SRELMIAAVAEDNW-RKDXNWHRSA-N 1 1 229.776 3.632 20 0 BHADMO Clc1csc(C[N@H+]2CCC23CCC3)c1 ZINC000494982166 226273623 /nfs/dbraw/zinc/27/36/23/226273623.db2.gz VKIAWIBNHZTEHH-UHFFFAOYSA-N 1 1 227.760 3.530 20 0 BHADMO CC(C)[C@H]1CC[N@@H+](Cc2cc(Cl)cs2)C1 ZINC000494982482 527800797 /nfs/dbraw/zinc/80/07/97/527800797.db2.gz XUJSKCJSKDMFBA-JTQLQIEISA-N 1 1 243.803 3.879 20 0 BHADMO CC(C)[C@@H]1CC[N@@H+](Cc2cc(Cl)cs2)C1 ZINC000494982483 528699985 /nfs/dbraw/zinc/69/99/85/528699985.db2.gz XUJSKCJSKDMFBA-SNVBAGLBSA-N 1 1 243.803 3.879 20 0 BHADMO CC1=CC[N@@H+](Cc2cc(Cl)cs2)CC1 ZINC000494982663 528121533 /nfs/dbraw/zinc/12/15/33/528121533.db2.gz WZZHWDRMOVEWJH-UHFFFAOYSA-N 1 1 227.760 3.554 20 0 BHADMO CC1=CC[N@H+](Cc2cc(Cl)cs2)CC1 ZINC000494982663 528121532 /nfs/dbraw/zinc/12/15/32/528121532.db2.gz WZZHWDRMOVEWJH-UHFFFAOYSA-N 1 1 227.760 3.554 20 0 BHADMO C[C@@H]1CC[C@H](C)[N@@H+]1Cc1cc(Cl)cs1 ZINC000494991252 534227895 /nfs/dbraw/zinc/22/78/95/534227895.db2.gz BXOCOZFLMINOPC-DTORHVGOSA-N 1 1 229.776 3.774 20 0 BHADMO CCC(CC)[N@@H+](CC(C)C)C[C@H]1CCSC1 ZINC000494999890 528771920 /nfs/dbraw/zinc/77/19/20/528771920.db2.gz SKNBKHUQJHGLED-CYBMUJFWSA-N 1 1 243.460 3.886 20 0 BHADMO CCC(CC)[N@@H+](CC(C)C)C[C@@H]1CCSC1 ZINC000494999892 528771508 /nfs/dbraw/zinc/77/15/08/528771508.db2.gz SKNBKHUQJHGLED-ZDUSSCGKSA-N 1 1 243.460 3.886 20 0 BHADMO CC[C@H](C)[C@H](C)[N@@H+](C[C@@H]1CCSC1)C1CC1 ZINC000495001450 529238027 /nfs/dbraw/zinc/23/80/27/529238027.db2.gz XPZXDJMBEYBUIY-AVGNSLFASA-N 1 1 241.444 3.639 20 0 BHADMO CC[C@H](C)[C@H](C)[N@@H+](C[C@H]1CCSC1)C1CC1 ZINC000495001451 529238045 /nfs/dbraw/zinc/23/80/45/529238045.db2.gz XPZXDJMBEYBUIY-RWMBFGLXSA-N 1 1 241.444 3.639 20 0 BHADMO CC[C@H](C)[C@@H](C)[N@@H+](C[C@@H]1CCSC1)C1CC1 ZINC000495001453 529202843 /nfs/dbraw/zinc/20/28/43/529202843.db2.gz XPZXDJMBEYBUIY-XQQFMLRXSA-N 1 1 241.444 3.639 20 0 BHADMO CC[C@H](C)[C@@H](C)[N@@H+](C[C@H]1CCSC1)C1CC1 ZINC000495001457 529203070 /nfs/dbraw/zinc/20/30/70/529203070.db2.gz XPZXDJMBEYBUIY-YNEHKIRRSA-N 1 1 241.444 3.639 20 0 BHADMO CCC[N@@H+](Cc1cc(Cl)cs1)C1CC1 ZINC000495031431 528130371 /nfs/dbraw/zinc/13/03/71/528130371.db2.gz RQLHNZQRGNNLHT-UHFFFAOYSA-N 1 1 229.776 3.776 20 0 BHADMO CC(C)[C@H]1CC[N@H+]1Cc1cc(Cl)cs1 ZINC000495035663 527805858 /nfs/dbraw/zinc/80/58/58/527805858.db2.gz JRURLDQVUYLTRW-LLVKDONJSA-N 1 1 229.776 3.632 20 0 BHADMO CC(C)[C@@H]1CC[N@H+]1Cc1cc(Cl)cs1 ZINC000495035664 528704331 /nfs/dbraw/zinc/70/43/31/528704331.db2.gz JRURLDQVUYLTRW-NSHDSACASA-N 1 1 229.776 3.632 20 0 BHADMO CC(C)[C@@H]1CC[N@H+]1Cc1sccc1Cl ZINC000495036037 528704337 /nfs/dbraw/zinc/70/43/37/528704337.db2.gz KZWXQLYNFPYSOQ-JTQLQIEISA-N 1 1 229.776 3.632 20 0 BHADMO CC(C)[C@H]1CC[N@H+]1Cc1sccc1Cl ZINC000495036038 527805191 /nfs/dbraw/zinc/80/51/91/527805191.db2.gz KZWXQLYNFPYSOQ-SNVBAGLBSA-N 1 1 229.776 3.632 20 0 BHADMO C[N@@H+](C/C=C\c1ccncc1)C1CCCCCC1 ZINC000495050457 529820968 /nfs/dbraw/zinc/82/09/68/529820968.db2.gz UANYMJKMOSLZER-SREVYHEPSA-N 1 1 244.382 3.749 20 0 BHADMO C[N@@H+](C/C=C/c1ccncc1)C1CCCCCC1 ZINC000495050458 529820139 /nfs/dbraw/zinc/82/01/39/529820139.db2.gz UANYMJKMOSLZER-VOTSOKGWSA-N 1 1 244.382 3.749 20 0 BHADMO CC(C)[C@@H](C)[N@@H+](C)Cc1cc(Cl)cs1 ZINC000495056098 528406891 /nfs/dbraw/zinc/40/68/91/528406891.db2.gz BKYPTWSHGCASLM-SECBINFHSA-N 1 1 231.792 3.878 20 0 BHADMO CC(C)[C@H](C)[N@@H+](C)Cc1cc(Cl)cs1 ZINC000495056099 528959473 /nfs/dbraw/zinc/95/94/73/528959473.db2.gz BKYPTWSHGCASLM-VIFPVBQESA-N 1 1 231.792 3.878 20 0 BHADMO CCC[C@H](C)[N@@H+](C)Cc1scnc1C1CC1 ZINC000495056601 538927629 /nfs/dbraw/zinc/92/76/29/538927629.db2.gz CIGUJGKIGFUFAE-JTQLQIEISA-N 1 1 238.400 3.641 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)Cc1scnc1C1CC1 ZINC000495056602 538927491 /nfs/dbraw/zinc/92/74/91/538927491.db2.gz CIGUJGKIGFUFAE-SNVBAGLBSA-N 1 1 238.400 3.641 20 0 BHADMO CCC[N@H+](Cc1ccccc1)C[C@@H]1CCSC1 ZINC000495059423 528145906 /nfs/dbraw/zinc/14/59/06/528145906.db2.gz MUOUWDBAJQYXNV-HNNXBMFYSA-N 1 1 249.423 3.652 20 0 BHADMO CCC[N@H+](Cc1ccccc1)C[C@H]1CCSC1 ZINC000495059424 528146321 /nfs/dbraw/zinc/14/63/21/528146321.db2.gz MUOUWDBAJQYXNV-OAHLLOKOSA-N 1 1 249.423 3.652 20 0 BHADMO C[N@@H+](C/C=C/c1ccncc1)CC1CCCCC1 ZINC000495065109 529820124 /nfs/dbraw/zinc/82/01/24/529820124.db2.gz ZNNANIZVJZJVOD-VMPITWQZSA-N 1 1 244.382 3.607 20 0 BHADMO C[N@@H+](C/C=C\c1ccncc1)CC1CCCCC1 ZINC000495065112 529820853 /nfs/dbraw/zinc/82/08/53/529820853.db2.gz ZNNANIZVJZJVOD-YVMONPNESA-N 1 1 244.382 3.607 20 0 BHADMO CC1CCC([N@@H+](C)C/C=C\c2ccncc2)CC1 ZINC000495067405 528191427 /nfs/dbraw/zinc/19/14/27/528191427.db2.gz OCALCXCMPSGDGF-ARJAWSKDSA-N 1 1 244.382 3.605 20 0 BHADMO CC1CCC([N@@H+](C)C/C=C/c2ccncc2)CC1 ZINC000495067408 528191129 /nfs/dbraw/zinc/19/11/29/528191129.db2.gz OCALCXCMPSGDGF-ONEGZZNKSA-N 1 1 244.382 3.605 20 0 BHADMO CCOc1c(Cl)cccc1C[N@@H+](C)C(C)C ZINC000495068211 528177006 /nfs/dbraw/zinc/17/70/06/528177006.db2.gz QBZJEPJAAUEWIZ-UHFFFAOYSA-N 1 1 241.762 3.579 20 0 BHADMO CCC1CCC([N@@H+](C)C[C@@H]2CCSC2)CC1 ZINC000495069736 527841599 /nfs/dbraw/zinc/84/15/99/527841599.db2.gz SZCJYNRUTXBJFE-MOKVOYLWSA-N 1 1 241.444 3.640 20 0 BHADMO CCC1CCC([N@@H+](C)C[C@H]2CCSC2)CC1 ZINC000495069738 527840833 /nfs/dbraw/zinc/84/08/33/527840833.db2.gz SZCJYNRUTXBJFE-ROKHWSDSSA-N 1 1 241.444 3.640 20 0 BHADMO C[C@@H]1CCCC[N@H+]1Cc1cc(Cl)cs1 ZINC000495071278 534162967 /nfs/dbraw/zinc/16/29/67/534162967.db2.gz BLMQDNYHYWECJN-SECBINFHSA-N 1 1 229.776 3.776 20 0 BHADMO C[C@H]1CCCC[N@H+]1Cc1cc(Cl)cs1 ZINC000495071280 226276046 /nfs/dbraw/zinc/27/60/46/226276046.db2.gz BLMQDNYHYWECJN-VIFPVBQESA-N 1 1 229.776 3.776 20 0 BHADMO C[C@@H]1CCC[C@H]([N@@H+](C)C/C=C\c2ccncc2)C1 ZINC000495071825 226275746 /nfs/dbraw/zinc/27/57/46/226275746.db2.gz YKVSMDJIYAIVMC-DURLZJIISA-N 1 1 244.382 3.605 20 0 BHADMO C[C@@H]1CCC[C@@H]([N@@H+](C)C/C=C\c2ccncc2)C1 ZINC000495071826 533762142 /nfs/dbraw/zinc/76/21/42/533762142.db2.gz YKVSMDJIYAIVMC-RXBJYRPYSA-N 1 1 244.382 3.605 20 0 BHADMO C[C@@H]1CCC[C@@H]([N@@H+](C)C/C=C/c2ccncc2)C1 ZINC000495071827 533762589 /nfs/dbraw/zinc/76/25/89/533762589.db2.gz YKVSMDJIYAIVMC-UKWDMRDTSA-N 1 1 244.382 3.605 20 0 BHADMO C[C@@H]1CCC[C@H]([N@@H+](C)C/C=C/c2ccncc2)C1 ZINC000495071828 226275820 /nfs/dbraw/zinc/27/58/20/226275820.db2.gz YKVSMDJIYAIVMC-WQDDEOEWSA-N 1 1 244.382 3.605 20 0 BHADMO CCCC[N@@H+](CC)Cc1scnc1C1CC1 ZINC000495072172 538927368 /nfs/dbraw/zinc/92/73/68/538927368.db2.gz CUSORPAZMGTLCH-UHFFFAOYSA-N 1 1 238.400 3.643 20 0 BHADMO C[C@@H]1CCCC[N@H+]1Cc1sccc1Cl ZINC000495072687 226275763 /nfs/dbraw/zinc/27/57/63/226275763.db2.gz FSXFNGOPKNAHPW-SECBINFHSA-N 1 1 229.776 3.776 20 0 BHADMO C[C@H]1CCCC[N@H+]1Cc1sccc1Cl ZINC000495072688 226275735 /nfs/dbraw/zinc/27/57/35/226275735.db2.gz FSXFNGOPKNAHPW-VIFPVBQESA-N 1 1 229.776 3.776 20 0 BHADMO CC(C)[N@@H+](C[C@H]1CCSC1)C1CCCCC1 ZINC000495076555 528936813 /nfs/dbraw/zinc/93/68/13/528936813.db2.gz AEHNLGOYHJXQBQ-CYBMUJFWSA-N 1 1 241.444 3.783 20 0 BHADMO CC(C)[N@@H+](C[C@@H]1CCSC1)C1CCCCC1 ZINC000495076556 528925787 /nfs/dbraw/zinc/92/57/87/528925787.db2.gz AEHNLGOYHJXQBQ-ZDUSSCGKSA-N 1 1 241.444 3.783 20 0 BHADMO CCCCC[N@@H+](C/C=C/c1ccncc1)C(C)C ZINC000495076837 528164501 /nfs/dbraw/zinc/16/45/01/528164501.db2.gz BRRBUZHGJHNZLS-BQYQJAHWSA-N 1 1 246.398 3.995 20 0 BHADMO CCCCC[N@@H+](C/C=C\c1ccncc1)C(C)C ZINC000495076838 528164158 /nfs/dbraw/zinc/16/41/58/528164158.db2.gz BRRBUZHGJHNZLS-FPLPWBNLSA-N 1 1 246.398 3.995 20 0 BHADMO CC(C)C[N@@H+](C[C@H]1CCSC1)C1CCCC1 ZINC000495078094 527945029 /nfs/dbraw/zinc/94/50/29/527945029.db2.gz HTOVVXJBWVRKJH-CYBMUJFWSA-N 1 1 241.444 3.640 20 0 BHADMO CC(C)C[N@@H+](C[C@@H]1CCSC1)C1CCCC1 ZINC000495078096 527944192 /nfs/dbraw/zinc/94/41/92/527944192.db2.gz HTOVVXJBWVRKJH-ZDUSSCGKSA-N 1 1 241.444 3.640 20 0 BHADMO CCCCC[N@@H+](C[C@H]1CCSC1)C(C)C ZINC000495078746 528181530 /nfs/dbraw/zinc/18/15/30/528181530.db2.gz KTFOCNVCOFBMFN-CYBMUJFWSA-N 1 1 229.433 3.640 20 0 BHADMO CCCCC[N@@H+](C[C@@H]1CCSC1)C(C)C ZINC000495078747 528181148 /nfs/dbraw/zinc/18/11/48/528181148.db2.gz KTFOCNVCOFBMFN-ZDUSSCGKSA-N 1 1 229.433 3.640 20 0 BHADMO CC[N@H+](Cc1cc(Cl)cs1)CC(C)C ZINC000495080264 528767322 /nfs/dbraw/zinc/76/73/22/528767322.db2.gz QJRUSNCROQOOQU-UHFFFAOYSA-N 1 1 231.792 3.879 20 0 BHADMO Cc1ccc([C@H](C)[N@@H+](C)C[C@@H]2CCSC2)cc1 ZINC000495080269 226276336 /nfs/dbraw/zinc/27/63/36/226276336.db2.gz QMXIPTLXMNNMLT-KBPBESRZSA-N 1 1 249.423 3.741 20 0 BHADMO Cc1ccc([C@@H](C)[N@@H+](C)C[C@@H]2CCSC2)cc1 ZINC000495080270 226276142 /nfs/dbraw/zinc/27/61/42/226276142.db2.gz QMXIPTLXMNNMLT-KGLIPLIRSA-N 1 1 249.423 3.741 20 0 BHADMO Cc1ccc([C@H](C)[N@@H+](C)C[C@H]2CCSC2)cc1 ZINC000495080271 226276178 /nfs/dbraw/zinc/27/61/78/226276178.db2.gz QMXIPTLXMNNMLT-UONOGXRCSA-N 1 1 249.423 3.741 20 0 BHADMO Cc1ccc([C@@H](C)[N@@H+](C)C[C@H]2CCSC2)cc1 ZINC000495080272 226276328 /nfs/dbraw/zinc/27/63/28/226276328.db2.gz QMXIPTLXMNNMLT-ZIAGYGMSSA-N 1 1 249.423 3.741 20 0 BHADMO CC[N@H+](Cc1ccccc1C)C[C@@H]1CCSC1 ZINC000495090131 528836637 /nfs/dbraw/zinc/83/66/37/528836637.db2.gz ZZHPMFROINUBBW-AWEZNQCLSA-N 1 1 249.423 3.570 20 0 BHADMO CC[N@H+](Cc1ccccc1C)C[C@H]1CCSC1 ZINC000495090137 528836917 /nfs/dbraw/zinc/83/69/17/528836917.db2.gz ZZHPMFROINUBBW-CQSZACIVSA-N 1 1 249.423 3.570 20 0 BHADMO CC(C)C[C@@H]1CCC[N@H+]1C/C=C\c1ccncc1 ZINC000495092440 528380502 /nfs/dbraw/zinc/38/05/02/528380502.db2.gz HQYJLZCQINTYTA-IMMZDGJCSA-N 1 1 244.382 3.605 20 0 BHADMO CC(C)C[C@H]1CCC[N@H+]1C/C=C/c1ccncc1 ZINC000495092441 528590916 /nfs/dbraw/zinc/59/09/16/528590916.db2.gz HQYJLZCQINTYTA-LLCTXKFZSA-N 1 1 244.382 3.605 20 0 BHADMO CC(C)C[C@H]1CCC[N@H+]1C/C=C\c1ccncc1 ZINC000495092442 528591137 /nfs/dbraw/zinc/59/11/37/528591137.db2.gz HQYJLZCQINTYTA-OICCZTGUSA-N 1 1 244.382 3.605 20 0 BHADMO CC(C)C[C@@H]1CCC[N@H+]1C/C=C/c1ccncc1 ZINC000495092443 528380822 /nfs/dbraw/zinc/38/08/22/528380822.db2.gz HQYJLZCQINTYTA-WMHVBEDNSA-N 1 1 244.382 3.605 20 0 BHADMO CCC(CC)C[N@@H+](CC)C/C=C/c1ccncc1 ZINC000495099132 528742514 /nfs/dbraw/zinc/74/25/14/528742514.db2.gz PNRIMGQEUKKACJ-BQYQJAHWSA-N 1 1 246.398 3.853 20 0 BHADMO CCC(CC)C[N@@H+](CC)C/C=C\c1ccncc1 ZINC000495099133 528742592 /nfs/dbraw/zinc/74/25/92/528742592.db2.gz PNRIMGQEUKKACJ-FPLPWBNLSA-N 1 1 246.398 3.853 20 0 BHADMO C[N@H+](Cc1ccoc1)Cc1cc(Cl)cs1 ZINC000495165353 530013205 /nfs/dbraw/zinc/01/32/05/530013205.db2.gz RENDYCGFORFSGX-UHFFFAOYSA-N 1 1 241.743 3.627 20 0 BHADMO C[N@@H+](Cc1ccoc1)Cc1cc(Cl)cs1 ZINC000495165353 530013204 /nfs/dbraw/zinc/01/32/04/530013204.db2.gz RENDYCGFORFSGX-UHFFFAOYSA-N 1 1 241.743 3.627 20 0 BHADMO C[N@@H+](Cc1cc(Cl)cs1)CC(C)(C)C ZINC000495171672 529978429 /nfs/dbraw/zinc/97/84/29/529978429.db2.gz ITZFLGYXAMKOOG-UHFFFAOYSA-N 1 1 231.792 3.879 20 0 BHADMO CCC[N@@H+](CC)Cc1cccc(OC(F)F)c1 ZINC000496113422 528003715 /nfs/dbraw/zinc/00/37/15/528003715.db2.gz WCAUWNZDGMIOPD-UHFFFAOYSA-N 1 1 243.297 3.520 20 0 BHADMO Cc1cccc(C[N@@H+](C)CCC(C)(C)C)c1 ZINC000496836162 226315479 /nfs/dbraw/zinc/31/54/79/226315479.db2.gz FBSHSJMLIFPVMW-UHFFFAOYSA-N 1 1 219.372 3.863 20 0 BHADMO CC[N@@H+](CCC(C)(C)C)Cc1ccc(OC)cc1 ZINC000496836690 528405381 /nfs/dbraw/zinc/40/53/81/528405381.db2.gz GNDGWQXCHOCICJ-UHFFFAOYSA-N 1 1 249.398 3.953 20 0 BHADMO C[N@@H+](CCC(C)(C)C)Cc1ccc(F)cc1F ZINC000496855501 529873527 /nfs/dbraw/zinc/87/35/27/529873527.db2.gz VCOZLQDQNBYGKD-UHFFFAOYSA-N 1 1 241.325 3.833 20 0 BHADMO CC(C)(C)CC[N@H+]1CCC[C@@H]1C1CCC1 ZINC000496884750 527663414 /nfs/dbraw/zinc/66/34/14/527663414.db2.gz USGPNAJOXMUQHE-CYBMUJFWSA-N 1 1 209.377 3.687 20 0 BHADMO CC(C)(C)CC[N@H+]1CCC[C@H]1C1CCC1 ZINC000496884751 527663500 /nfs/dbraw/zinc/66/35/00/527663500.db2.gz USGPNAJOXMUQHE-ZDUSSCGKSA-N 1 1 209.377 3.687 20 0 BHADMO CCC(CC)[N@@H+](CCOC)CCC(C)(C)C ZINC000496898633 528779620 /nfs/dbraw/zinc/77/96/20/528779620.db2.gz NTNQPABUVIQMGA-UHFFFAOYSA-N 1 1 229.408 3.560 20 0 BHADMO C[N@@H+](CCC(C)(C)C)Cc1ccc(F)c(F)c1 ZINC000496900222 529873510 /nfs/dbraw/zinc/87/35/10/529873510.db2.gz TWHPWFIXMZBSJH-UHFFFAOYSA-N 1 1 241.325 3.833 20 0 BHADMO C[C@@H]1CCC[C@@H]([N@@H+](C)CCC(C)(C)C)C1 ZINC000496915715 533761421 /nfs/dbraw/zinc/76/14/21/533761421.db2.gz HKWKESHBJBJSBS-CHWSQXEVSA-N 1 1 211.393 3.933 20 0 BHADMO C[C@@H]1CCC[C@H]([N@@H+](C)CCC(C)(C)C)C1 ZINC000496915716 226317355 /nfs/dbraw/zinc/31/73/55/226317355.db2.gz HKWKESHBJBJSBS-OLZOCXBDSA-N 1 1 211.393 3.933 20 0 BHADMO C[C@H]1CCC[C@@H]([N@@H+](C)CCC(C)(C)C)C1 ZINC000496915717 226317344 /nfs/dbraw/zinc/31/73/44/226317344.db2.gz HKWKESHBJBJSBS-QWHCGFSZSA-N 1 1 211.393 3.933 20 0 BHADMO C[C@H]1CCC[C@H]([N@@H+](C)CCC(C)(C)C)C1 ZINC000496915718 226317486 /nfs/dbraw/zinc/31/74/86/226317486.db2.gz HKWKESHBJBJSBS-STQMWFEESA-N 1 1 211.393 3.933 20 0 BHADMO CC(C)CC[N@@H+](CCC(C)(C)C)C1CC1 ZINC000496916718 527716800 /nfs/dbraw/zinc/71/68/00/527716800.db2.gz QVWJZJOZMYKDJE-UHFFFAOYSA-N 1 1 211.393 3.933 20 0 BHADMO C[N@@H+](CCc1ccc(F)cc1)CCC(C)(C)C ZINC000496933358 529933242 /nfs/dbraw/zinc/93/32/42/529933242.db2.gz FKMAGJRONWJSIJ-UHFFFAOYSA-N 1 1 237.362 3.736 20 0 BHADMO COc1ccc(C[N@@H+](C)CCC(C)(C)C)cc1C ZINC000496950053 533536558 /nfs/dbraw/zinc/53/65/58/533536558.db2.gz IQRAFYGSPHIEMF-UHFFFAOYSA-N 1 1 249.398 3.872 20 0 BHADMO Cc1ccc(C[N@@H+](C)CCC(C)(C)C)s1 ZINC000496952353 533872538 /nfs/dbraw/zinc/87/25/38/533872538.db2.gz SWSCECABIHYDKP-UHFFFAOYSA-N 1 1 225.401 3.925 20 0 BHADMO Cc1cccc(C)c1OCCC[N@H+](C)CC(C)C ZINC000496966492 226318958 /nfs/dbraw/zinc/31/89/58/226318958.db2.gz HEVKOTFWOXWKHB-UHFFFAOYSA-N 1 1 249.398 3.660 20 0 BHADMO C[N@@H+](CCCOc1ccccc1)CCC(C)(C)C ZINC000496968112 529896194 /nfs/dbraw/zinc/89/61/94/529896194.db2.gz PFPCDJPJXNENGL-UHFFFAOYSA-N 1 1 249.398 3.824 20 0 BHADMO CC[N@@H+](CCCOc1c(C)cccc1C)C1CC1 ZINC000496985558 528471683 /nfs/dbraw/zinc/47/16/83/528471683.db2.gz QGXRDMUVAYYNJY-UHFFFAOYSA-N 1 1 247.382 3.557 20 0 BHADMO CC[N@@H+](CCCOc1c(C)cccc1C)C(C)C ZINC000496987946 528471203 /nfs/dbraw/zinc/47/12/03/528471203.db2.gz YDTTVKRHXGKATP-UHFFFAOYSA-N 1 1 249.398 3.803 20 0 BHADMO CC(C)(C)CC[N@H+]1CC[C@H](c2ccccc2)C1 ZINC000497012967 527664127 /nfs/dbraw/zinc/66/41/27/527664127.db2.gz AHCKZOJGMCGKFW-HNNXBMFYSA-N 1 1 231.383 3.912 20 0 BHADMO CC(C)(C)CC[N@H+]1CC[C@@H](c2ccccc2)C1 ZINC000497012968 527664832 /nfs/dbraw/zinc/66/48/32/527664832.db2.gz AHCKZOJGMCGKFW-OAHLLOKOSA-N 1 1 231.383 3.912 20 0 BHADMO CCC[N@@H+](CCC(C)(C)C)C[C@@H]1CCCCO1 ZINC000497017055 528033535 /nfs/dbraw/zinc/03/35/35/528033535.db2.gz MTGPCKZTKPYXHS-AWEZNQCLSA-N 1 1 241.419 3.704 20 0 BHADMO CCC[N@@H+](CCC(C)(C)C)C[C@H]1CCCCO1 ZINC000497017060 528032671 /nfs/dbraw/zinc/03/26/71/528032671.db2.gz MTGPCKZTKPYXHS-CQSZACIVSA-N 1 1 241.419 3.704 20 0 BHADMO CC[C@@H]1CCCN(c2cc[nH+]cc2Cl)CC1 ZINC000497177309 384716332 /nfs/dbraw/zinc/71/63/32/384716332.db2.gz COKOQZIVJKJUEO-LLVKDONJSA-N 1 1 238.762 3.752 20 0 BHADMO CC[C@H]1CCCN(c2cc[nH+]cc2Cl)CC1 ZINC000497177314 384716624 /nfs/dbraw/zinc/71/66/24/384716624.db2.gz COKOQZIVJKJUEO-NSHDSACASA-N 1 1 238.762 3.752 20 0 BHADMO CCC[N@@H+](C)[C@H](c1ccccc1)C(C)C ZINC000497358525 384999596 /nfs/dbraw/zinc/99/95/96/384999596.db2.gz SKSOQAXBEHPIRA-AWEZNQCLSA-N 1 1 205.345 3.726 20 0 BHADMO CCC[N@@H+](C)[C@@H](c1ccccc1)C(C)C ZINC000497358526 384998302 /nfs/dbraw/zinc/99/83/02/384998302.db2.gz SKSOQAXBEHPIRA-CQSZACIVSA-N 1 1 205.345 3.726 20 0 BHADMO CC(C)C[N@@H+](C)[C@H](c1ccccc1)C(C)C ZINC000497364590 385004886 /nfs/dbraw/zinc/00/48/86/385004886.db2.gz LMKIMMAOHDFNLX-HNNXBMFYSA-N 1 1 219.372 3.972 20 0 BHADMO CC(C)C[N@@H+](C)[C@@H](c1ccccc1)C(C)C ZINC000497364595 385005088 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CC(C)COCC[N@@H+](Cc1ccccc1)C(C)C ZINC000501108569 528095156 /nfs/dbraw/zinc/09/51/56/528095156.db2.gz DYVCXAPVLHNMQT-UHFFFAOYSA-N 1 1 249.398 3.570 20 0 BHADMO CC(C)[N@@H+](CCSC1CCCCC1)C1CC1 ZINC000501109653 528912290 /nfs/dbraw/zinc/91/22/90/528912290.db2.gz RXZIETBFKWJMSA-UHFFFAOYSA-N 1 1 241.444 3.925 20 0 BHADMO COc1cccc(C[N@H+]2CCC[C@H]2CC(C)C)c1 ZINC000501111587 533479299 /nfs/dbraw/zinc/47/92/99/533479299.db2.gz UGBBCFIOEQSIDC-HNNXBMFYSA-N 1 1 247.382 3.706 20 0 BHADMO COc1cccc(C[N@H+]2CCC[C@@H]2CC(C)C)c1 ZINC000501111589 533476487 /nfs/dbraw/zinc/47/64/87/533476487.db2.gz UGBBCFIOEQSIDC-OAHLLOKOSA-N 1 1 247.382 3.706 20 0 BHADMO CC[C@@H](C)[N@@H+](C)Cc1cc(C)c(OC)c(C)c1 ZINC000501113928 529345088 /nfs/dbraw/zinc/34/50/88/529345088.db2.gz UEDGLIJBGSTANR-CYBMUJFWSA-N 1 1 235.371 3.542 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1cc(C)c(OC)c(C)c1 ZINC000501113929 529690990 /nfs/dbraw/zinc/69/09/90/529690990.db2.gz UEDGLIJBGSTANR-ZDUSSCGKSA-N 1 1 235.371 3.542 20 0 BHADMO CCC[C@H](C)[N@@H+](C)Cc1ccc(C)s1 ZINC000501115707 528046725 /nfs/dbraw/zinc/04/67/25/528046725.db2.gz ZRLBJBKHEVWNLD-JTQLQIEISA-N 1 1 211.374 3.677 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)Cc1ccc(C)s1 ZINC000501115708 528887034 /nfs/dbraw/zinc/88/70/34/528887034.db2.gz ZRLBJBKHEVWNLD-SNVBAGLBSA-N 1 1 211.374 3.677 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)Cc1ccccc1OCC ZINC000501119946 528888721 /nfs/dbraw/zinc/88/87/21/528888721.db2.gz XIJNBIKBMZACAZ-CYBMUJFWSA-N 1 1 235.371 3.706 20 0 BHADMO CCC[C@H](C)[N@@H+](C)Cc1ccccc1OCC ZINC000501119948 528047088 /nfs/dbraw/zinc/04/70/88/528047088.db2.gz XIJNBIKBMZACAZ-ZDUSSCGKSA-N 1 1 235.371 3.706 20 0 BHADMO CCC[C@H](C)[N@@H+](C)CCCOc1ccccc1 ZINC000501129551 528046370 /nfs/dbraw/zinc/04/63/70/528046370.db2.gz WJSWKFJYJJTOFY-AWEZNQCLSA-N 1 1 235.371 3.576 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)CCCOc1ccccc1 ZINC000501129553 528887020 /nfs/dbraw/zinc/88/70/20/528887020.db2.gz WJSWKFJYJJTOFY-CQSZACIVSA-N 1 1 235.371 3.576 20 0 BHADMO CCC[C@H](C)[N@@H+](C)Cc1ccc(F)c(F)c1 ZINC000501133301 528047009 /nfs/dbraw/zinc/04/70/09/528047009.db2.gz JVXRABSMWLGKQV-JTQLQIEISA-N 1 1 227.298 3.585 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)Cc1ccc(F)c(F)c1 ZINC000501133307 528888473 /nfs/dbraw/zinc/88/84/73/528888473.db2.gz JVXRABSMWLGKQV-SNVBAGLBSA-N 1 1 227.298 3.585 20 0 BHADMO CCC[C@H](C)[N@H+]1CC[C@@H](c2cccc(F)c2)C1 ZINC000501133661 528051002 /nfs/dbraw/zinc/05/10/02/528051002.db2.gz LCQSIDAYVONVKJ-GXTWGEPZSA-N 1 1 235.346 3.804 20 0 BHADMO CCC[C@H](C)[N@H+]1CC[C@H](c2cccc(F)c2)C1 ZINC000501133663 528052326 /nfs/dbraw/zinc/05/23/26/528052326.db2.gz LCQSIDAYVONVKJ-JSGCOSHPSA-N 1 1 235.346 3.804 20 0 BHADMO CCC[C@@H](C)[N@H+]1CC[C@H](c2cccc(F)c2)C1 ZINC000501133664 528891422 /nfs/dbraw/zinc/89/14/22/528891422.db2.gz LCQSIDAYVONVKJ-OCCSQVGLSA-N 1 1 235.346 3.804 20 0 BHADMO CCC[C@@H](C)[N@H+]1CC[C@@H](c2cccc(F)c2)C1 ZINC000501133666 528891843 /nfs/dbraw/zinc/89/18/43/528891843.db2.gz LCQSIDAYVONVKJ-TZMCWYRMSA-N 1 1 235.346 3.804 20 0 BHADMO CCC[C@H](C)[N@@H+](C)Cc1ccc(F)cc1F ZINC000501135048 528047228 /nfs/dbraw/zinc/04/72/28/528047228.db2.gz OAGDCLQYANQODW-JTQLQIEISA-N 1 1 227.298 3.585 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)Cc1ccc(F)cc1F ZINC000501135049 528888730 /nfs/dbraw/zinc/88/87/30/528888730.db2.gz OAGDCLQYANQODW-SNVBAGLBSA-N 1 1 227.298 3.585 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)Cc1ccc(OCC)cc1 ZINC000501135120 528888443 /nfs/dbraw/zinc/88/84/43/528888443.db2.gz OUICWYGIRYUPEW-CYBMUJFWSA-N 1 1 235.371 3.706 20 0 BHADMO CCC[C@H](C)[N@@H+](C)Cc1ccc(OCC)cc1 ZINC000501135122 528046985 /nfs/dbraw/zinc/04/69/85/528046985.db2.gz OUICWYGIRYUPEW-ZDUSSCGKSA-N 1 1 235.371 3.706 20 0 BHADMO CCC[C@H](C)[N@H+]1CC[C@@H](c2ccccc2)C1 ZINC000501136590 528051161 /nfs/dbraw/zinc/05/11/61/528051161.db2.gz TVZYVIOKSGKKKQ-DZGCQCFKSA-N 1 1 217.356 3.665 20 0 BHADMO CCC[C@@H](C)[N@H+]1CC[C@H](c2ccccc2)C1 ZINC000501136591 528891239 /nfs/dbraw/zinc/89/12/39/528891239.db2.gz TVZYVIOKSGKKKQ-HIFRSBDPSA-N 1 1 217.356 3.665 20 0 BHADMO CCC[C@@H](C)[N@H+]1CC[C@@H](c2ccccc2)C1 ZINC000501136593 528891805 /nfs/dbraw/zinc/89/18/05/528891805.db2.gz TVZYVIOKSGKKKQ-UKRRQHHQSA-N 1 1 217.356 3.665 20 0 BHADMO CCC[C@H](C)[N@H+]1CC[C@H](c2ccccc2)C1 ZINC000501136595 528051621 /nfs/dbraw/zinc/05/16/21/528051621.db2.gz TVZYVIOKSGKKKQ-ZFWWWQNUSA-N 1 1 217.356 3.665 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)Cc1cccc(C)c1 ZINC000501142132 528888515 /nfs/dbraw/zinc/88/85/15/528888515.db2.gz MWHDFAIDZXDYOR-CYBMUJFWSA-N 1 1 205.345 3.615 20 0 BHADMO CCC[C@H](C)[N@@H+](C)Cc1cccc(C)c1 ZINC000501142133 528048121 /nfs/dbraw/zinc/04/81/21/528048121.db2.gz MWHDFAIDZXDYOR-ZDUSSCGKSA-N 1 1 205.345 3.615 20 0 BHADMO CCC[C@H](C)[N@H+]1CC[C@@H](c2ccc(OC)cc2)C1 ZINC000501144208 528050323 /nfs/dbraw/zinc/05/03/23/528050323.db2.gz UMDQOCKNUYAODJ-DZGCQCFKSA-N 1 1 247.382 3.673 20 0 BHADMO CCC[C@@H](C)[N@H+]1CC[C@H](c2ccc(OC)cc2)C1 ZINC000501144209 528891936 /nfs/dbraw/zinc/89/19/36/528891936.db2.gz UMDQOCKNUYAODJ-HIFRSBDPSA-N 1 1 247.382 3.673 20 0 BHADMO CCC[C@@H](C)[N@H+]1CC[C@@H](c2ccc(OC)cc2)C1 ZINC000501144211 528891522 /nfs/dbraw/zinc/89/15/22/528891522.db2.gz UMDQOCKNUYAODJ-UKRRQHHQSA-N 1 1 247.382 3.673 20 0 BHADMO CCC[C@H](C)[N@H+]1CC[C@H](c2ccc(OC)cc2)C1 ZINC000501144213 528051798 /nfs/dbraw/zinc/05/17/98/528051798.db2.gz UMDQOCKNUYAODJ-ZFWWWQNUSA-N 1 1 247.382 3.673 20 0 BHADMO Cc1ccc([C@H](C)[N@H+](C)CCOCC(C)C)cc1 ZINC000501153432 226327154 /nfs/dbraw/zinc/32/71/54/226327154.db2.gz IEHFPVUFXAEEAB-HNNXBMFYSA-N 1 1 249.398 3.660 20 0 BHADMO Cc1ccc([C@@H](C)[N@H+](C)CCOCC(C)C)cc1 ZINC000501153434 226327115 /nfs/dbraw/zinc/32/71/15/226327115.db2.gz IEHFPVUFXAEEAB-OAHLLOKOSA-N 1 1 249.398 3.660 20 0 BHADMO CC[N@@H+](CCSC1CCCCC1)C(C)C ZINC000501154878 528584067 /nfs/dbraw/zinc/58/40/67/528584067.db2.gz QWBWQPYWWOFRDJ-UHFFFAOYSA-N 1 1 229.433 3.783 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)Cc1ccc(OC)c(C)c1 ZINC000501164868 528888890 /nfs/dbraw/zinc/88/88/90/528888890.db2.gz UKLHAPKAAPACSG-CYBMUJFWSA-N 1 1 235.371 3.624 20 0 BHADMO CCC[C@H](C)[N@@H+](C)Cc1ccc(OC)c(C)c1 ZINC000501164869 528047701 /nfs/dbraw/zinc/04/77/01/528047701.db2.gz UKLHAPKAAPACSG-ZDUSSCGKSA-N 1 1 235.371 3.624 20 0 BHADMO CCC[C@H](C)[N@@H+](C)C[C@H](C)c1ccccc1 ZINC000501165256 528047657 /nfs/dbraw/zinc/04/76/57/528047657.db2.gz VKKWZYIGICNPMF-KBPBESRZSA-N 1 1 219.372 3.911 20 0 BHADMO CCC[C@H](C)[N@@H+](C)C[C@@H](C)c1ccccc1 ZINC000501165257 385212150 /nfs/dbraw/zinc/21/21/50/385212150.db2.gz VKKWZYIGICNPMF-KGLIPLIRSA-N 1 1 219.372 3.911 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)C[C@H](C)c1ccccc1 ZINC000501165258 385212909 /nfs/dbraw/zinc/21/29/09/385212909.db2.gz VKKWZYIGICNPMF-UONOGXRCSA-N 1 1 219.372 3.911 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)C[C@@H](C)c1ccccc1 ZINC000501165259 385212572 /nfs/dbraw/zinc/21/25/72/385212572.db2.gz VKKWZYIGICNPMF-ZIAGYGMSSA-N 1 1 219.372 3.911 20 0 BHADMO CCCC[N@@H+](C)[C@H](C)c1ccccc1F ZINC000501387771 528368848 /nfs/dbraw/zinc/36/88/48/528368848.db2.gz NHDFJNCHQRPRDV-LLVKDONJSA-N 1 1 209.308 3.619 20 0 BHADMO CCCC[N@@H+](C)[C@@H](C)c1ccccc1F ZINC000501387772 528368765 /nfs/dbraw/zinc/36/87/65/528368765.db2.gz NHDFJNCHQRPRDV-NSHDSACASA-N 1 1 209.308 3.619 20 0 BHADMO CC[C@@H](c1ccccc1)[N@H+]1CC[C@](C)(F)C1 ZINC000501389044 529257266 /nfs/dbraw/zinc/25/72/66/529257266.db2.gz AEUKNZLHFZZDLA-KBPBESRZSA-N 1 1 221.319 3.572 20 0 BHADMO CC[C@H](c1ccccc1)[N@H+]1CC[C@](C)(F)C1 ZINC000501389046 529182613 /nfs/dbraw/zinc/18/26/13/529182613.db2.gz AEUKNZLHFZZDLA-KGLIPLIRSA-N 1 1 221.319 3.572 20 0 BHADMO CC[C@@H](c1ccccc1)[N@H+]1CC[C@@](C)(F)C1 ZINC000501389048 529257157 /nfs/dbraw/zinc/25/71/57/529257157.db2.gz AEUKNZLHFZZDLA-UONOGXRCSA-N 1 1 221.319 3.572 20 0 BHADMO CC[C@H](c1ccccc1)[N@H+]1CC[C@@](C)(F)C1 ZINC000501389050 529182185 /nfs/dbraw/zinc/18/21/85/529182185.db2.gz AEUKNZLHFZZDLA-ZIAGYGMSSA-N 1 1 221.319 3.572 20 0 BHADMO C[C@@H](c1cccc(Cl)c1)[N@H+]1CC[C@](C)(F)C1 ZINC000501407697 534087358 /nfs/dbraw/zinc/08/73/58/534087358.db2.gz DTSKJDVANCVFBZ-GWCFXTLKSA-N 1 1 241.737 3.835 20 0 BHADMO C[C@@H](c1cccc(Cl)c1)[N@@H+]1CC[C@](C)(F)C1 ZINC000501407697 534087356 /nfs/dbraw/zinc/08/73/56/534087356.db2.gz DTSKJDVANCVFBZ-GWCFXTLKSA-N 1 1 241.737 3.835 20 0 BHADMO C[C@@H](c1cccc(Cl)c1)[N@H+]1CC[C@@](C)(F)C1 ZINC000501407698 534086608 /nfs/dbraw/zinc/08/66/08/534086608.db2.gz DTSKJDVANCVFBZ-GXFFZTMASA-N 1 1 241.737 3.835 20 0 BHADMO C[C@@H](c1cccc(Cl)c1)[N@@H+]1CC[C@@](C)(F)C1 ZINC000501407698 534086599 /nfs/dbraw/zinc/08/65/99/534086599.db2.gz DTSKJDVANCVFBZ-GXFFZTMASA-N 1 1 241.737 3.835 20 0 BHADMO C[C@H](c1cccc(Cl)c1)[N@H+]1CC[C@](C)(F)C1 ZINC000501407699 534126819 /nfs/dbraw/zinc/12/68/19/534126819.db2.gz DTSKJDVANCVFBZ-MFKMUULPSA-N 1 1 241.737 3.835 20 0 BHADMO C[C@H](c1cccc(Cl)c1)[N@@H+]1CC[C@](C)(F)C1 ZINC000501407699 534126818 /nfs/dbraw/zinc/12/68/18/534126818.db2.gz DTSKJDVANCVFBZ-MFKMUULPSA-N 1 1 241.737 3.835 20 0 BHADMO C[C@H](c1cccc(Cl)c1)[N@H+]1CC[C@@](C)(F)C1 ZINC000501407700 534127884 /nfs/dbraw/zinc/12/78/84/534127884.db2.gz DTSKJDVANCVFBZ-ZWNOBZJWSA-N 1 1 241.737 3.835 20 0 BHADMO C[C@H](c1cccc(Cl)c1)[N@@H+]1CC[C@@](C)(F)C1 ZINC000501407700 534127879 /nfs/dbraw/zinc/12/78/79/534127879.db2.gz DTSKJDVANCVFBZ-ZWNOBZJWSA-N 1 1 241.737 3.835 20 0 BHADMO C[C@]1(F)CC[N@@H+](Cc2cccc3ccccc32)C1 ZINC000501409139 385251658 /nfs/dbraw/zinc/25/16/58/385251658.db2.gz JCJABMMSWVEXDN-INIZCTEOSA-N 1 1 243.325 3.774 20 0 BHADMO C[C@@]1(F)CC[N@@H+](Cc2cccc3ccccc32)C1 ZINC000501409140 385251553 /nfs/dbraw/zinc/25/15/53/385251553.db2.gz JCJABMMSWVEXDN-MRXNPFEDSA-N 1 1 243.325 3.774 20 0 BHADMO C[C@@H](c1ccccc1Cl)[N@H+]1CC[C@](C)(F)C1 ZINC000501423581 226327693 /nfs/dbraw/zinc/32/76/93/226327693.db2.gz GYTPLIUUKKAKOC-GWCFXTLKSA-N 1 1 241.737 3.835 20 0 BHADMO C[C@@H](c1ccccc1Cl)[N@@H+]1CC[C@](C)(F)C1 ZINC000501423581 226327692 /nfs/dbraw/zinc/32/76/92/226327692.db2.gz GYTPLIUUKKAKOC-GWCFXTLKSA-N 1 1 241.737 3.835 20 0 BHADMO C[C@@H](c1ccccc1Cl)[N@H+]1CC[C@@](C)(F)C1 ZINC000501423582 226327890 /nfs/dbraw/zinc/32/78/90/226327890.db2.gz GYTPLIUUKKAKOC-GXFFZTMASA-N 1 1 241.737 3.835 20 0 BHADMO C[C@@H](c1ccccc1Cl)[N@@H+]1CC[C@@](C)(F)C1 ZINC000501423582 226327889 /nfs/dbraw/zinc/32/78/89/226327889.db2.gz GYTPLIUUKKAKOC-GXFFZTMASA-N 1 1 241.737 3.835 20 0 BHADMO C[C@H](c1ccccc1Cl)[N@H+]1CC[C@](C)(F)C1 ZINC000501423583 534138249 /nfs/dbraw/zinc/13/82/49/534138249.db2.gz GYTPLIUUKKAKOC-MFKMUULPSA-N 1 1 241.737 3.835 20 0 BHADMO C[C@H](c1ccccc1Cl)[N@@H+]1CC[C@](C)(F)C1 ZINC000501423583 534138245 /nfs/dbraw/zinc/13/82/45/534138245.db2.gz GYTPLIUUKKAKOC-MFKMUULPSA-N 1 1 241.737 3.835 20 0 BHADMO C[C@H](c1ccccc1Cl)[N@H+]1CC[C@@](C)(F)C1 ZINC000501423584 534138324 /nfs/dbraw/zinc/13/83/24/534138324.db2.gz GYTPLIUUKKAKOC-ZWNOBZJWSA-N 1 1 241.737 3.835 20 0 BHADMO C[C@H](c1ccccc1Cl)[N@@H+]1CC[C@@](C)(F)C1 ZINC000501423584 534138320 /nfs/dbraw/zinc/13/83/20/534138320.db2.gz GYTPLIUUKKAKOC-ZWNOBZJWSA-N 1 1 241.737 3.835 20 0 BHADMO CC[C@@H](c1ccc(F)cc1)[N@H+]1CC[C@](C)(F)C1 ZINC000501424853 529255290 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226328023 /nfs/dbraw/zinc/32/80/23/226328023.db2.gz ZBLKVKRLYPGMHE-GWCFXTLKSA-N 1 1 241.737 3.835 20 0 BHADMO C[C@@H](c1ccc(Cl)cc1)[N@H+]1CC[C@@](C)(F)C1 ZINC000501438197 226327924 /nfs/dbraw/zinc/32/79/24/226327924.db2.gz ZBLKVKRLYPGMHE-GXFFZTMASA-N 1 1 241.737 3.835 20 0 BHADMO C[C@@H](c1ccc(Cl)cc1)[N@@H+]1CC[C@@](C)(F)C1 ZINC000501438197 226327923 /nfs/dbraw/zinc/32/79/23/226327923.db2.gz ZBLKVKRLYPGMHE-GXFFZTMASA-N 1 1 241.737 3.835 20 0 BHADMO C[C@H](c1ccc(Cl)cc1)[N@H+]1CC[C@](C)(F)C1 ZINC000501438198 226327746 /nfs/dbraw/zinc/32/77/46/226327746.db2.gz ZBLKVKRLYPGMHE-MFKMUULPSA-N 1 1 241.737 3.835 20 0 BHADMO C[C@H](c1ccc(Cl)cc1)[N@@H+]1CC[C@](C)(F)C1 ZINC000501438198 226327745 /nfs/dbraw/zinc/32/77/45/226327745.db2.gz ZBLKVKRLYPGMHE-MFKMUULPSA-N 1 1 241.737 3.835 20 0 BHADMO C[C@H](c1ccc(Cl)cc1)[N@H+]1CC[C@@](C)(F)C1 ZINC000501438199 226327897 /nfs/dbraw/zinc/32/78/97/226327897.db2.gz ZBLKVKRLYPGMHE-ZWNOBZJWSA-N 1 1 241.737 3.835 20 0 BHADMO C[C@H](c1ccc(Cl)cc1)[N@@H+]1CC[C@@](C)(F)C1 ZINC000501438199 226327896 /nfs/dbraw/zinc/32/78/96/226327896.db2.gz ZBLKVKRLYPGMHE-ZWNOBZJWSA-N 1 1 241.737 3.835 20 0 BHADMO C/C(=C\c1ccccc1)CNc1[nH+]cccc1C ZINC000501449626 527534799 /nfs/dbraw/zinc/53/47/99/527534799.db2.gz YOHNYYQGVXSFTH-ACCUITESSA-N 1 1 238.334 3.905 20 0 BHADMO C/C(=C/c1ccccc1)CNc1[nH+]cccc1C ZINC000501449627 527507964 /nfs/dbraw/zinc/50/79/64/527507964.db2.gz YOHNYYQGVXSFTH-QBFSEMIESA-N 1 1 238.334 3.905 20 0 BHADMO C[C@]1(F)CC[N@@H+](Cc2csc3ccccc23)C1 ZINC000501451747 226328074 /nfs/dbraw/zinc/32/80/74/226328074.db2.gz ZMUIAWZRSQWYQC-AWEZNQCLSA-N 1 1 249.354 3.835 20 0 BHADMO C[C@@]1(F)CC[N@@H+](Cc2csc3ccccc23)C1 ZINC000501451750 226328129 /nfs/dbraw/zinc/32/81/29/226328129.db2.gz ZMUIAWZRSQWYQC-CQSZACIVSA-N 1 1 249.354 3.835 20 0 BHADMO CC(C)Oc1cccc(C[N@@H+](C)C2CCCC2)c1 ZINC000501510763 528222751 /nfs/dbraw/zinc/22/27/51/528222751.db2.gz GCEDILXMZHQXLV-UHFFFAOYSA-N 1 1 247.382 3.848 20 0 BHADMO c1cc2c(s1)CC[N@H+](CC1CCCCC1)C2 ZINC000501779775 226328756 /nfs/dbraw/zinc/32/87/56/226328756.db2.gz KFDZKFBBVAIYPT-UHFFFAOYSA-N 1 1 235.396 3.687 20 0 BHADMO COc1cccc([C@H](C)[N@H+]2CC[C@H](C)[C@@H](C)C2)c1 ZINC000501792243 226328523 /nfs/dbraw/zinc/32/85/23/226328523.db2.gz SQSICASRDJCLRW-IHRRRGAJSA-N 1 1 247.382 3.734 20 0 BHADMO COc1cccc([C@H](C)[N@H+]2CC[C@@H](C)[C@H](C)C2)c1 ZINC000501792244 226328519 /nfs/dbraw/zinc/32/85/19/226328519.db2.gz SQSICASRDJCLRW-MCIONIFRSA-N 1 1 247.382 3.734 20 0 BHADMO COc1cccc([C@H](C)[N@H+]2CC[C@H](C)[C@H](C)C2)c1 ZINC000501792245 226328668 /nfs/dbraw/zinc/32/86/68/226328668.db2.gz SQSICASRDJCLRW-MJBXVCDLSA-N 1 1 247.382 3.734 20 0 BHADMO COc1cccc([C@H](C)[N@H+]2CC[C@@H](C)[C@@H](C)C2)c1 ZINC000501792246 226328748 /nfs/dbraw/zinc/32/87/48/226328748.db2.gz SQSICASRDJCLRW-RDBSUJKOSA-N 1 1 247.382 3.734 20 0 BHADMO C[C@@H]1CC[N@@H+](CCCCC(F)(F)F)C[C@H]1C ZINC000501803787 534032075 /nfs/dbraw/zinc/03/20/75/534032075.db2.gz JTOVSWUEXNRQQW-GHMZBOCLSA-N 1 1 237.309 3.697 20 0 BHADMO C[C@H]1CC[N@@H+](CCCCC(F)(F)F)C[C@H]1C ZINC000501803788 226328474 /nfs/dbraw/zinc/32/84/74/226328474.db2.gz JTOVSWUEXNRQQW-WDEREUQCSA-N 1 1 237.309 3.697 20 0 BHADMO CCC[C@H](C)[N@@H+](C)CCCOCc1ccccc1 ZINC000501841209 528046059 /nfs/dbraw/zinc/04/60/59/528046059.db2.gz HDOPXUVDZJPBQJ-HNNXBMFYSA-N 1 1 249.398 3.714 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)CCCOCc1ccccc1 ZINC000501841210 528887086 /nfs/dbraw/zinc/88/70/86/528887086.db2.gz HDOPXUVDZJPBQJ-OAHLLOKOSA-N 1 1 249.398 3.714 20 0 BHADMO CC1=CCC[N@@H+](CCSC2CCCCC2)C1 ZINC000501845980 528103760 /nfs/dbraw/zinc/10/37/60/528103760.db2.gz ZNJOIJLVIFRFAQ-UHFFFAOYSA-N 1 1 239.428 3.704 20 0 BHADMO CC[C@@H](C)[N@@H+](C)Cc1ccc(F)c(Cl)c1 ZINC000501850189 529345257 /nfs/dbraw/zinc/34/52/57/529345257.db2.gz RBXBSSOQWCVGHK-SECBINFHSA-N 1 1 229.726 3.709 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1ccc(F)c(Cl)c1 ZINC000501850190 529691355 /nfs/dbraw/zinc/69/13/55/529691355.db2.gz RBXBSSOQWCVGHK-VIFPVBQESA-N 1 1 229.726 3.709 20 0 BHADMO CC(C)CC[N@H+]1CCC[C@H]1Cc1ccccc1 ZINC000501870214 527726293 /nfs/dbraw/zinc/72/62/93/527726293.db2.gz MICUJGYYEUFEPP-INIZCTEOSA-N 1 1 231.383 3.740 20 0 BHADMO CC(C)CC[N@H+]1CCC[C@@H]1Cc1ccccc1 ZINC000501870215 527727139 /nfs/dbraw/zinc/72/71/39/527727139.db2.gz MICUJGYYEUFEPP-MRXNPFEDSA-N 1 1 231.383 3.740 20 0 BHADMO CC[C@H](C)[N@@H+](C)C/C(C)=C/c1ccccc1 ZINC000501872899 529687231 /nfs/dbraw/zinc/68/72/31/529687231.db2.gz KBARMGJWSPZEAG-CMPYXILNSA-N 1 1 217.356 3.820 20 0 BHADMO CC[C@H](C)[N@@H+](C)C/C(C)=C\c1ccccc1 ZINC000501872901 529687113 /nfs/dbraw/zinc/68/71/13/529687113.db2.gz KBARMGJWSPZEAG-FZDNWWAKSA-N 1 1 217.356 3.820 20 0 BHADMO CC[C@@H](C)[N@@H+](C)C/C(C)=C\c1ccccc1 ZINC000501872902 529340809 /nfs/dbraw/zinc/34/08/09/529340809.db2.gz KBARMGJWSPZEAG-YBEMTRGBSA-N 1 1 217.356 3.820 20 0 BHADMO CC[C@@H](C)[N@@H+](C)C/C(C)=C/c1ccccc1 ZINC000501872904 529340865 /nfs/dbraw/zinc/34/08/65/529340865.db2.gz KBARMGJWSPZEAG-YPDDLIOESA-N 1 1 217.356 3.820 20 0 BHADMO c1ccc(C[C@H]2CCC[N@@H+]2CC2CCCC2)cc1 ZINC000501873449 226328507 /nfs/dbraw/zinc/32/85/07/226328507.db2.gz VFKJNSRAPHYZKH-QGZVFWFLSA-N 1 1 243.394 3.884 20 0 BHADMO CC[C@@H](C)[N@H+]1CC[C@](C)(c2ccc(F)cc2)C1 ZINC000501874867 529356770 /nfs/dbraw/zinc/35/67/70/529356770.db2.gz HXASSUVCXQMNOT-DOMZBBRYSA-N 1 1 235.346 3.588 20 0 BHADMO CC[C@@H](C)[N@H+]1CC[C@@](C)(c2ccc(F)cc2)C1 ZINC000501874868 529357010 /nfs/dbraw/zinc/35/70/10/529357010.db2.gz HXASSUVCXQMNOT-IUODEOHRSA-N 1 1 235.346 3.588 20 0 BHADMO CC[C@H](C)[N@H+]1CC[C@@](C)(c2ccc(F)cc2)C1 ZINC000501874869 529701991 /nfs/dbraw/zinc/70/19/91/529701991.db2.gz HXASSUVCXQMNOT-SWLSCSKDSA-N 1 1 235.346 3.588 20 0 BHADMO CC[C@H](C)[N@H+]1CC[C@](C)(c2ccc(F)cc2)C1 ZINC000501874870 529702008 /nfs/dbraw/zinc/70/20/08/529702008.db2.gz HXASSUVCXQMNOT-WFASDCNBSA-N 1 1 235.346 3.588 20 0 BHADMO CC[C@@H](C)[N@@H+](C)Cc1cc(Cl)ccc1F ZINC000501899198 529344692 /nfs/dbraw/zinc/34/46/92/529344692.db2.gz JZBFJQZHOCPZKF-SECBINFHSA-N 1 1 229.726 3.709 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1cc(Cl)ccc1F ZINC000501899199 529691464 /nfs/dbraw/zinc/69/14/64/529691464.db2.gz JZBFJQZHOCPZKF-VIFPVBQESA-N 1 1 229.726 3.709 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)Cc1cccc2[nH]ccc21 ZINC000501899581 528888241 /nfs/dbraw/zinc/88/82/41/528888241.db2.gz NSFCPTYZKWJHCR-GFCCVEGCSA-N 1 1 230.355 3.788 20 0 BHADMO CCC[C@H](C)[N@@H+](C)Cc1cccc2[nH]ccc21 ZINC000501899597 528047815 /nfs/dbraw/zinc/04/78/15/528047815.db2.gz NSFCPTYZKWJHCR-LBPRGKRZSA-N 1 1 230.355 3.788 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)Cc1ccc(F)cc1C ZINC000501901531 528888641 /nfs/dbraw/zinc/88/86/41/528888641.db2.gz UXDBKCKOHLRYEM-GFCCVEGCSA-N 1 1 223.335 3.755 20 0 BHADMO CCC[C@H](C)[N@@H+](C)Cc1ccc(F)cc1C ZINC000501901534 528047312 /nfs/dbraw/zinc/04/73/12/528047312.db2.gz UXDBKCKOHLRYEM-LBPRGKRZSA-N 1 1 223.335 3.755 20 0 BHADMO CC[C@@H](C)[N@@H+](C)Cc1cc(C)cc(C)c1 ZINC000501902410 529344990 /nfs/dbraw/zinc/34/49/90/529344990.db2.gz YGQAQPJIRIOWNR-CYBMUJFWSA-N 1 1 205.345 3.534 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1cc(C)cc(C)c1 ZINC000501902414 529691162 /nfs/dbraw/zinc/69/11/62/529691162.db2.gz YGQAQPJIRIOWNR-ZDUSSCGKSA-N 1 1 205.345 3.534 20 0 BHADMO CC[C@@H](C)[N@@H+](C)Cc1cc(C)ccc1C ZINC000501902664 529344627 /nfs/dbraw/zinc/34/46/27/529344627.db2.gz YEDLKOFQHKYWCT-CYBMUJFWSA-N 1 1 205.345 3.534 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1cc(C)ccc1C ZINC000501902665 529691116 /nfs/dbraw/zinc/69/11/16/529691116.db2.gz YEDLKOFQHKYWCT-ZDUSSCGKSA-N 1 1 205.345 3.534 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)Cc1cccc2cc[nH]c21 ZINC000501912247 528888877 /nfs/dbraw/zinc/88/88/77/528888877.db2.gz BGYFHHFKBFIGGG-GFCCVEGCSA-N 1 1 230.355 3.788 20 0 BHADMO CCC[C@H](C)[N@@H+](C)Cc1cccc2cc[nH]c21 ZINC000501912248 528047839 /nfs/dbraw/zinc/04/78/39/528047839.db2.gz BGYFHHFKBFIGGG-LBPRGKRZSA-N 1 1 230.355 3.788 20 0 BHADMO CCC[C@H](C)[N@@H+](C)Cc1cc(F)cc(F)c1 ZINC000501915157 528048041 /nfs/dbraw/zinc/04/80/41/528048041.db2.gz JCCUGFAHXKDFLO-JTQLQIEISA-N 1 1 227.298 3.585 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)Cc1cc(F)cc(F)c1 ZINC000501915158 528887344 /nfs/dbraw/zinc/88/73/44/528887344.db2.gz JCCUGFAHXKDFLO-SNVBAGLBSA-N 1 1 227.298 3.585 20 0 BHADMO CCC[C@@H](C)[N@H+]1CCc2cc(C)ccc2C1 ZINC000501920331 528891083 /nfs/dbraw/zinc/89/10/83/528891083.db2.gz KYMBIJARHFWGFL-CYBMUJFWSA-N 1 1 217.356 3.542 20 0 BHADMO CCC[C@H](C)[N@H+]1CCc2cc(C)ccc2C1 ZINC000501920332 528051745 /nfs/dbraw/zinc/05/17/45/528051745.db2.gz KYMBIJARHFWGFL-ZDUSSCGKSA-N 1 1 217.356 3.542 20 0 BHADMO CCC[C@@H](C)[N@H+]1CCc2cccc(C)c2C1 ZINC000501931156 528891434 /nfs/dbraw/zinc/89/14/34/528891434.db2.gz ZZHWZJVBFVWSNY-CYBMUJFWSA-N 1 1 217.356 3.542 20 0 BHADMO CCC[C@H](C)[N@H+]1CCc2cccc(C)c2C1 ZINC000501931157 528052394 /nfs/dbraw/zinc/05/23/94/528052394.db2.gz ZZHWZJVBFVWSNY-ZDUSSCGKSA-N 1 1 217.356 3.542 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)Cc1cc(F)ccc1C ZINC000501937665 528886636 /nfs/dbraw/zinc/88/66/36/528886636.db2.gz HJABOSYWZMSPHX-GFCCVEGCSA-N 1 1 223.335 3.755 20 0 BHADMO CCC[C@H](C)[N@@H+](C)Cc1cc(F)ccc1C ZINC000501937666 528047159 /nfs/dbraw/zinc/04/71/59/528047159.db2.gz HJABOSYWZMSPHX-LBPRGKRZSA-N 1 1 223.335 3.755 20 0 BHADMO CCC[C@H](C)[N@@H+](C)CC1(c2ccccc2)CC1 ZINC000501948187 528046409 /nfs/dbraw/zinc/04/64/09/528046409.db2.gz FCDSGZYDUSPHLF-AWEZNQCLSA-N 1 1 231.383 3.839 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)CC1(c2ccccc2)CC1 ZINC000501948189 528887334 /nfs/dbraw/zinc/88/73/34/528887334.db2.gz FCDSGZYDUSPHLF-CQSZACIVSA-N 1 1 231.383 3.839 20 0 BHADMO CCC[C@@H](C)[N@H+]1Cc2ccccc2C2(CC2)C1 ZINC000501999875 528894866 /nfs/dbraw/zinc/89/48/66/528894866.db2.gz JMXWVTPVEXHLAI-CYBMUJFWSA-N 1 1 229.367 3.722 20 0 BHADMO CCC[C@H](C)[N@H+]1Cc2ccccc2C2(CC2)C1 ZINC000501999965 528056511 /nfs/dbraw/zinc/05/65/11/528056511.db2.gz JMXWVTPVEXHLAI-ZDUSSCGKSA-N 1 1 229.367 3.722 20 0 BHADMO Cc1cc(C[N@H+](CC(C)C)C2CC2)cc(C)c1O ZINC000502067682 226329150 /nfs/dbraw/zinc/32/91/50/226329150.db2.gz WVVWFOLGQICKTA-UHFFFAOYSA-N 1 1 247.382 3.629 20 0 BHADMO CCCCN(CCCC)c1cc(C)[nH+]c(C)n1 ZINC000502095601 528406960 /nfs/dbraw/zinc/40/69/60/528406960.db2.gz YCLGNHMTEGJZPN-UHFFFAOYSA-N 1 1 235.375 3.500 20 0 BHADMO CC[N@@H+](Cc1ccc(C(C)(C)C)cc1)C1CC1 ZINC000502211946 528777435 /nfs/dbraw/zinc/77/74/35/528777435.db2.gz XCLKGXZYJWCPSA-UHFFFAOYSA-N 1 1 231.383 3.968 20 0 BHADMO CC[N@@H+](Cc1ccccc1)[C@@H](C)CC(C)C ZINC000502423820 528830991 /nfs/dbraw/zinc/83/09/91/528830991.db2.gz DLFAZBMBJARONH-AWEZNQCLSA-N 1 1 219.372 3.943 20 0 BHADMO CC[N@@H+](Cc1ccccc1)[C@H](C)CC(C)C ZINC000502423821 528831361 /nfs/dbraw/zinc/83/13/61/528831361.db2.gz DLFAZBMBJARONH-CQSZACIVSA-N 1 1 219.372 3.943 20 0 BHADMO CC(C)C[C@@H](C)[N@H+]1CC[C@@H](c2ccccc2)C1 ZINC000502426751 528258889 /nfs/dbraw/zinc/25/88/89/528258889.db2.gz UJEFJPNTPINHOM-GDBMZVCRSA-N 1 1 231.383 3.911 20 0 BHADMO CC(C)C[C@H](C)[N@H+]1CC[C@@H](c2ccccc2)C1 ZINC000502426753 528467310 /nfs/dbraw/zinc/46/73/10/528467310.db2.gz UJEFJPNTPINHOM-GOEBONIOSA-N 1 1 231.383 3.911 20 0 BHADMO CC(C)C[C@H](C)[N@H+]1CC[C@H](c2ccccc2)C1 ZINC000502426754 528467697 /nfs/dbraw/zinc/46/76/97/528467697.db2.gz UJEFJPNTPINHOM-HOCLYGCPSA-N 1 1 231.383 3.911 20 0 BHADMO CC(C)C[C@@H](C)[N@H+]1CC[C@H](c2ccccc2)C1 ZINC000502426755 528257644 /nfs/dbraw/zinc/25/76/44/528257644.db2.gz UJEFJPNTPINHOM-ZBFHGGJFSA-N 1 1 231.383 3.911 20 0 BHADMO CC[N@@H+](CCC1CCCCC1)Cc1ccncc1 ZINC000502755473 528429134 /nfs/dbraw/zinc/42/91/34/528429134.db2.gz HVSYIXBPDZOJIL-UHFFFAOYSA-N 1 1 246.398 3.874 20 0 BHADMO FC(F)[C@H]1CCCC[N@H+]1CC1CCCCC1 ZINC000502786795 226330895 /nfs/dbraw/zinc/33/08/95/226330895.db2.gz CLKUZVTWTVNXJV-GFCCVEGCSA-N 1 1 231.330 3.686 20 0 BHADMO FC(F)[C@@H]1CCCC[N@H+]1CC1CCCCC1 ZINC000502786796 226330779 /nfs/dbraw/zinc/33/07/79/226330779.db2.gz CLKUZVTWTVNXJV-LBPRGKRZSA-N 1 1 231.330 3.686 20 0 BHADMO CC(C)CCC[N@H+]1CCCC[C@@H]1C(F)F ZINC000502805930 527703549 /nfs/dbraw/zinc/70/35/49/527703549.db2.gz BJUGUDARZVWGKT-LLVKDONJSA-N 1 1 219.319 3.542 20 0 BHADMO CC(C)CCC[N@@H+]1CCCC[C@@H]1C(F)F ZINC000502805930 527703548 /nfs/dbraw/zinc/70/35/48/527703548.db2.gz BJUGUDARZVWGKT-LLVKDONJSA-N 1 1 219.319 3.542 20 0 BHADMO CC(C)CCC[N@H+]1CCCC[C@H]1C(F)F ZINC000502805931 527703591 /nfs/dbraw/zinc/70/35/91/527703591.db2.gz BJUGUDARZVWGKT-NSHDSACASA-N 1 1 219.319 3.542 20 0 BHADMO CC(C)CCC[N@@H+]1CCCC[C@H]1C(F)F ZINC000502805931 527703589 /nfs/dbraw/zinc/70/35/89/527703589.db2.gz BJUGUDARZVWGKT-NSHDSACASA-N 1 1 219.319 3.542 20 0 BHADMO FC(F)[C@H]1CCCC[N@H+]1CCC1CCCC1 ZINC000502809399 226330858 /nfs/dbraw/zinc/33/08/58/226330858.db2.gz RPPKIUJVMVZDHQ-GFCCVEGCSA-N 1 1 231.330 3.686 20 0 BHADMO FC(F)[C@H]1CCCC[N@@H+]1CCC1CCCC1 ZINC000502809399 226330857 /nfs/dbraw/zinc/33/08/57/226330857.db2.gz RPPKIUJVMVZDHQ-GFCCVEGCSA-N 1 1 231.330 3.686 20 0 BHADMO FC(F)[C@@H]1CCCC[N@H+]1CCC1CCCC1 ZINC000502809400 226330902 /nfs/dbraw/zinc/33/09/02/226330902.db2.gz RPPKIUJVMVZDHQ-LBPRGKRZSA-N 1 1 231.330 3.686 20 0 BHADMO FC(F)[C@@H]1CCCC[N@@H+]1CCC1CCCC1 ZINC000502809400 226330901 /nfs/dbraw/zinc/33/09/01/226330901.db2.gz RPPKIUJVMVZDHQ-LBPRGKRZSA-N 1 1 231.330 3.686 20 0 BHADMO CC(C)(C)CC[N@H+]1CCCC[C@H]1C(F)F ZINC000502849067 527663374 /nfs/dbraw/zinc/66/33/74/527663374.db2.gz VZQMKZDXQBJOAY-JTQLQIEISA-N 1 1 219.319 3.542 20 0 BHADMO CC(C)(C)CC[N@@H+]1CCCC[C@H]1C(F)F ZINC000502849067 527663371 /nfs/dbraw/zinc/66/33/71/527663371.db2.gz VZQMKZDXQBJOAY-JTQLQIEISA-N 1 1 219.319 3.542 20 0 BHADMO CC(C)(C)CC[N@H+]1CCCC[C@@H]1C(F)F ZINC000502849068 527663696 /nfs/dbraw/zinc/66/36/96/527663696.db2.gz VZQMKZDXQBJOAY-SNVBAGLBSA-N 1 1 219.319 3.542 20 0 BHADMO CC(C)(C)CC[N@@H+]1CCCC[C@@H]1C(F)F ZINC000502849068 527663694 /nfs/dbraw/zinc/66/36/94/527663694.db2.gz VZQMKZDXQBJOAY-SNVBAGLBSA-N 1 1 219.319 3.542 20 0 BHADMO CCc1ccc(CCn2cc[nH+]c2C(C)C)cc1 ZINC000502856543 529630946 /nfs/dbraw/zinc/63/09/46/529630946.db2.gz PPYRNDKGCNECQU-UHFFFAOYSA-N 1 1 242.366 3.812 20 0 BHADMO Cc1cccc(CCCn2cc[nH+]c2C(C)C)c1 ZINC000502900639 534690870 /nfs/dbraw/zinc/69/08/70/534690870.db2.gz XAACUKDUKGYJBI-UHFFFAOYSA-N 1 1 242.366 3.948 20 0 BHADMO Cc1ccc[nH+]c1NC[C@H]1C[C@H]1c1ccccc1 ZINC000502992947 226331442 /nfs/dbraw/zinc/33/14/42/226331442.db2.gz DECMIBLSJDNVIZ-CABCVRRESA-N 1 1 238.334 3.606 20 0 BHADMO Cc1ccc[nH+]c1NC[C@H]1C[C@@H]1c1ccccc1 ZINC000502992957 226331405 /nfs/dbraw/zinc/33/14/05/226331405.db2.gz DECMIBLSJDNVIZ-HUUCEWRRSA-N 1 1 238.334 3.606 20 0 BHADMO Cc1ccc[nH+]c1NC[C@@H]1C[C@@H]1c1ccccc1 ZINC000502992958 226331445 /nfs/dbraw/zinc/33/14/45/226331445.db2.gz DECMIBLSJDNVIZ-LSDHHAIUSA-N 1 1 238.334 3.606 20 0 BHADMO Cc1ccc(NC[C@H]2C[C@H]2c2ccccc2)[nH+]c1 ZINC000503030507 226331321 /nfs/dbraw/zinc/33/13/21/226331321.db2.gz BNNIZAXEQUUSTO-CABCVRRESA-N 1 1 238.334 3.606 20 0 BHADMO Cc1ccc(NC[C@H]2C[C@@H]2c2ccccc2)[nH+]c1 ZINC000503030510 226331480 /nfs/dbraw/zinc/33/14/80/226331480.db2.gz BNNIZAXEQUUSTO-HUUCEWRRSA-N 1 1 238.334 3.606 20 0 BHADMO Cc1ccc(NC[C@@H]2C[C@@H]2c2ccccc2)[nH+]c1 ZINC000503030512 226331385 /nfs/dbraw/zinc/33/13/85/226331385.db2.gz BNNIZAXEQUUSTO-LSDHHAIUSA-N 1 1 238.334 3.606 20 0 BHADMO CCC[C@@H](C)C[N@H+]1CCCC[C@@H]1C(F)F ZINC000503106272 528877382 /nfs/dbraw/zinc/87/73/82/528877382.db2.gz CNFNRVPOTWJTBT-GHMZBOCLSA-N 1 1 219.319 3.542 20 0 BHADMO CCC[C@@H](C)C[N@@H+]1CCCC[C@@H]1C(F)F ZINC000503106272 528877379 /nfs/dbraw/zinc/87/73/79/528877379.db2.gz CNFNRVPOTWJTBT-GHMZBOCLSA-N 1 1 219.319 3.542 20 0 BHADMO CCC[C@@H](C)C[N@H+]1CCCC[C@H]1C(F)F ZINC000503106273 528877301 /nfs/dbraw/zinc/87/73/01/528877301.db2.gz CNFNRVPOTWJTBT-MNOVXSKESA-N 1 1 219.319 3.542 20 0 BHADMO CCC[C@@H](C)C[N@@H+]1CCCC[C@H]1C(F)F ZINC000503106273 528877295 /nfs/dbraw/zinc/87/72/95/528877295.db2.gz CNFNRVPOTWJTBT-MNOVXSKESA-N 1 1 219.319 3.542 20 0 BHADMO CCC[C@H](C)C[N@H+]1CCCC[C@H]1C(F)F ZINC000503106274 528031673 /nfs/dbraw/zinc/03/16/73/528031673.db2.gz CNFNRVPOTWJTBT-QWRGUYRKSA-N 1 1 219.319 3.542 20 0 BHADMO CCC[C@H](C)C[N@@H+]1CCCC[C@H]1C(F)F ZINC000503106274 528031669 /nfs/dbraw/zinc/03/16/69/528031669.db2.gz CNFNRVPOTWJTBT-QWRGUYRKSA-N 1 1 219.319 3.542 20 0 BHADMO CCC[C@H](C)C[N@H+]1CCCC[C@@H]1C(F)F ZINC000503106275 528033058 /nfs/dbraw/zinc/03/30/58/528033058.db2.gz CNFNRVPOTWJTBT-WDEREUQCSA-N 1 1 219.319 3.542 20 0 BHADMO CCC[C@H](C)C[N@@H+]1CCCC[C@@H]1C(F)F ZINC000503106275 528033053 /nfs/dbraw/zinc/03/30/53/528033053.db2.gz CNFNRVPOTWJTBT-WDEREUQCSA-N 1 1 219.319 3.542 20 0 BHADMO CCC(CC)C[N@H+]1CCCC[C@@H]1C(F)F ZINC000503117711 528751360 /nfs/dbraw/zinc/75/13/60/528751360.db2.gz IHBFMNGURZYABH-LLVKDONJSA-N 1 1 219.319 3.542 20 0 BHADMO CCC(CC)C[N@H+]1CCCC[C@H]1C(F)F ZINC000503117713 528752061 /nfs/dbraw/zinc/75/20/61/528752061.db2.gz IHBFMNGURZYABH-NSHDSACASA-N 1 1 219.319 3.542 20 0 BHADMO CC[C@@H](C)[N@@H+](C)Cc1cc(-c2ccccc2)on1 ZINC000503165501 529345022 /nfs/dbraw/zinc/34/50/22/529345022.db2.gz CDSPMYDYIQORNY-GFCCVEGCSA-N 1 1 244.338 3.572 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1cc(-c2ccccc2)on1 ZINC000503165517 529691230 /nfs/dbraw/zinc/69/12/30/529691230.db2.gz CDSPMYDYIQORNY-LBPRGKRZSA-N 1 1 244.338 3.572 20 0 BHADMO Fc1cccc(C[N@H+]2CCC[C@H]3CCCC[C@H]32)c1 ZINC000503245185 534518500 /nfs/dbraw/zinc/51/85/00/534518500.db2.gz KNKDULPLJHHRQS-GDBMZVCRSA-N 1 1 247.357 3.980 20 0 BHADMO Fc1cccc(C[N@H+]2CCC[C@@H]3CCCC[C@H]32)c1 ZINC000503245186 534516959 /nfs/dbraw/zinc/51/69/59/534516959.db2.gz KNKDULPLJHHRQS-GOEBONIOSA-N 1 1 247.357 3.980 20 0 BHADMO CC(C)(C)[C@H]1CCN(c2cc[nH+]cc2Cl)C1 ZINC000503550282 526733723 /nfs/dbraw/zinc/73/37/23/526733723.db2.gz FBDIMOVSENAZSL-JTQLQIEISA-N 1 1 238.762 3.607 20 0 BHADMO CC(C)(C)[C@@H]1CCN(c2cc[nH+]cc2Cl)C1 ZINC000503550283 526673715 /nfs/dbraw/zinc/67/37/15/526673715.db2.gz FBDIMOVSENAZSL-SNVBAGLBSA-N 1 1 238.762 3.607 20 0 BHADMO C[C@H]1CCN(c2cc[nH+]cc2Cl)CC1(C)C ZINC000503575103 226332438 /nfs/dbraw/zinc/33/24/38/226332438.db2.gz ZIOGSFSELLDRJM-JTQLQIEISA-N 1 1 238.762 3.607 20 0 BHADMO C[C@@H]1CCN(c2cc[nH+]cc2Cl)CC1(C)C ZINC000503575104 534059306 /nfs/dbraw/zinc/05/93/06/534059306.db2.gz ZIOGSFSELLDRJM-SNVBAGLBSA-N 1 1 238.762 3.607 20 0 BHADMO C[C@@H]1CN(c2cc[nH+]cc2Cl)CC(C)(C)C1 ZINC000503575735 226332458 /nfs/dbraw/zinc/33/24/58/226332458.db2.gz JEYINDDOUMFIPP-JTQLQIEISA-N 1 1 238.762 3.607 20 0 BHADMO C[C@H]1CN(c2cc[nH+]cc2Cl)CC(C)(C)C1 ZINC000503575736 533986193 /nfs/dbraw/zinc/98/61/93/533986193.db2.gz JEYINDDOUMFIPP-SNVBAGLBSA-N 1 1 238.762 3.607 20 0 BHADMO CC(C)[C@@H]1CCCN(c2cc[nH+]cc2Cl)C1 ZINC000503576572 528669340 /nfs/dbraw/zinc/66/93/40/528669340.db2.gz QLBLBSYNHGZMNT-LLVKDONJSA-N 1 1 238.762 3.607 20 0 BHADMO CC(C)[C@H]1CCCN(c2cc[nH+]cc2Cl)C1 ZINC000503576573 527780402 /nfs/dbraw/zinc/78/04/02/527780402.db2.gz QLBLBSYNHGZMNT-NSHDSACASA-N 1 1 238.762 3.607 20 0 BHADMO CC[C@H](c1ccccc1)[C@@H]1CCC[N@H+]1CC ZINC000503583787 529183171 /nfs/dbraw/zinc/18/31/71/529183171.db2.gz WOTQLVQAUQLTCA-CABCVRRESA-N 1 1 217.356 3.665 20 0 BHADMO CC[C@@H](c1ccccc1)[C@@H]1CCC[N@H+]1CC ZINC000503583788 529257622 /nfs/dbraw/zinc/25/76/22/529257622.db2.gz WOTQLVQAUQLTCA-GJZGRUSLSA-N 1 1 217.356 3.665 20 0 BHADMO CC[C@H](c1ccccc1)[C@H]1CCC[N@H+]1CC ZINC000503583789 529183759 /nfs/dbraw/zinc/18/37/59/529183759.db2.gz WOTQLVQAUQLTCA-HUUCEWRRSA-N 1 1 217.356 3.665 20 0 BHADMO CC[C@@H](c1ccccc1)[C@H]1CCC[N@H+]1CC ZINC000503583790 529257477 /nfs/dbraw/zinc/25/74/77/529257477.db2.gz WOTQLVQAUQLTCA-LSDHHAIUSA-N 1 1 217.356 3.665 20 0 BHADMO CC1(C)CCCCN(c2cc[nH+]cc2Cl)C1 ZINC000503601662 528913441 /nfs/dbraw/zinc/91/34/41/528913441.db2.gz HKSRAGZWJONFMQ-UHFFFAOYSA-N 1 1 238.762 3.752 20 0 BHADMO CC[N@@H+]([C@@H](C)c1ccccc1Cl)C1CC1 ZINC000503604850 528923480 /nfs/dbraw/zinc/92/34/80/528923480.db2.gz ONLZPPNWXVDASZ-JTQLQIEISA-N 1 1 223.747 3.885 20 0 BHADMO CC[N@@H+]([C@H](C)c1ccccc1Cl)C1CC1 ZINC000503604851 528924887 /nfs/dbraw/zinc/92/48/87/528924887.db2.gz ONLZPPNWXVDASZ-SNVBAGLBSA-N 1 1 223.747 3.885 20 0 BHADMO CC(C)CC[N@@H+](C)Cc1ccc(F)cc1Cl ZINC000503614243 527711080 /nfs/dbraw/zinc/71/10/80/527711080.db2.gz JURMJEQVDREXBW-UHFFFAOYSA-N 1 1 243.753 3.957 20 0 BHADMO CC[N@@H+](Cc1c(F)cccc1F)C1CCCC1 ZINC000503619191 528760486 /nfs/dbraw/zinc/76/04/86/528760486.db2.gz WXSFRCWAYRPWFN-UHFFFAOYSA-N 1 1 239.309 3.729 20 0 BHADMO CCCC[N@@H+](C)Cc1ccc(Cl)cc1F ZINC000503633848 528359975 /nfs/dbraw/zinc/35/99/75/528359975.db2.gz FWFFFPSJTNRBOC-UHFFFAOYSA-N 1 1 229.726 3.711 20 0 BHADMO CC(C)C[N@@H+](C)Cc1ccc(Cl)cc1F ZINC000503639010 527915263 /nfs/dbraw/zinc/91/52/63/527915263.db2.gz CYBIYQBZWVIDMC-UHFFFAOYSA-N 1 1 229.726 3.567 20 0 BHADMO CC[N@@H+](C)Cc1ccccc1-c1ccccc1 ZINC000503640309 527847903 /nfs/dbraw/zinc/84/79/03/527847903.db2.gz YKALZKHSKQBMEO-UHFFFAOYSA-N 1 1 225.335 3.805 20 0 BHADMO Fc1ccccc1[C@H]1CC[N@@H+](CC2CCCC2)C1 ZINC000503692259 534533952 /nfs/dbraw/zinc/53/39/52/534533952.db2.gz KKZIKJFWPWMXKY-AWEZNQCLSA-N 1 1 247.357 3.805 20 0 BHADMO Fc1ccccc1[C@@H]1CC[N@@H+](CC2CCCC2)C1 ZINC000503692260 534532466 /nfs/dbraw/zinc/53/24/66/534532466.db2.gz KKZIKJFWPWMXKY-CQSZACIVSA-N 1 1 247.357 3.805 20 0 BHADMO CC(C)=CC[N@H+]1CC[C@@H](c2ccccc2F)C1 ZINC000503702958 527430853 /nfs/dbraw/zinc/43/08/53/527430853.db2.gz RVCAHLDFMUYNRU-CYBMUJFWSA-N 1 1 233.330 3.581 20 0 BHADMO CC(C)=CC[N@H+]1CC[C@H](c2ccccc2F)C1 ZINC000503702959 527430577 /nfs/dbraw/zinc/43/05/77/527430577.db2.gz RVCAHLDFMUYNRU-ZDUSSCGKSA-N 1 1 233.330 3.581 20 0 BHADMO CCc1cc(OC)ccc1C[N@H+](CC)C1CCC1 ZINC000503884303 529567190 /nfs/dbraw/zinc/56/71/90/529567190.db2.gz HGIPLXDLEUEEPX-UHFFFAOYSA-N 1 1 247.382 3.632 20 0 BHADMO C[C@@H]([NH2+]C1(C(F)F)CC1)[C@@H](C)c1ccccc1 ZINC000503889227 533328738 /nfs/dbraw/zinc/32/87/38/533328738.db2.gz WFTFIFKKQRYSMW-GHMZBOCLSA-N 1 1 239.309 3.566 20 0 BHADMO C[C@H]([NH2+]C1(C(F)F)CC1)[C@@H](C)c1ccccc1 ZINC000503889228 533788334 /nfs/dbraw/zinc/78/83/34/533788334.db2.gz WFTFIFKKQRYSMW-MNOVXSKESA-N 1 1 239.309 3.566 20 0 BHADMO C[C@H](c1ccccc1)[C@H](C)[NH2+]C1(C(F)F)CC1 ZINC000503889229 226336368 /nfs/dbraw/zinc/33/63/68/226336368.db2.gz WFTFIFKKQRYSMW-QWRGUYRKSA-N 1 1 239.309 3.566 20 0 BHADMO C[C@@H]([NH2+]C1(C(F)F)CC1)[C@H](C)c1ccccc1 ZINC000503889230 533328459 /nfs/dbraw/zinc/32/84/59/533328459.db2.gz WFTFIFKKQRYSMW-WDEREUQCSA-N 1 1 239.309 3.566 20 0 BHADMO CC(C)C[C@H]1CCC[C@H]([NH2+]C2(C(F)F)CC2)C1 ZINC000503892346 528592209 /nfs/dbraw/zinc/59/22/09/528592209.db2.gz LVHFFDUNPGFIQG-NEPJUHHUSA-N 1 1 245.357 3.979 20 0 BHADMO CC(C)C[C@@H]1CCC[C@@H]([NH2+]C2(C(F)F)CC2)C1 ZINC000503892347 528381557 /nfs/dbraw/zinc/38/15/57/528381557.db2.gz LVHFFDUNPGFIQG-NWDGAFQWSA-N 1 1 245.357 3.979 20 0 BHADMO CC(C)C[C@@H]1CCC[C@H]([NH2+]C2(C(F)F)CC2)C1 ZINC000503892348 528382554 /nfs/dbraw/zinc/38/25/54/528382554.db2.gz LVHFFDUNPGFIQG-RYUDHWBXSA-N 1 1 245.357 3.979 20 0 BHADMO CC(C)C[C@H]1CCC[C@@H]([NH2+]C2(C(F)F)CC2)C1 ZINC000503892349 528591735 /nfs/dbraw/zinc/59/17/35/528591735.db2.gz LVHFFDUNPGFIQG-VXGBXAGGSA-N 1 1 245.357 3.979 20 0 BHADMO CCc1cc(OC)ccc1C[N@@H+](C)C1CCCC1 ZINC000503892685 529566910 /nfs/dbraw/zinc/56/69/10/529566910.db2.gz MRQQRHVLKAAZQH-UHFFFAOYSA-N 1 1 247.382 3.632 20 0 BHADMO CC(C)(C)C1CCC([NH2+]C2(C(F)F)CC2)CC1 ZINC000503910572 527632237 /nfs/dbraw/zinc/63/22/37/527632237.db2.gz MOGYAARBHBHYRE-UHFFFAOYSA-N 1 1 245.357 3.979 20 0 BHADMO CC(C)[C@@H]1CC[C@H]([NH2+]C2(C(F)F)CC2)C[C@@H]1C ZINC000503941173 528707445 /nfs/dbraw/zinc/70/74/45/528707445.db2.gz FXNXPTCCPUUTEI-SRVKXCTJSA-N 1 1 245.357 3.835 20 0 BHADMO CC(C)[C@@H]1CC[C@@H]([NH2+]C2(C(F)F)CC2)C[C@@H]1C ZINC000503941174 528707089 /nfs/dbraw/zinc/70/70/89/528707089.db2.gz FXNXPTCCPUUTEI-TUAOUCFPSA-N 1 1 245.357 3.835 20 0 BHADMO CC(C)[C@@H]1CC[C@@H]([NH2+]C2(C(F)F)CC2)C[C@H]1C ZINC000503941175 528707577 /nfs/dbraw/zinc/70/75/77/528707577.db2.gz FXNXPTCCPUUTEI-UTUOFQBUSA-N 1 1 245.357 3.835 20 0 BHADMO CC(C)[C@@H]1CC[C@H]([NH2+]C2(C(F)F)CC2)C[C@H]1C ZINC000503941176 528707514 /nfs/dbraw/zinc/70/75/14/528707514.db2.gz FXNXPTCCPUUTEI-WOPDTQHZSA-N 1 1 245.357 3.835 20 0 BHADMO CC[N@@H+](C)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000503951139 527864315 /nfs/dbraw/zinc/86/43/15/527864315.db2.gz DTBGMLNLVWISPG-SECBINFHSA-N 1 1 231.261 3.718 20 0 BHADMO CC[N@@H+](C)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000503951145 527861650 /nfs/dbraw/zinc/86/16/50/527861650.db2.gz DTBGMLNLVWISPG-VIFPVBQESA-N 1 1 231.261 3.718 20 0 BHADMO CC[N@@H+](CCOC)[C@@H](C)c1ccc(C(C)C)cc1 ZINC000503951984 528564564 /nfs/dbraw/zinc/56/45/64/528564564.db2.gz HEJKMQAIDOMMNE-AWEZNQCLSA-N 1 1 249.398 3.839 20 0 BHADMO CC[N@@H+](CCOC)[C@H](C)c1ccc(C(C)C)cc1 ZINC000503951985 528565318 /nfs/dbraw/zinc/56/53/18/528565318.db2.gz HEJKMQAIDOMMNE-CQSZACIVSA-N 1 1 249.398 3.839 20 0 BHADMO CC[N@H+]1CCC[C@H]1Cc1c(F)cccc1Cl ZINC000503953555 529106890 /nfs/dbraw/zinc/10/68/90/529106890.db2.gz PGQDBRVTZXQYFE-JTQLQIEISA-N 1 1 241.737 3.506 20 0 BHADMO CC[N@H+]1CCC[C@@H]1Cc1c(F)cccc1Cl ZINC000503953556 529083158 /nfs/dbraw/zinc/08/31/58/529083158.db2.gz PGQDBRVTZXQYFE-SNVBAGLBSA-N 1 1 241.737 3.506 20 0 BHADMO CCC[N@@H+](CC)[C@@H](C)c1cc(F)ccc1F ZINC000503953591 528005563 /nfs/dbraw/zinc/00/55/63/528005563.db2.gz PNSINRQPXYEQOI-JTQLQIEISA-N 1 1 227.298 3.758 20 0 BHADMO CCC[N@@H+](CC)[C@H](C)c1cc(F)ccc1F ZINC000503953592 528005145 /nfs/dbraw/zinc/00/51/45/528005145.db2.gz PNSINRQPXYEQOI-SNVBAGLBSA-N 1 1 227.298 3.758 20 0 BHADMO CCC[N@@H+](CC)Cc1c(F)cccc1Cl ZINC000503954055 527999724 /nfs/dbraw/zinc/99/97/24/527999724.db2.gz STTGHIVSMQWERK-UHFFFAOYSA-N 1 1 229.726 3.711 20 0 BHADMO CCC[N@@H+](CC)[C@H](C)c1cccc(F)c1 ZINC000503954381 528006328 /nfs/dbraw/zinc/00/63/28/528006328.db2.gz WLNDHSQIDOKFRS-LLVKDONJSA-N 1 1 209.308 3.619 20 0 BHADMO CCC[N@@H+](CC)[C@@H](C)c1cccc(F)c1 ZINC000503954382 528006014 /nfs/dbraw/zinc/00/60/14/528006014.db2.gz WLNDHSQIDOKFRS-NSHDSACASA-N 1 1 209.308 3.619 20 0 BHADMO CCOc1ccc(C[N@@H+](CC)CC(C)C)cc1 ZINC000503956898 528431388 /nfs/dbraw/zinc/43/13/88/528431388.db2.gz DLFULOPETHSDRL-UHFFFAOYSA-N 1 1 235.371 3.563 20 0 BHADMO CC[N@@H+](CC(C)C)[C@H](C)c1ccccc1F ZINC000503964820 527963291 /nfs/dbraw/zinc/96/32/91/527963291.db2.gz TVNFWNXMSHYRQD-GFCCVEGCSA-N 1 1 223.335 3.865 20 0 BHADMO CC[N@@H+](CC(C)C)[C@@H](C)c1ccccc1F ZINC000503964821 527963473 /nfs/dbraw/zinc/96/34/73/527963473.db2.gz TVNFWNXMSHYRQD-LBPRGKRZSA-N 1 1 223.335 3.865 20 0 BHADMO CCCCC[N@@H+](CC)Cc1ccc(F)cc1 ZINC000503966028 528167641 /nfs/dbraw/zinc/16/76/41/528167641.db2.gz YRGUYMOOFIZNMW-UHFFFAOYSA-N 1 1 223.335 3.838 20 0 BHADMO CC[N@H+]1CCC[C@H]1c1cccc2ccccc21 ZINC000503969807 529108062 /nfs/dbraw/zinc/10/80/62/529108062.db2.gz NMIUBDTXTMLKRG-INIZCTEOSA-N 1 1 225.335 3.997 20 0 BHADMO CC[N@@H+](Cc1ccc2ccccc2c1)C1CC1 ZINC000503969934 528801818 /nfs/dbraw/zinc/80/18/18/528801818.db2.gz OPAMTEZTRBRZMU-UHFFFAOYSA-N 1 1 225.335 3.824 20 0 BHADMO CC[N@@H+](CC(C)C)[C@H](C)c1cccc(F)c1 ZINC000503970610 527963336 /nfs/dbraw/zinc/96/33/36/527963336.db2.gz URQAADNJCHYOBI-GFCCVEGCSA-N 1 1 223.335 3.865 20 0 BHADMO CC[N@@H+](CC(C)C)[C@@H](C)c1cccc(F)c1 ZINC000503970611 527963372 /nfs/dbraw/zinc/96/33/72/527963372.db2.gz URQAADNJCHYOBI-LBPRGKRZSA-N 1 1 223.335 3.865 20 0 BHADMO CC[N@@H+](Cc1ccc(C)cc1C)C(C)C ZINC000503977010 528776540 /nfs/dbraw/zinc/77/65/40/528776540.db2.gz OMHLCDPINUJKHF-UHFFFAOYSA-N 1 1 205.345 3.534 20 0 BHADMO CC[N@@H+](CCc1ccc(F)cc1)C1CCCC1 ZINC000503978203 528587499 /nfs/dbraw/zinc/58/74/99/528587499.db2.gz VNFUGJLVSUPPAR-UHFFFAOYSA-N 1 1 235.346 3.633 20 0 BHADMO CC[N@@H+](CC(C)C)[C@H](C)c1ccccc1 ZINC000503978796 527963436 /nfs/dbraw/zinc/96/34/36/527963436.db2.gz YFCGKMJOBREJQE-CYBMUJFWSA-N 1 1 205.345 3.726 20 0 BHADMO CC[N@@H+](CC(C)C)[C@@H](C)c1ccccc1 ZINC000503978797 527963656 /nfs/dbraw/zinc/96/36/56/527963656.db2.gz YFCGKMJOBREJQE-ZDUSSCGKSA-N 1 1 205.345 3.726 20 0 BHADMO CC[N@@H+](Cc1c(F)cccc1Cl)C(C)C ZINC000503983404 528756631 /nfs/dbraw/zinc/75/66/31/528756631.db2.gz AGRYFTQHZFJJFR-UHFFFAOYSA-N 1 1 229.726 3.709 20 0 BHADMO CC[N@H+](Cc1c(F)cccc1Cl)C(C)C ZINC000503983404 528756626 /nfs/dbraw/zinc/75/66/26/528756626.db2.gz AGRYFTQHZFJJFR-UHFFFAOYSA-N 1 1 229.726 3.709 20 0 BHADMO CC[N@@H+](Cc1c(Cl)cccc1Cl)C1CC1 ZINC000503984348 528756219 /nfs/dbraw/zinc/75/62/19/528756219.db2.gz DXYUDYNHBWRQCK-UHFFFAOYSA-N 1 1 244.165 3.978 20 0 BHADMO CC[N@H+](Cc1c(Cl)cccc1Cl)C1CC1 ZINC000503984348 528756214 /nfs/dbraw/zinc/75/62/14/528756214.db2.gz DXYUDYNHBWRQCK-UHFFFAOYSA-N 1 1 244.165 3.978 20 0 BHADMO CC[N@@H+](Cc1cccc(C(F)(F)F)c1)C(C)C ZINC000503985615 528803524 /nfs/dbraw/zinc/80/35/24/528803524.db2.gz JSZBOVOKHKAIDG-UHFFFAOYSA-N 1 1 245.288 3.936 20 0 BHADMO CC[N@@H+](Cc1ccccc1C(F)(F)F)C(C)C ZINC000503986042 528832198 /nfs/dbraw/zinc/83/21/98/528832198.db2.gz LZLVFUUQZDPKQG-UHFFFAOYSA-N 1 1 245.288 3.936 20 0 BHADMO CCCC[N@@H+](CC)[C@@H](C)c1cccc(OC)c1 ZINC000503988415 528396801 /nfs/dbraw/zinc/39/68/01/528396801.db2.gz DFYFGXUBBWLAQW-ZDUSSCGKSA-N 1 1 235.371 3.878 20 0 BHADMO CC[N@@H+](CCC(C)C)Cc1ccc(OC)cc1 ZINC000503988943 528406412 /nfs/dbraw/zinc/40/64/12/528406412.db2.gz GWYLZNBVHFDSNU-UHFFFAOYSA-N 1 1 235.371 3.563 20 0 BHADMO CC[N@@H+](CCc1ccc(OC)cc1)[C@@H](C)C(C)C ZINC000503989888 528586904 /nfs/dbraw/zinc/58/69/04/528586904.db2.gz LEPKPUFNTCIVEA-AWEZNQCLSA-N 1 1 249.398 3.604 20 0 BHADMO CC[N@@H+](CCc1ccc(OC)cc1)[C@H](C)C(C)C ZINC000503989889 528586505 /nfs/dbraw/zinc/58/65/05/528586505.db2.gz LEPKPUFNTCIVEA-CQSZACIVSA-N 1 1 249.398 3.604 20 0 BHADMO CC[N@@H+](Cc1cccc(Cl)c1Cl)C1CC1 ZINC000503991747 528806150 /nfs/dbraw/zinc/80/61/50/528806150.db2.gz HJMDNBQXJXSEIL-UHFFFAOYSA-N 1 1 244.165 3.978 20 0 BHADMO CC[N@@H+](CCc1ccccc1F)C1CCCC1 ZINC000503992505 528593053 /nfs/dbraw/zinc/59/30/53/528593053.db2.gz KLXVAIOVQKKDFE-UHFFFAOYSA-N 1 1 235.346 3.633 20 0 BHADMO CCC[N@@H+](CC)Cc1ccc(Cl)cc1 ZINC000503994405 528004475 /nfs/dbraw/zinc/00/44/75/528004475.db2.gz YBEGULPTZFECBZ-UHFFFAOYSA-N 1 1 211.736 3.572 20 0 BHADMO CCC[N@@H+](CC)[C@H](C)c1ccccc1F ZINC000504000631 528005909 /nfs/dbraw/zinc/00/59/09/528005909.db2.gz CTKIPHKREQFSSZ-LLVKDONJSA-N 1 1 209.308 3.619 20 0 BHADMO CCC[N@@H+](CC)[C@@H](C)c1ccccc1F ZINC000504000632 528005858 /nfs/dbraw/zinc/00/58/58/528005858.db2.gz CTKIPHKREQFSSZ-NSHDSACASA-N 1 1 209.308 3.619 20 0 BHADMO CC[N@@H+](CCc1ccccc1)[C@@H](C)C(C)C ZINC000504000671 528593405 /nfs/dbraw/zinc/59/34/05/528593405.db2.gz DHFHULGKFQSIGP-AWEZNQCLSA-N 1 1 219.372 3.596 20 0 BHADMO CC[N@@H+](CCc1ccccc1)[C@H](C)C(C)C ZINC000504000672 528593134 /nfs/dbraw/zinc/59/31/34/528593134.db2.gz DHFHULGKFQSIGP-CQSZACIVSA-N 1 1 219.372 3.596 20 0 BHADMO CCC[N@@H+](CC)[C@@H](C)c1c(F)cccc1F ZINC000504001230 528005258 /nfs/dbraw/zinc/00/52/58/528005258.db2.gz JAFAHHPTDTYTFP-JTQLQIEISA-N 1 1 227.298 3.758 20 0 BHADMO CCC[N@@H+](CC)[C@H](C)c1c(F)cccc1F ZINC000504001231 528006064 /nfs/dbraw/zinc/00/60/64/528006064.db2.gz JAFAHHPTDTYTFP-SNVBAGLBSA-N 1 1 227.298 3.758 20 0 BHADMO CCC[N@@H+](CC)[C@@H](CC)c1ccccc1 ZINC000504002300 528006285 /nfs/dbraw/zinc/00/62/85/528006285.db2.gz OBFMKYOYWCJQNH-AWEZNQCLSA-N 1 1 205.345 3.870 20 0 BHADMO CCC[N@@H+](CC)[C@H](CC)c1ccccc1 ZINC000504002301 528005483 /nfs/dbraw/zinc/00/54/83/528005483.db2.gz OBFMKYOYWCJQNH-CQSZACIVSA-N 1 1 205.345 3.870 20 0 BHADMO CCC[N@@H+](CC)[C@H](C)c1ccccc1C ZINC000504003213 528005376 /nfs/dbraw/zinc/00/53/76/528005376.db2.gz DRUNUKVIUIBSDV-CYBMUJFWSA-N 1 1 205.345 3.788 20 0 BHADMO CCC[N@@H+](CC)[C@@H](C)c1ccccc1C ZINC000504003214 528006105 /nfs/dbraw/zinc/00/61/05/528006105.db2.gz DRUNUKVIUIBSDV-ZDUSSCGKSA-N 1 1 205.345 3.788 20 0 BHADMO CCC[N@@H+](CC)Cc1ccccc1C(F)(F)F ZINC000504003313 528003908 /nfs/dbraw/zinc/00/39/08/528003908.db2.gz RIXDUMCJEUOKBK-UHFFFAOYSA-N 1 1 245.288 3.937 20 0 BHADMO CC[N@@H+](Cc1ccc(Cl)cc1Cl)C1CC1 ZINC000504003756 528783490 /nfs/dbraw/zinc/78/34/90/528783490.db2.gz SHGDROYYYDWMKG-UHFFFAOYSA-N 1 1 244.165 3.978 20 0 BHADMO CC[N@@H+](Cc1ccc(C(F)(F)F)cc1)C(C)C ZINC000504004315 528777105 /nfs/dbraw/zinc/77/71/05/528777105.db2.gz IGNNIRSKIJMASJ-UHFFFAOYSA-N 1 1 245.288 3.936 20 0 BHADMO CCC[N@@H+](CC)[C@@H](C)c1ccc(F)cc1F ZINC000504004675 528005578 /nfs/dbraw/zinc/00/55/78/528005578.db2.gz IOGHSGVKDWHDRB-JTQLQIEISA-N 1 1 227.298 3.758 20 0 BHADMO CCC[N@@H+](CC)[C@H](C)c1ccc(F)cc1F ZINC000504004676 528005073 /nfs/dbraw/zinc/00/50/73/528005073.db2.gz IOGHSGVKDWHDRB-SNVBAGLBSA-N 1 1 227.298 3.758 20 0 BHADMO CCC[N@@H+](CC)Cc1ccc(C(F)(F)F)cc1 ZINC000504004954 528003519 /nfs/dbraw/zinc/00/35/19/528003519.db2.gz YBNVZPGKNRJIRP-UHFFFAOYSA-N 1 1 245.288 3.937 20 0 BHADMO CCC[N@@H+](CC)[C@@H](C)c1ccc(F)c(F)c1 ZINC000504008157 528005690 /nfs/dbraw/zinc/00/56/90/528005690.db2.gz UKMKPPJEILGPTQ-JTQLQIEISA-N 1 1 227.298 3.758 20 0 BHADMO CCC[N@@H+](CC)[C@H](C)c1ccc(F)c(F)c1 ZINC000504008158 528006254 /nfs/dbraw/zinc/00/62/54/528006254.db2.gz UKMKPPJEILGPTQ-SNVBAGLBSA-N 1 1 227.298 3.758 20 0 BHADMO CC[N@H+](CCc1cccs1)CCC(C)C ZINC000504009730 528597376 /nfs/dbraw/zinc/59/73/76/528597376.db2.gz ZMUIZHCTVDKUTQ-UHFFFAOYSA-N 1 1 225.401 3.659 20 0 BHADMO COc1ccc([C@H]2CC[N@@H+](CCC(C)C)C2)cc1 ZINC000504489404 533207065 /nfs/dbraw/zinc/20/70/65/533207065.db2.gz PIPFVXPFTHVNGS-HNNXBMFYSA-N 1 1 247.382 3.531 20 0 BHADMO COc1ccc([C@@H]2CC[N@@H+](CCC(C)C)C2)cc1 ZINC000504489406 533146002 /nfs/dbraw/zinc/14/60/02/533146002.db2.gz PIPFVXPFTHVNGS-OAHLLOKOSA-N 1 1 247.382 3.531 20 0 BHADMO C[C@H](CC[NH2+]C1(C(F)F)CC1)c1ccccc1 ZINC000504540209 533940717 /nfs/dbraw/zinc/94/07/17/533940717.db2.gz GMUAXWDOJLPJDP-LLVKDONJSA-N 1 1 239.309 3.568 20 0 BHADMO C[C@@H](CC[NH2+]C1(C(F)F)CC1)c1ccccc1 ZINC000504540210 533606927 /nfs/dbraw/zinc/60/69/27/533606927.db2.gz GMUAXWDOJLPJDP-NSHDSACASA-N 1 1 239.309 3.568 20 0 BHADMO CC[C@H](C[NH2+]C1(C(F)F)CC1)c1ccccc1 ZINC000504567577 529360453 /nfs/dbraw/zinc/36/04/53/529360453.db2.gz FQRYEHQRBVXVFQ-LLVKDONJSA-N 1 1 239.309 3.568 20 0 BHADMO CC[C@@H](C[NH2+]C1(C(F)F)CC1)c1ccccc1 ZINC000504567578 529489666 /nfs/dbraw/zinc/48/96/66/529489666.db2.gz FQRYEHQRBVXVFQ-NSHDSACASA-N 1 1 239.309 3.568 20 0 BHADMO Cc1ccc2c(c1)[nH+]c(C)cc2OCCCCF ZINC000504947294 226352229 /nfs/dbraw/zinc/35/22/29/226352229.db2.gz FGJQXIZILRVDCY-UHFFFAOYSA-N 1 1 247.313 3.980 20 0 BHADMO Cc1cc(OCC[C@@H](C)F)c2c(C)cccc2[nH+]1 ZINC000504947621 226352220 /nfs/dbraw/zinc/35/22/20/226352220.db2.gz GBGYAGDSBIESSB-LLVKDONJSA-N 1 1 247.313 3.979 20 0 BHADMO Cc1cc(OCC[C@H](C)F)c2c(C)cccc2[nH+]1 ZINC000504947622 226352155 /nfs/dbraw/zinc/35/21/55/226352155.db2.gz GBGYAGDSBIESSB-NSHDSACASA-N 1 1 247.313 3.979 20 0 BHADMO Cc1ccc2c(c1)[nH+]c(C)cc2OCC[C@@H](C)F ZINC000504948808 226352250 /nfs/dbraw/zinc/35/22/50/226352250.db2.gz LPAFXUUBLHXJMC-LLVKDONJSA-N 1 1 247.313 3.979 20 0 BHADMO Cc1ccc2c(c1)[nH+]c(C)cc2OCC[C@H](C)F ZINC000504948809 226352299 /nfs/dbraw/zinc/35/22/99/226352299.db2.gz LPAFXUUBLHXJMC-NSHDSACASA-N 1 1 247.313 3.979 20 0 BHADMO Cc1cc(OCCCCF)c2c(C)cccc2[nH+]1 ZINC000504950685 226352222 /nfs/dbraw/zinc/35/22/22/226352222.db2.gz VLALLARBMWAQHG-UHFFFAOYSA-N 1 1 247.313 3.980 20 0 BHADMO CC(C)[C@@H](C)[N@@H+](Cc1ccccc1)C1CC1 ZINC000505228606 528408190 /nfs/dbraw/zinc/40/81/90/528408190.db2.gz BADRQKDRNGXCID-CYBMUJFWSA-N 1 1 217.356 3.696 20 0 BHADMO CC(C)[C@H](C)[N@@H+](Cc1ccccc1)C1CC1 ZINC000505228607 528961053 /nfs/dbraw/zinc/96/10/53/528961053.db2.gz BADRQKDRNGXCID-ZDUSSCGKSA-N 1 1 217.356 3.696 20 0 BHADMO C[N@H+](Cc1coc2ccccc12)CC1CCC1 ZINC000505228622 530019042 /nfs/dbraw/zinc/01/90/42/530019042.db2.gz BJMHGMIIBOYVKZ-UHFFFAOYSA-N 1 1 229.323 3.665 20 0 BHADMO CCC[N@@H+](CC)C[C@H]1C[C@H]1c1ccccc1 ZINC000505228806 528001247 /nfs/dbraw/zinc/00/12/47/528001247.db2.gz CZSNXDOXYINOLO-CABCVRRESA-N 1 1 217.356 3.522 20 0 BHADMO CCC[N@@H+](CC)C[C@H]1C[C@@H]1c1ccccc1 ZINC000505228807 528000136 /nfs/dbraw/zinc/00/01/36/528000136.db2.gz CZSNXDOXYINOLO-HUUCEWRRSA-N 1 1 217.356 3.522 20 0 BHADMO CCC[N@@H+](CC)C[C@@H]1C[C@@H]1c1ccccc1 ZINC000505228808 527992489 /nfs/dbraw/zinc/99/24/89/527992489.db2.gz CZSNXDOXYINOLO-LSDHHAIUSA-N 1 1 217.356 3.522 20 0 BHADMO CCC[N@@H+](CC)C/C=C/c1ccc(F)cc1 ZINC000505229854 527962329 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CC(C)[N@@H+](C)Cc1ccc(C(C)(C)C)s1 ZINC000505867515 528835590 /nfs/dbraw/zinc/83/55/90/528835590.db2.gz HQEZSYWKOUODSR-UHFFFAOYSA-N 1 1 225.401 3.886 20 0 BHADMO Cc1cc2cc(C[N@H+](C)C(C)C)oc2cc1C ZINC000505867981 534086800 /nfs/dbraw/zinc/08/68/00/534086800.db2.gz JQPRCFTUADMLFQ-UHFFFAOYSA-N 1 1 231.339 3.890 20 0 BHADMO CCCCOc1ccc(C[N@@H+](C)C(C)C)cc1 ZINC000505868024 528672167 /nfs/dbraw/zinc/67/21/67/528672167.db2.gz KCFDDKHIGDSWRU-UHFFFAOYSA-N 1 1 235.371 3.706 20 0 BHADMO CCCC[N@@H+](C)Cc1cc(F)cc2cccnc21 ZINC000505868054 528359327 /nfs/dbraw/zinc/35/93/27/528359327.db2.gz KKEAQHQTBWMQEH-UHFFFAOYSA-N 1 1 246.329 3.606 20 0 BHADMO Cc1ccc(F)c(C[N@@H+]2CCCC[C@H]2C)c1 ZINC000505869203 226361045 /nfs/dbraw/zinc/36/10/45/226361045.db2.gz VOCOOQGUENQBIP-GFCCVEGCSA-N 1 1 221.319 3.509 20 0 BHADMO Cc1ccc(F)c(C[N@@H+]2CCCC[C@@H]2C)c1 ZINC000505869204 226361017 /nfs/dbraw/zinc/36/10/17/226361017.db2.gz VOCOOQGUENQBIP-LBPRGKRZSA-N 1 1 221.319 3.509 20 0 BHADMO CC(C)[N@@H+](C)Cc1ccc(-c2ccccc2F)o1 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ATKPXPGIQLDNEO-UHFFFAOYSA-N 1 1 217.312 3.665 20 0 BHADMO CC(C)[N@@H+](C)Cc1c(Cl)cccc1Cl ZINC000505881618 528835410 /nfs/dbraw/zinc/83/54/10/528835410.db2.gz OYMJJTFLXQHCPX-UHFFFAOYSA-N 1 1 232.154 3.834 20 0 BHADMO CC(C)[N@H+](C)Cc1c(Cl)cccc1Cl ZINC000505881618 528835400 /nfs/dbraw/zinc/83/54/00/528835400.db2.gz OYMJJTFLXQHCPX-UHFFFAOYSA-N 1 1 232.154 3.834 20 0 BHADMO C[C@@H]1CCCC[N@H+]1Cc1cc2ccccc2o1 ZINC000505881901 534163857 /nfs/dbraw/zinc/16/38/57/534163857.db2.gz VQKQYGYJERKZEI-GFCCVEGCSA-N 1 1 229.323 3.807 20 0 BHADMO C[C@H]1CCCC[N@H+]1Cc1cc2ccccc2o1 ZINC000505881902 226360917 /nfs/dbraw/zinc/36/09/17/226360917.db2.gz VQKQYGYJERKZEI-LBPRGKRZSA-N 1 1 229.323 3.807 20 0 BHADMO CC(C)[N@@H+](C)Cc1ccc2c(c1)CCC(C)(C)O2 ZINC000505886281 528835207 /nfs/dbraw/zinc/83/52/07/528835207.db2.gz BPOHLVLYVNNNQU-UHFFFAOYSA-N 1 1 247.382 3.630 20 0 BHADMO CC(C)[N@@H+](C)Cc1ccc(-c2ccccc2)o1 ZINC000505886517 528835043 /nfs/dbraw/zinc/83/50/43/528835043.db2.gz GYWXQYCCAGAEJP-UHFFFAOYSA-N 1 1 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ZINC000506236197 529472001 /nfs/dbraw/zinc/47/20/01/529472001.db2.gz YILHLJXWXJSAGA-DZGCQCFKSA-N 1 1 249.423 3.618 20 0 BHADMO CC[C@H](C[N@@H+](C)[C@H]1CCSC1)c1ccccc1 ZINC000506236199 529333680 /nfs/dbraw/zinc/33/36/80/529333680.db2.gz YILHLJXWXJSAGA-HIFRSBDPSA-N 1 1 249.423 3.618 20 0 BHADMO CC[C@H](C[N@@H+](C)[C@@H]1CCSC1)c1ccccc1 ZINC000506236200 529333696 /nfs/dbraw/zinc/33/36/96/529333696.db2.gz YILHLJXWXJSAGA-UKRRQHHQSA-N 1 1 249.423 3.618 20 0 BHADMO CC[C@@H](C[N@@H+](C)[C@H]1CCSC1)c1ccccc1 ZINC000506236201 529471947 /nfs/dbraw/zinc/47/19/47/529471947.db2.gz YILHLJXWXJSAGA-ZFWWWQNUSA-N 1 1 249.423 3.618 20 0 BHADMO Cc1ccc(C[N@H+](C)C2CCCC2)cc1F ZINC000506257119 533869757 /nfs/dbraw/zinc/86/97/57/533869757.db2.gz AKMBGCGIAJODNO-UHFFFAOYSA-N 1 1 221.319 3.509 20 0 BHADMO C[N@@H+](Cc1cccc(Cl)c1F)C1CCCC1 ZINC000506259321 529994190 /nfs/dbraw/zinc/99/41/90/529994190.db2.gz PKVOLWRBOAMNAB-UHFFFAOYSA-N 1 1 241.737 3.854 20 0 BHADMO C[N@@H+](Cc1ccc(Cl)c(F)c1)C1CCCC1 ZINC000506260576 529984896 /nfs/dbraw/zinc/98/48/96/529984896.db2.gz XCKUMFVLMGIYDR-UHFFFAOYSA-N 1 1 241.737 3.854 20 0 BHADMO Cc1ccc(F)c(C[N@H+](C)C2CCCC2)c1 ZINC000506270835 226362868 /nfs/dbraw/zinc/36/28/68/226362868.db2.gz VERFJPOENNMJRV-UHFFFAOYSA-N 1 1 221.319 3.509 20 0 BHADMO C[N@@H+](Cc1ccc(F)c(Cl)c1)C1CCCC1 ZINC000506280969 529986817 /nfs/dbraw/zinc/98/68/17/529986817.db2.gz MANSAGLPXCHTNJ-UHFFFAOYSA-N 1 1 241.737 3.854 20 0 BHADMO C[N@@H+](Cc1cc2ccccc2o1)C1CCCC1 ZINC000506284118 529980916 /nfs/dbraw/zinc/98/09/16/529980916.db2.gz YOVNPQAFCFYAMK-UHFFFAOYSA-N 1 1 229.323 3.807 20 0 BHADMO Cc1cccc(C[N@H+](C)C2CCCC2)c1C ZINC000506294162 534701619 /nfs/dbraw/zinc/70/16/19/534701619.db2.gz ITYNNUABUBYQFG-UHFFFAOYSA-N 1 1 217.356 3.678 20 0 BHADMO Cc1cc(C[N@H+](C)C2CCCC2)ccc1F ZINC000506296577 534167251 /nfs/dbraw/zinc/16/72/51/534167251.db2.gz AQHKCVPSGAZHGT-UHFFFAOYSA-N 1 1 221.319 3.509 20 0 BHADMO C[N@@H+](C[C@H]1C[C@@H]1c1ccccc1)C1CCCC1 ZINC000506298445 529973025 /nfs/dbraw/zinc/97/30/25/529973025.db2.gz PGKNNSJYIHPSTM-GDBMZVCRSA-N 1 1 229.367 3.665 20 0 BHADMO C[N@@H+](C[C@@H]1C[C@@H]1c1ccccc1)C1CCCC1 ZINC000506298446 529957830 /nfs/dbraw/zinc/95/78/30/529957830.db2.gz PGKNNSJYIHPSTM-GOEBONIOSA-N 1 1 229.367 3.665 20 0 BHADMO C[N@@H+](C[C@H]1C[C@H]1c1ccccc1)C1CCCC1 ZINC000506298447 529972928 /nfs/dbraw/zinc/97/29/28/529972928.db2.gz PGKNNSJYIHPSTM-ZBFHGGJFSA-N 1 1 229.367 3.665 20 0 BHADMO Cc1cc(F)ccc1C[N@H+](C)C1CCCC1 ZINC000506309149 533876319 /nfs/dbraw/zinc/87/63/19/533876319.db2.gz JLLLZPKQGHGNCD-UHFFFAOYSA-N 1 1 221.319 3.509 20 0 BHADMO C/C(=C/c1ccccc1)C[N@H+](C)C1CCCC1 ZINC000506312115 527504437 /nfs/dbraw/zinc/50/44/37/527504437.db2.gz WYNNEHLQJDVFGL-OWBHPGMISA-N 1 1 229.367 3.964 20 0 BHADMO C/C(=C\c1ccccc1)C[N@H+](C)C1CCCC1 ZINC000506312116 527533286 /nfs/dbraw/zinc/53/32/86/527533286.db2.gz WYNNEHLQJDVFGL-WYMLVPIESA-N 1 1 229.367 3.964 20 0 BHADMO C[C@@H]1C[C@H]1c1ccc(C[N@@H+](C)C2CCCC2)o1 ZINC000506312364 534050369 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/nfs/dbraw/zinc/82/04/87/529820487.db2.gz YWISDYCNIHXKLT-PLNGDYQASA-N 1 1 233.330 3.713 20 0 BHADMO C[N@@H+](C/C=C/c1ccc(F)cc1)C1CCCC1 ZINC000506313838 529820171 /nfs/dbraw/zinc/82/01/71/529820171.db2.gz YWISDYCNIHXKLT-SNAWJCMRSA-N 1 1 233.330 3.713 20 0 BHADMO Clc1ccc(C2=CC[N@@H+](CC3CC3)CC2)cc1 ZINC000506328051 534638761 /nfs/dbraw/zinc/63/87/61/534638761.db2.gz SBPWBSUMWGWZKI-UHFFFAOYSA-N 1 1 247.769 3.839 20 0 BHADMO CC[N@@H+](Cc1cccn1CCC(C)C)C(C)C ZINC000506328375 528849746 /nfs/dbraw/zinc/84/97/46/528849746.db2.gz XLHOZAVUSVXXNN-UHFFFAOYSA-N 1 1 236.403 3.765 20 0 BHADMO CC[N@@H+](Cc1cc(C)c(OC)c(C)c1)C(C)C ZINC000506338634 528765257 /nfs/dbraw/zinc/76/52/57/528765257.db2.gz DBYHPWSMAPHLJM-UHFFFAOYSA-N 1 1 235.371 3.542 20 0 BHADMO CC[N@@H+](Cc1ccc2c(c1)CC(C)(C)O2)C(C)C ZINC000506339036 528795893 /nfs/dbraw/zinc/79/58/93/528795893.db2.gz FMCVHMJDFGHHLU-UHFFFAOYSA-N 1 1 247.382 3.630 20 0 BHADMO CC[N@@H+](Cc1ccc(F)c(Cl)c1)C(C)C ZINC000506340203 528786947 /nfs/dbraw/zinc/78/69/47/528786947.db2.gz GOQLJHPTCXKXDY-UHFFFAOYSA-N 1 1 229.726 3.709 20 0 BHADMO CC[N@@H+](C)Cc1ccc(-c2ccc(F)cc2C)o1 ZINC000506340444 527840760 /nfs/dbraw/zinc/84/07/60/527840760.db2.gz LWYQMIHUKMLTOV-UHFFFAOYSA-N 1 1 247.313 3.846 20 0 BHADMO Cc1ccc([C@@H]2CCC[N@H+]2CC2CC2)cc1 ZINC000506343284 226363397 /nfs/dbraw/zinc/36/33/97/226363397.db2.gz VLAOGKAULXMJRC-HNNXBMFYSA-N 1 1 215.340 3.542 20 0 BHADMO Cc1ccc([C@H]2CCC[N@H+]2CC2CC2)cc1 ZINC000506343297 226363307 /nfs/dbraw/zinc/36/33/07/226363307.db2.gz VLAOGKAULXMJRC-OAHLLOKOSA-N 1 1 215.340 3.542 20 0 BHADMO CC[N@@H+](Cc1cccc2c1OC(C)(C)C2)C(C)C ZINC000506343569 528815908 /nfs/dbraw/zinc/81/59/08/528815908.db2.gz ZYBPGCNPIFSYCK-UHFFFAOYSA-N 1 1 247.382 3.630 20 0 BHADMO CC[C@@H](C[N@@H+](CC)C(C)C)c1ccccc1 ZINC000506343728 529472259 /nfs/dbraw/zinc/47/22/59/529472259.db2.gz XLJDIHHUAAEBQU-AWEZNQCLSA-N 1 1 219.372 3.911 20 0 BHADMO CC[C@H](C[N@@H+](CC)C(C)C)c1ccccc1 ZINC000506343729 529334113 /nfs/dbraw/zinc/33/41/13/529334113.db2.gz XLJDIHHUAAEBQU-CQSZACIVSA-N 1 1 219.372 3.911 20 0 BHADMO CC[N@@H+](C)Cc1ccc(-c2ccccc2)s1 ZINC000506344016 527840472 /nfs/dbraw/zinc/84/04/72/527840472.db2.gz WRBUXXVYNICKHD-UHFFFAOYSA-N 1 1 231.364 3.867 20 0 BHADMO CC[N@@H+](Cc1cccc(C)c1C)C(C)C ZINC000506353712 528803152 /nfs/dbraw/zinc/80/31/52/528803152.db2.gz SNQKGYYBRCXBIS-UHFFFAOYSA-N 1 1 205.345 3.534 20 0 BHADMO CC[N@@H+](C[C@H]1C[C@H]1c1ccccc1)C(C)C ZINC000506354133 528756804 /nfs/dbraw/zinc/75/68/04/528756804.db2.gz AJSGXXBNSDVWQF-CABCVRRESA-N 1 1 217.356 3.520 20 0 BHADMO CC[N@@H+](C[C@H]1C[C@@H]1c1ccccc1)C(C)C ZINC000506354134 528756756 /nfs/dbraw/zinc/75/67/56/528756756.db2.gz AJSGXXBNSDVWQF-HUUCEWRRSA-N 1 1 217.356 3.520 20 0 BHADMO CC[N@@H+](C[C@@H]1C[C@@H]1c1ccccc1)C(C)C ZINC000506354135 528686054 /nfs/dbraw/zinc/68/60/54/528686054.db2.gz AJSGXXBNSDVWQF-LSDHHAIUSA-N 1 1 217.356 3.520 20 0 BHADMO CC[N@@H+](C)Cc1ccc(OCCC(C)C)cc1 ZINC000506355773 527841077 /nfs/dbraw/zinc/84/10/77/527841077.db2.gz JRGBFRFDWSOJNP-UHFFFAOYSA-N 1 1 235.371 3.563 20 0 BHADMO CC[N@@H+](C/C(C)=C\c1ccccc1)C(C)C ZINC000506357971 527870726 /nfs/dbraw/zinc/87/07/26/527870726.db2.gz VZWNDVRKMDEYHR-KAMYIIQDSA-N 1 1 217.356 3.820 20 0 BHADMO CC[N@@H+](C/C(C)=C/c1ccccc1)C(C)C ZINC000506357972 527870907 /nfs/dbraw/zinc/87/09/07/527870907.db2.gz VZWNDVRKMDEYHR-SDNWHVSQSA-N 1 1 217.356 3.820 20 0 BHADMO CC[N@@H+](Cc1ccc(C)c(C)c1)C(C)C ZINC000506368733 528777304 /nfs/dbraw/zinc/77/73/04/528777304.db2.gz JVDQUVPCULURNZ-UHFFFAOYSA-N 1 1 205.345 3.534 20 0 BHADMO CC[N@@H+](Cc1cc(Cl)ccc1F)C(C)C ZINC000506368775 528767115 /nfs/dbraw/zinc/76/71/15/528767115.db2.gz KEGMUEWOIYRLHH-UHFFFAOYSA-N 1 1 229.726 3.709 20 0 BHADMO CC[N@@H+](C)Cc1ccc(-c2ccc(C)cc2)o1 ZINC000506369339 527839725 /nfs/dbraw/zinc/83/97/25/527839725.db2.gz MHZIXVPMKVOISO-UHFFFAOYSA-N 1 1 229.323 3.707 20 0 BHADMO CC[N@@H+](Cc1ccccc1OCC1CC1)C(C)C ZINC000506369630 528842109 /nfs/dbraw/zinc/84/21/09/528842109.db2.gz NKHZUOHBCJJCFC-UHFFFAOYSA-N 1 1 247.382 3.706 20 0 BHADMO CCCOc1cccc(C[N@@H+](CC)C(C)C)c1 ZINC000506369756 528752410 /nfs/dbraw/zinc/75/24/10/528752410.db2.gz OKQBMIZQTHEFOI-UHFFFAOYSA-N 1 1 235.371 3.706 20 0 BHADMO CC[N@@H+](C)Cc1cc(-c2ccccc2)cs1 ZINC000506370607 527841417 /nfs/dbraw/zinc/84/14/17/527841417.db2.gz RDYXTOAKVODVLG-UHFFFAOYSA-N 1 1 231.364 3.867 20 0 BHADMO CC[N@@H+](C)Cc1ccc(-c2cccc(F)c2C)o1 ZINC000506370931 527839564 /nfs/dbraw/zinc/83/95/64/527839564.db2.gz QZEWUXBBWFZNOF-UHFFFAOYSA-N 1 1 247.313 3.846 20 0 BHADMO CC[N@@H+](Cc1cccc(Cl)c1F)C(C)C ZINC000506378654 528805661 /nfs/dbraw/zinc/80/56/61/528805661.db2.gz DAQYERGROKPIOW-UHFFFAOYSA-N 1 1 229.726 3.709 20 0 BHADMO CCc1ccc(C[N@@H+](C)CCc2ccccc2)o1 ZINC000506382627 529635017 /nfs/dbraw/zinc/63/50/17/529635017.db2.gz RONXOFIAWGQMON-UHFFFAOYSA-N 1 1 243.350 3.517 20 0 BHADMO C[N@@H+](CCc1ccccc1)C[C@H]1CC=CCC1 ZINC000506383547 529934371 /nfs/dbraw/zinc/93/43/71/529934371.db2.gz GKONJPZGLHZVHG-INIZCTEOSA-N 1 1 229.367 3.517 20 0 BHADMO C[N@@H+](CCc1ccccc1)C[C@@H]1CC=CCC1 ZINC000506383548 529934506 /nfs/dbraw/zinc/93/45/06/529934506.db2.gz GKONJPZGLHZVHG-MRXNPFEDSA-N 1 1 229.367 3.517 20 0 BHADMO C[N@@H+](CCc1ccccc1)Cc1ccc(Cl)o1 ZINC000506383604 529934554 /nfs/dbraw/zinc/93/45/54/529934554.db2.gz UOTDHHPUIQCKBG-UHFFFAOYSA-N 1 1 249.741 3.608 20 0 BHADMO Cc1ccc(C[N@H+](Cc2ccco2)C(C)C)cc1 ZINC000506396331 533907605 /nfs/dbraw/zinc/90/76/05/533907605.db2.gz KRTJAYUNAVFIKM-UHFFFAOYSA-N 1 1 243.350 3.999 20 0 BHADMO CC[N@@H+](Cc1ccc(Cl)c(F)c1)C(C)C ZINC000506398594 528780485 /nfs/dbraw/zinc/78/04/85/528780485.db2.gz XXOPDCJDCSTKGN-UHFFFAOYSA-N 1 1 229.726 3.709 20 0 BHADMO CCC[N@@H+](C)Cc1cc(Cl)ccc1Cl ZINC000506404650 527851245 /nfs/dbraw/zinc/85/12/45/527851245.db2.gz RBEANTWEJIPVIH-UHFFFAOYSA-N 1 1 232.154 3.835 20 0 BHADMO CC[N@@H+](CC(C)C)[C@@H](C)Cc1ccc(OC)cc1 ZINC000506405480 527963862 /nfs/dbraw/zinc/96/38/62/527963862.db2.gz TVOVBRIQYGIKCS-AWEZNQCLSA-N 1 1 249.398 3.604 20 0 BHADMO CC[N@@H+](CC(C)C)[C@H](C)Cc1ccc(OC)cc1 ZINC000506405482 527963751 /nfs/dbraw/zinc/96/37/51/527963751.db2.gz TVOVBRIQYGIKCS-CQSZACIVSA-N 1 1 249.398 3.604 20 0 BHADMO CCCOc1cccc(C[N@@H+](C)CC(C)C)c1 ZINC000506415443 528751949 /nfs/dbraw/zinc/75/19/49/528751949.db2.gz JGCVNPQYHRQWOX-UHFFFAOYSA-N 1 1 235.371 3.563 20 0 BHADMO CCC[N@@H+](C)Cc1ccc(-c2ccccc2F)o1 ZINC000506415689 527853601 /nfs/dbraw/zinc/85/36/01/527853601.db2.gz KRPSWGGFBTYUGW-UHFFFAOYSA-N 1 1 247.313 3.928 20 0 BHADMO CC(C)C[N@@H+](C)Cc1cc(Cl)ccc1F ZINC000506416277 527914673 /nfs/dbraw/zinc/91/46/73/527914673.db2.gz MNUANYOQNQCAEL-UHFFFAOYSA-N 1 1 229.726 3.567 20 0 BHADMO CCC[N@@H+](C)Cc1cc(C(F)(F)F)ccc1F ZINC000506417233 527852080 /nfs/dbraw/zinc/85/20/80/527852080.db2.gz QEDIYWULKZJZCB-UHFFFAOYSA-N 1 1 249.251 3.686 20 0 BHADMO CCC[N@@H+](C)Cc1cc(F)cc(C(F)(F)F)c1 ZINC000506417958 527850553 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/nfs/dbraw/zinc/85/31/69/527853169.db2.gz WIUSTXBKVWBFSP-UHFFFAOYSA-N 1 1 243.350 3.690 20 0 BHADMO CCC[N@@H+](C)Cc1ccc(F)cc1C(F)(F)F ZINC000506459754 527854098 /nfs/dbraw/zinc/85/40/98/527854098.db2.gz NVWBXJOYWRWTCR-UHFFFAOYSA-N 1 1 249.251 3.686 20 0 BHADMO CCC[N@@H+](C)Cc1c(OC)ccc2ccccc21 ZINC000506459981 527851615 /nfs/dbraw/zinc/85/16/15/527851615.db2.gz QDMKXNCJNAEWEU-UHFFFAOYSA-N 1 1 243.350 3.690 20 0 BHADMO CCC[N@@H+](C)Cc1cccc(OC2CCCC2)c1 ZINC000506460258 527854244 /nfs/dbraw/zinc/85/42/44/527854244.db2.gz NBRWHLWAKQIOBT-UHFFFAOYSA-N 1 1 247.382 3.850 20 0 BHADMO CCC[N@@H+](C)Cc1ccccc1OC1CCCC1 ZINC000506460483 527853986 /nfs/dbraw/zinc/85/39/86/527853986.db2.gz USJHXRXYQALERH-UHFFFAOYSA-N 1 1 247.382 3.850 20 0 BHADMO CC(C)C[N@@H+](C)Cc1ccc(F)c(Cl)c1 ZINC000506464253 527914817 /nfs/dbraw/zinc/91/48/17/527914817.db2.gz AKNXPXQMIAKMBC-UHFFFAOYSA-N 1 1 229.726 3.567 20 0 BHADMO CC[C@@H](C[N@@H+](C)CC(C)C)c1ccccc1 ZINC000506464513 529471495 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SLDMUZLNNPAWPG-PLNGDYQASA-N 1 1 223.747 3.695 20 0 BHADMO CCC[N@@H+](C)C/C=C/c1ccc(Cl)cc1 ZINC000506467544 527813044 /nfs/dbraw/zinc/81/30/44/527813044.db2.gz SLDMUZLNNPAWPG-SNAWJCMRSA-N 1 1 223.747 3.695 20 0 BHADMO CC(C)CC[N@@H+](CCc1cccc(F)c1)C1CC1 ZINC000506471721 527720273 /nfs/dbraw/zinc/72/02/73/527720273.db2.gz RKENZHXDPCEBKF-UHFFFAOYSA-N 1 1 249.373 3.879 20 0 BHADMO CCCC[N@@H+](CCc1cccc(F)c1)C1CC1 ZINC000506472200 528439610 /nfs/dbraw/zinc/43/96/10/528439610.db2.gz SWCHJKYVJCSYFJ-UHFFFAOYSA-N 1 1 235.346 3.633 20 0 BHADMO CCC[N@@H+](C)Cc1ccc(OCC(C)C)cc1 ZINC000506479619 527853584 /nfs/dbraw/zinc/85/35/84/527853584.db2.gz GATDWUZKXAOLEP-UHFFFAOYSA-N 1 1 235.371 3.563 20 0 BHADMO CCC[N@@H+](C)Cc1ccc(F)c(C(F)(F)F)c1 ZINC000506494830 527853085 /nfs/dbraw/zinc/85/30/85/527853085.db2.gz ILNLCYXSKGZXAF-UHFFFAOYSA-N 1 1 249.251 3.686 20 0 BHADMO CCC[N@@H+](C)Cc1c(Cl)oc2ccccc21 ZINC000506495051 527851006 /nfs/dbraw/zinc/85/10/06/527851006.db2.gz IPQRAOXMUTZBCV-UHFFFAOYSA-N 1 1 237.730 3.928 20 0 BHADMO Cc1cc(C[N@H+](C)CC(C)C)c2ccccc2n1 ZINC000506496403 226364072 /nfs/dbraw/zinc/36/40/72/226364072.db2.gz QAMCLGZDHJHVSR-UHFFFAOYSA-N 1 1 242.366 3.631 20 0 BHADMO C/C(=C\c1ccccc1)C[N@H+](C)CC(C)C ZINC000506500860 527533450 /nfs/dbraw/zinc/53/34/50/527533450.db2.gz XVFNGSCMCVXBQJ-GXDHUFHOSA-N 1 1 217.356 3.678 20 0 BHADMO C/C(=C/c1ccccc1)C[N@H+](C)CC(C)C ZINC000506500861 527505326 /nfs/dbraw/zinc/50/53/26/527505326.db2.gz XVFNGSCMCVXBQJ-UVTDQMKNSA-N 1 1 217.356 3.678 20 0 BHADMO CC(C)C[N@@H+]([C@H](C)c1ccccc1)C1CC1 ZINC000506537013 527955161 /nfs/dbraw/zinc/95/51/61/527955161.db2.gz GBXYFQPTWRHQEX-CYBMUJFWSA-N 1 1 217.356 3.868 20 0 BHADMO CC(C)C[N@@H+]([C@@H](C)c1ccccc1)C1CC1 ZINC000506537014 527955293 /nfs/dbraw/zinc/95/52/93/527955293.db2.gz GBXYFQPTWRHQEX-ZDUSSCGKSA-N 1 1 217.356 3.868 20 0 BHADMO C[C@H](c1ccccc1)[N@@H+](CC1CC1)C1CC1 ZINC000506545061 226363929 /nfs/dbraw/zinc/36/39/29/226363929.db2.gz IFELCAIRVFDTBZ-GFCCVEGCSA-N 1 1 215.340 3.622 20 0 BHADMO C[C@@H](c1ccccc1)[N@@H+](CC1CC1)C1CC1 ZINC000506545062 534101535 /nfs/dbraw/zinc/10/15/35/534101535.db2.gz IFELCAIRVFDTBZ-LBPRGKRZSA-N 1 1 215.340 3.622 20 0 BHADMO CC(C)CC[N@@H+](Cc1ccc(Cl)o1)C1CC1 ZINC000506583071 538753121 /nfs/dbraw/zinc/75/31/21/538753121.db2.gz FBFJGWYDZQQFCH-UHFFFAOYSA-N 1 1 241.762 3.944 20 0 BHADMO C[N@@H+](CC(C)(C)C)[C@H]1CCc2ccccc21 ZINC000506675735 529844250 /nfs/dbraw/zinc/84/42/50/529844250.db2.gz QHSTWOFGEDOOJB-AWEZNQCLSA-N 1 1 217.356 3.652 20 0 BHADMO C[N@@H+](CC(C)(C)C)[C@@H]1CCc2ccccc21 ZINC000506675737 529844233 /nfs/dbraw/zinc/84/42/33/529844233.db2.gz QHSTWOFGEDOOJB-CQSZACIVSA-N 1 1 217.356 3.652 20 0 BHADMO CCOc1ccc([C@@H]2CCC[N@H+]2CC2CC2)cc1 ZINC000506718177 528601023 /nfs/dbraw/zinc/60/10/23/528601023.db2.gz GYJFDRIJUSSSLF-INIZCTEOSA-N 1 1 245.366 3.632 20 0 BHADMO CCOc1ccc([C@H]2CCC[N@H+]2CC2CC2)cc1 ZINC000506718178 528609418 /nfs/dbraw/zinc/60/94/18/528609418.db2.gz GYJFDRIJUSSSLF-MRXNPFEDSA-N 1 1 245.366 3.632 20 0 BHADMO C[N@H+](Cc1ccc(F)cc1)C[C@@H]1CC=CCC1 ZINC000506754089 529987871 /nfs/dbraw/zinc/98/78/71/529987871.db2.gz WCDKJGIEHJRCMA-CYBMUJFWSA-N 1 1 233.330 3.614 20 0 BHADMO C[N@H+](Cc1ccc(F)cc1)C[C@H]1CC=CCC1 ZINC000506754090 529987956 /nfs/dbraw/zinc/98/79/56/529987956.db2.gz WCDKJGIEHJRCMA-ZDUSSCGKSA-N 1 1 233.330 3.614 20 0 BHADMO C[N@H+](Cc1cccc(Cl)c1Cl)CC1CC1 ZINC000506761512 529994306 /nfs/dbraw/zinc/99/43/06/529994306.db2.gz YRINMIROSHNXIY-UHFFFAOYSA-N 1 1 244.165 3.835 20 0 BHADMO CCC(CC)C[N@H+]1CCC[C@@H](C(F)(F)F)C1 ZINC000506768164 528752173 /nfs/dbraw/zinc/75/21/73/528752173.db2.gz SBHRAWINEDCGJQ-LLVKDONJSA-N 1 1 237.309 3.697 20 0 BHADMO CCC(CC)C[N@H+]1CCC[C@H](C(F)(F)F)C1 ZINC000506768167 528753125 /nfs/dbraw/zinc/75/31/25/528753125.db2.gz SBHRAWINEDCGJQ-NSHDSACASA-N 1 1 237.309 3.697 20 0 BHADMO Cc1cc(N(C)CCC2CCCCC2)nc(C)[nH+]1 ZINC000506770128 226364413 /nfs/dbraw/zinc/36/44/13/226364413.db2.gz JCIIEMXWTUGUCK-UHFFFAOYSA-N 1 1 247.386 3.500 20 0 BHADMO COCc1ccccc1/C=C(\C)C[N@@H+](C)C(C)C ZINC000506875847 533253857 /nfs/dbraw/zinc/25/38/57/533253857.db2.gz OQUPGTKNYBXGTI-GXDHUFHOSA-N 1 1 247.382 3.577 20 0 BHADMO COCc1ccccc1/C=C(/C)C[N@@H+](C)C(C)C ZINC000506875848 226364502 /nfs/dbraw/zinc/36/45/02/226364502.db2.gz OQUPGTKNYBXGTI-UVTDQMKNSA-N 1 1 247.382 3.577 20 0 BHADMO CC(C)[N@@H+](C)Cc1ccc(C2CCC2)cc1 ZINC000506876260 528833963 /nfs/dbraw/zinc/83/39/63/528833963.db2.gz RDNDBFXMJRYPKR-UHFFFAOYSA-N 1 1 217.356 3.794 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)CC1=Cc2ccccc2OC1 ZINC000506994449 528886648 /nfs/dbraw/zinc/88/66/48/528886648.db2.gz IPJRZBWKBAPZJX-CYBMUJFWSA-N 1 1 245.366 3.583 20 0 BHADMO CCC[C@H](C)[N@@H+](C)CC1=Cc2ccccc2OC1 ZINC000506994450 528046341 /nfs/dbraw/zinc/04/63/41/528046341.db2.gz IPJRZBWKBAPZJX-ZDUSSCGKSA-N 1 1 245.366 3.583 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)C/C=C/c1ccccc1OC ZINC000506994463 528886724 /nfs/dbraw/zinc/88/67/24/528886724.db2.gz ITMVHYDGFTUGFP-BMGYJQCNSA-N 1 1 247.382 3.829 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)C/C=C\c1ccccc1OC ZINC000506994464 528886588 /nfs/dbraw/zinc/88/65/88/528886588.db2.gz ITMVHYDGFTUGFP-KOTGUFOOSA-N 1 1 247.382 3.829 20 0 BHADMO CCC[C@H](C)[N@@H+](C)C/C=C\c1ccccc1OC ZINC000506994465 528045558 /nfs/dbraw/zinc/04/55/58/528045558.db2.gz ITMVHYDGFTUGFP-MSKHEQNASA-N 1 1 247.382 3.829 20 0 BHADMO CCC[C@H](C)[N@@H+](C)C/C=C/c1ccccc1OC ZINC000506994466 528045450 /nfs/dbraw/zinc/04/54/50/528045450.db2.gz ITMVHYDGFTUGFP-ZHZWZMEUSA-N 1 1 247.382 3.829 20 0 BHADMO CC[N@@H+](Cc1ccc(OC)cc1)CC(C)(C)C ZINC000506995097 528793422 /nfs/dbraw/zinc/79/34/22/528793422.db2.gz POSFECPPFZUUTP-UHFFFAOYSA-N 1 1 235.371 3.563 20 0 BHADMO CCC[C@H](C)[N@@H+](C)C[C@@H]1C[C@@H]1c1ccccc1 ZINC000506995415 528047195 /nfs/dbraw/zinc/04/71/95/528047195.db2.gz SCMSKFZEEVBNAE-CWRNSKLLSA-N 1 1 231.383 3.911 20 0 BHADMO CCC[C@H](C)[N@@H+](C)C[C@H]1C[C@H]1c1ccccc1 ZINC000506995416 528047923 /nfs/dbraw/zinc/04/79/23/528047923.db2.gz SCMSKFZEEVBNAE-IMJJTQAJSA-N 1 1 231.383 3.911 20 0 BHADMO CCC[C@H](C)[N@@H+](C)C[C@H]1C[C@@H]1c1ccccc1 ZINC000506995417 528047075 /nfs/dbraw/zinc/04/70/75/528047075.db2.gz SCMSKFZEEVBNAE-NUEKZKHPSA-N 1 1 231.383 3.911 20 0 BHADMO CCC[C@H](C)[N@@H+](C)C/C=C/c1ccc(F)cc1 ZINC000507003674 528045526 /nfs/dbraw/zinc/04/55/26/528045526.db2.gz XPTINHAZFZHEAU-IYNGYCSASA-N 1 1 235.346 3.959 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)C/C=C\c1ccc(F)cc1 ZINC000507003676 528887267 /nfs/dbraw/zinc/88/72/67/528887267.db2.gz XPTINHAZFZHEAU-SCXUMTSISA-N 1 1 235.346 3.959 20 0 BHADMO CCC[C@H](C)[N@@H+](C)C/C=C\c1ccc(F)cc1 ZINC000507003677 528046442 /nfs/dbraw/zinc/04/64/42/528046442.db2.gz XPTINHAZFZHEAU-VGVVRCBHSA-N 1 1 235.346 3.959 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)C/C=C/c1ccc(F)cc1 ZINC000507003679 528887055 /nfs/dbraw/zinc/88/70/55/528887055.db2.gz XPTINHAZFZHEAU-VUDGCMKMSA-N 1 1 235.346 3.959 20 0 BHADMO CCC[C@H](C)[N@@H+](C)Cc1cc(C)sc1C ZINC000507006778 528047677 /nfs/dbraw/zinc/04/76/77/528047677.db2.gz JXIJHXIKODFJRD-JTQLQIEISA-N 1 1 225.401 3.985 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)Cc1cc(C)sc1C ZINC000507006781 528887202 /nfs/dbraw/zinc/88/72/02/528887202.db2.gz JXIJHXIKODFJRD-SNVBAGLBSA-N 1 1 225.401 3.985 20 0 BHADMO COc1ccc(C[N@@H+](CC(C)C)C(C)C)cc1 ZINC000507008472 533548785 /nfs/dbraw/zinc/54/87/85/533548785.db2.gz UDTDAPBDMWGMEZ-UHFFFAOYSA-N 1 1 235.371 3.562 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)Cc1cc(F)c(F)cc1F ZINC000507009750 528886672 /nfs/dbraw/zinc/88/66/72/528886672.db2.gz YBMSLMSYPSAKKO-SECBINFHSA-N 1 1 245.288 3.724 20 0 BHADMO CCC[C@H](C)[N@@H+](C)Cc1cc(F)c(F)cc1F ZINC000507009756 528047536 /nfs/dbraw/zinc/04/75/36/528047536.db2.gz YBMSLMSYPSAKKO-VIFPVBQESA-N 1 1 245.288 3.724 20 0 BHADMO c1coc(C[N@H+](CC2CC2)C2CCCCC2)c1 ZINC000507012958 226364733 /nfs/dbraw/zinc/36/47/33/226364733.db2.gz NRFHRAQYUAIFMS-UHFFFAOYSA-N 1 1 233.355 3.824 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)Cc1ccc(Cl)o1 ZINC000507019123 528888599 /nfs/dbraw/zinc/88/85/99/528888599.db2.gz DVFINROYFBJORF-SECBINFHSA-N 1 1 215.724 3.553 20 0 BHADMO CCC[C@H](C)[N@@H+](C)Cc1ccc(Cl)o1 ZINC000507019125 528046816 /nfs/dbraw/zinc/04/68/16/528046816.db2.gz DVFINROYFBJORF-VIFPVBQESA-N 1 1 215.724 3.553 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)Cc1cccc(OCC)c1 ZINC000507023248 528888918 /nfs/dbraw/zinc/88/89/18/528888918.db2.gz XDNPRBBRWGJDEV-CYBMUJFWSA-N 1 1 235.371 3.706 20 0 BHADMO CCC[C@H](C)[N@@H+](C)Cc1cccc(OCC)c1 ZINC000507023250 528047716 /nfs/dbraw/zinc/04/77/16/528047716.db2.gz XDNPRBBRWGJDEV-ZDUSSCGKSA-N 1 1 235.371 3.706 20 0 BHADMO Cc1sccc1C[N@H+]1CCc2sccc2C1 ZINC000507078299 226364979 /nfs/dbraw/zinc/36/49/79/226364979.db2.gz PSAJPRJAIYJKSY-UHFFFAOYSA-N 1 1 249.404 3.676 20 0 BHADMO CC[N@@H+](Cc1ccc(C)o1)Cc1ccccc1C ZINC000507109196 528777513 /nfs/dbraw/zinc/77/75/13/528777513.db2.gz BUTKPGJFTGYJLG-UHFFFAOYSA-N 1 1 243.350 3.919 20 0 BHADMO COc1ccc(C)cc1C[N@H+]1CCC[C@H]1C(C)C ZINC000507110456 533385908 /nfs/dbraw/zinc/38/59/08/533385908.db2.gz KJCHMFKXPDBSDW-HNNXBMFYSA-N 1 1 247.382 3.624 20 0 BHADMO CC(C)C[N@@H+](Cc1ccc(F)cc1)C(C)C 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ZINC000507134780 226365800 /nfs/dbraw/zinc/36/58/00/226365800.db2.gz OBLUSTBSAAPXSY-INIZCTEOSA-N 1 1 246.398 3.570 20 0 BHADMO Cn1cccc1C[N@H+]1CCC[C@@H]1C1CCCCC1 ZINC000507134781 226365854 /nfs/dbraw/zinc/36/58/54/226365854.db2.gz OBLUSTBSAAPXSY-MRXNPFEDSA-N 1 1 246.398 3.570 20 0 BHADMO CC(C)C[C@H]1CCC[N@H+]1Cc1ccc(Cl)o1 ZINC000507135946 528590790 /nfs/dbraw/zinc/59/07/90/528590790.db2.gz VQUKGUOQSPFIBL-LLVKDONJSA-N 1 1 241.762 3.944 20 0 BHADMO CC(C)C[C@@H]1CCC[N@H+]1Cc1ccc(Cl)o1 ZINC000507135947 528380437 /nfs/dbraw/zinc/38/04/37/528380437.db2.gz VQUKGUOQSPFIBL-NSHDSACASA-N 1 1 241.762 3.944 20 0 BHADMO CC[C@@H](C)[N@@H+](C)Cc1ccc(OC(C)C)cc1 ZINC000507139595 529344611 /nfs/dbraw/zinc/34/46/11/529344611.db2.gz CJUMIIZQMJCXQV-CYBMUJFWSA-N 1 1 235.371 3.704 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1ccc(OC(C)C)cc1 ZINC000507139596 529691547 /nfs/dbraw/zinc/69/15/47/529691547.db2.gz CJUMIIZQMJCXQV-ZDUSSCGKSA-N 1 1 235.371 3.704 20 0 BHADMO CC[N@@H+](Cc1occc1C)Cc1ccccc1F ZINC000507139911 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/nfs/dbraw/zinc/91/77/27/528917727.db2.gz QSZMGZUPXDJFLR-UHFFFAOYSA-N 1 1 243.350 3.919 20 0 BHADMO CCCOc1cccc(C[N@@H+](C)[C@H](C)CC)c1 ZINC000507145123 528751907 /nfs/dbraw/zinc/75/19/07/528751907.db2.gz SHCWXKVYFDOGBD-CYBMUJFWSA-N 1 1 235.371 3.706 20 0 BHADMO CCCOc1cccc(C[N@@H+](C)[C@@H](C)CC)c1 ZINC000507145124 528752046 /nfs/dbraw/zinc/75/20/46/528752046.db2.gz SHCWXKVYFDOGBD-ZDUSSCGKSA-N 1 1 235.371 3.706 20 0 BHADMO CC[N@H+](Cc1cccc2cc[nH]c21)CC(C)C ZINC000507145600 528815757 /nfs/dbraw/zinc/81/57/57/528815757.db2.gz UAKSDMDYKFRORX-UHFFFAOYSA-N 1 1 230.355 3.646 20 0 BHADMO CC(C)[C@@H]1CCC[N@H+]1Cc1c(F)cccc1F ZINC000507147162 528673812 /nfs/dbraw/zinc/67/38/12/528673812.db2.gz XIUQQJWBTPZKOE-AWEZNQCLSA-N 1 1 239.309 3.585 20 0 BHADMO CC(C)[C@H]1CCC[N@H+]1Cc1c(F)cccc1F ZINC000507147163 527783982 /nfs/dbraw/zinc/78/39/82/527783982.db2.gz XIUQQJWBTPZKOE-CQSZACIVSA-N 1 1 239.309 3.585 20 0 BHADMO Cc1cccc([C@@H]2CCC[N@H+]2CC2CC2)c1 ZINC000507151494 226366315 /nfs/dbraw/zinc/36/63/15/226366315.db2.gz GSJCWLZTSBOAAR-HNNXBMFYSA-N 1 1 215.340 3.542 20 0 BHADMO Cc1cccc([C@H]2CCC[N@H+]2CC2CC2)c1 ZINC000507151495 534765431 /nfs/dbraw/zinc/76/54/31/534765431.db2.gz GSJCWLZTSBOAAR-OAHLLOKOSA-N 1 1 215.340 3.542 20 0 BHADMO Cc1ccoc1C[N@@H+](C)CCCc1ccccc1 ZINC000507153177 226366416 /nfs/dbraw/zinc/36/64/16/226366416.db2.gz AIZOCNAZTYTMMA-UHFFFAOYSA-N 1 1 243.350 3.653 20 0 BHADMO C[C@H](c1cccc(F)c1)[N@@H+](C)Cc1ccoc1 ZINC000507153185 534127227 /nfs/dbraw/zinc/12/72/27/534127227.db2.gz ALIBTUQGAOQULN-LLVKDONJSA-N 1 1 233.286 3.612 20 0 BHADMO C[C@@H](c1cccc(F)c1)[N@@H+](C)Cc1ccoc1 ZINC000507153186 534090180 /nfs/dbraw/zinc/09/01/80/534090180.db2.gz ALIBTUQGAOQULN-NSHDSACASA-N 1 1 233.286 3.612 20 0 BHADMO Cc1ccoc1C[N@@H+]1CCC[C@@H]1CC(C)C ZINC000507153516 226366336 /nfs/dbraw/zinc/36/63/36/226366336.db2.gz CIVHMKWLQQWZMQ-CYBMUJFWSA-N 1 1 221.344 3.599 20 0 BHADMO Cc1ccoc1C[N@@H+]1CCC[C@H]1CC(C)C ZINC000507153517 226366287 /nfs/dbraw/zinc/36/62/87/226366287.db2.gz CIVHMKWLQQWZMQ-ZDUSSCGKSA-N 1 1 221.344 3.599 20 0 BHADMO Cc1ccoc1C[N@H+](C)[C@H](C)c1cccc(F)c1 ZINC000507153728 226366218 /nfs/dbraw/zinc/36/62/18/226366218.db2.gz DYCIKJPOMDRFIE-GFCCVEGCSA-N 1 1 247.313 3.920 20 0 BHADMO Cc1ccoc1C[N@H+](C)[C@@H](C)c1cccc(F)c1 ZINC000507153729 226366333 /nfs/dbraw/zinc/36/63/33/226366333.db2.gz DYCIKJPOMDRFIE-LBPRGKRZSA-N 1 1 247.313 3.920 20 0 BHADMO CC(C)C[N@@H+](Cc1ccccc1F)C(C)C ZINC000507158055 527948553 /nfs/dbraw/zinc/94/85/53/527948553.db2.gz YVPLEIGOCPRWPD-UHFFFAOYSA-N 1 1 223.335 3.692 20 0 BHADMO Cc1ccccc1[C@@H]1CCC[N@H+]1CC1CC1 ZINC000507158130 226366310 /nfs/dbraw/zinc/36/63/10/226366310.db2.gz ZNDMEPMCTJXGSI-HNNXBMFYSA-N 1 1 215.340 3.542 20 0 BHADMO Cc1ccccc1[C@H]1CCC[N@H+]1CC1CC1 ZINC000507158132 226366144 /nfs/dbraw/zinc/36/61/44/226366144.db2.gz ZNDMEPMCTJXGSI-OAHLLOKOSA-N 1 1 215.340 3.542 20 0 BHADMO CC[C@@H](C)[N@@H+](C)Cc1cccc(C)c1C ZINC000507158342 529345185 /nfs/dbraw/zinc/34/51/85/529345185.db2.gz CSJZAPBKPUSXLJ-GFCCVEGCSA-N 1 1 205.345 3.534 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1cccc(C)c1C ZINC000507158343 529691487 /nfs/dbraw/zinc/69/14/87/529691487.db2.gz CSJZAPBKPUSXLJ-LBPRGKRZSA-N 1 1 205.345 3.534 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1cccn1CCC(C)C ZINC000507158769 529690949 /nfs/dbraw/zinc/69/09/49/529690949.db2.gz FMTNFKQEYQKNIS-AWEZNQCLSA-N 1 1 236.403 3.765 20 0 BHADMO CC[C@@H](C)[N@@H+](C)Cc1cccn1CCC(C)C ZINC000507158770 529345199 /nfs/dbraw/zinc/34/51/99/529345199.db2.gz FMTNFKQEYQKNIS-CQSZACIVSA-N 1 1 236.403 3.765 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1ccc(OC)cc1Cl ZINC000507159072 529691391 /nfs/dbraw/zinc/69/13/91/529691391.db2.gz GYDUBTYOPPBQQH-JTQLQIEISA-N 1 1 241.762 3.579 20 0 BHADMO CC[C@@H](C)[N@@H+](C)Cc1ccc(OC)cc1Cl ZINC000507159073 529345238 /nfs/dbraw/zinc/34/52/38/529345238.db2.gz GYDUBTYOPPBQQH-SNVBAGLBSA-N 1 1 241.762 3.579 20 0 BHADMO CC[C@@H](C)[N@@H+](C)Cc1cccc(Cl)c1F ZINC000507159857 529344712 /nfs/dbraw/zinc/34/47/12/529344712.db2.gz JHULRJSQNSCRLJ-SECBINFHSA-N 1 1 229.726 3.709 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1cccc(Cl)c1F ZINC000507159858 529691387 /nfs/dbraw/zinc/69/13/87/529691387.db2.gz JHULRJSQNSCRLJ-VIFPVBQESA-N 1 1 229.726 3.709 20 0 BHADMO COc1ccc2c(c1)CCC[C@@H]2[N@@H+](C)CC(C)C ZINC000507160270 226366283 /nfs/dbraw/zinc/36/62/83/226366283.db2.gz KQVFKYRETJUVAG-INIZCTEOSA-N 1 1 247.382 3.660 20 0 BHADMO COc1ccc2c(c1)CCC[C@H]2[N@@H+](C)CC(C)C ZINC000507160271 533253171 /nfs/dbraw/zinc/25/31/71/533253171.db2.gz KQVFKYRETJUVAG-MRXNPFEDSA-N 1 1 247.382 3.660 20 0 BHADMO CC[C@@H](C)[N@@H+](C)Cc1cccc2c1OC(C)(C)C2 ZINC000507161405 529345037 /nfs/dbraw/zinc/34/50/37/529345037.db2.gz QIKUJFONZDLRAQ-GFCCVEGCSA-N 1 1 247.382 3.630 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1cccc2c1OC(C)(C)C2 ZINC000507161407 529691535 /nfs/dbraw/zinc/69/15/35/529691535.db2.gz QIKUJFONZDLRAQ-LBPRGKRZSA-N 1 1 247.382 3.630 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1cnc(C2CCC2)s1 ZINC000507162062 529691176 /nfs/dbraw/zinc/69/11/76/529691176.db2.gz UCEKMCRHVMWFTH-JTQLQIEISA-N 1 1 238.400 3.641 20 0 BHADMO CC[C@@H](C)[N@@H+](C)Cc1cnc(C2CCC2)s1 ZINC000507162063 529345172 /nfs/dbraw/zinc/34/51/72/529345172.db2.gz UCEKMCRHVMWFTH-SNVBAGLBSA-N 1 1 238.400 3.641 20 0 BHADMO CC[N@H+](Cc1cc(F)c(F)cc1F)CC(C)C ZINC000507162117 528766215 /nfs/dbraw/zinc/76/62/15/528766215.db2.gz UUMSVLOUMCVTTD-UHFFFAOYSA-N 1 1 245.288 3.582 20 0 BHADMO CC[C@@H](C)[N@@H+](C)Cc1ccc2c(c1)CC(C)(C)O2 ZINC000507162571 529345054 /nfs/dbraw/zinc/34/50/54/529345054.db2.gz VKACMDGFDJHPRG-GFCCVEGCSA-N 1 1 247.382 3.630 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1ccc2c(c1)CC(C)(C)O2 ZINC000507162572 529691332 /nfs/dbraw/zinc/69/13/32/529691332.db2.gz VKACMDGFDJHPRG-LBPRGKRZSA-N 1 1 247.382 3.630 20 0 BHADMO C[C@H](c1ccc(Cl)cc1)[N@H+]1CC[C@@H](C)C1 ZINC000507163496 226366508 /nfs/dbraw/zinc/36/65/08/226366508.db2.gz GQNXQDJBIXAANI-GHMZBOCLSA-N 1 1 223.747 3.743 20 0 BHADMO C[C@@H](c1ccc(Cl)cc1)[N@H+]1CC[C@@H](C)C1 ZINC000507163497 226366098 /nfs/dbraw/zinc/36/60/98/226366098.db2.gz GQNXQDJBIXAANI-MNOVXSKESA-N 1 1 223.747 3.743 20 0 BHADMO C[C@@H](c1ccc(Cl)cc1)[N@H+]1CC[C@H](C)C1 ZINC000507163498 226366503 /nfs/dbraw/zinc/36/65/03/226366503.db2.gz GQNXQDJBIXAANI-QWRGUYRKSA-N 1 1 223.747 3.743 20 0 BHADMO C[C@H](c1ccc(Cl)cc1)[N@H+]1CC[C@H](C)C1 ZINC000507163499 226366095 /nfs/dbraw/zinc/36/60/95/226366095.db2.gz GQNXQDJBIXAANI-WDEREUQCSA-N 1 1 223.747 3.743 20 0 BHADMO C[C@@H]1CC[N@@H+](Cc2ccc(Cl)cc2Cl)C1 ZINC000507163932 534038284 /nfs/dbraw/zinc/03/82/84/534038284.db2.gz HVQBMXQSEUNEQF-SECBINFHSA-N 1 1 244.165 3.835 20 0 BHADMO C[C@H]1CC[N@@H+](Cc2ccc(Cl)cc2Cl)C1 ZINC000507163933 226366435 /nfs/dbraw/zinc/36/64/35/226366435.db2.gz HVQBMXQSEUNEQF-VIFPVBQESA-N 1 1 244.165 3.835 20 0 BHADMO CC(C)C[C@H]1CCC[N@H+]1Cc1cccs1 ZINC000507166575 528590445 /nfs/dbraw/zinc/59/04/45/528590445.db2.gz DJHMEGSCVKAPFY-GFCCVEGCSA-N 1 1 223.385 3.759 20 0 BHADMO CC(C)C[C@@H]1CCC[N@H+]1Cc1cccs1 ZINC000507166576 528380415 /nfs/dbraw/zinc/38/04/15/528380415.db2.gz DJHMEGSCVKAPFY-LBPRGKRZSA-N 1 1 223.385 3.759 20 0 BHADMO C[C@H]1CC[N@@H+](Cc2csc3ccccc23)C1 ZINC000507166926 533642871 /nfs/dbraw/zinc/64/28/71/533642871.db2.gz ZWRKFKMGACQQKE-NSHDSACASA-N 1 1 231.364 3.743 20 0 BHADMO CCCCC[N@@H+](Cc1ccco1)C(C)C ZINC000507167008 528182352 /nfs/dbraw/zinc/18/23/52/528182352.db2.gz HDKGBWSJMWYNLW-UHFFFAOYSA-N 1 1 209.333 3.680 20 0 BHADMO CC(C)C[C@H]1CCC[N@H+]1Cc1ccsc1 ZINC000507167130 528590822 /nfs/dbraw/zinc/59/08/22/528590822.db2.gz IQSOYNOYTFHALM-CYBMUJFWSA-N 1 1 223.385 3.759 20 0 BHADMO CC(C)C[C@@H]1CCC[N@H+]1Cc1ccsc1 ZINC000507167131 528380097 /nfs/dbraw/zinc/38/00/97/528380097.db2.gz IQSOYNOYTFHALM-ZDUSSCGKSA-N 1 1 223.385 3.759 20 0 BHADMO CC[C@@H](C)[N@@H+](C)Cc1ccc(C)c(C)c1 ZINC000507171388 529345217 /nfs/dbraw/zinc/34/52/17/529345217.db2.gz URFBMSNWAVIQRC-CYBMUJFWSA-N 1 1 205.345 3.534 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1ccc(C)c(C)c1 ZINC000507171389 529691139 /nfs/dbraw/zinc/69/11/39/529691139.db2.gz URFBMSNWAVIQRC-ZDUSSCGKSA-N 1 1 205.345 3.534 20 0 BHADMO CC[N@@H+](CCc1ccccc1)Cc1ccc(C)o1 ZINC000507171423 528591480 /nfs/dbraw/zinc/59/14/80/528591480.db2.gz VBWSDTIQWUTZFN-UHFFFAOYSA-N 1 1 243.350 3.653 20 0 BHADMO Clc1ccc([C@@H]2CCC[N@H+]2CC2CC2)cc1 ZINC000507171995 226366668 /nfs/dbraw/zinc/36/66/68/226366668.db2.gz YLEVHTVUNOOTQN-AWEZNQCLSA-N 1 1 235.758 3.887 20 0 BHADMO Clc1ccc([C@H]2CCC[N@H+]2CC2CC2)cc1 ZINC000507171996 226366746 /nfs/dbraw/zinc/36/67/46/226366746.db2.gz YLEVHTVUNOOTQN-CQSZACIVSA-N 1 1 235.758 3.887 20 0 BHADMO Cc1nocc1C[N@@H+](C1CC1)C1CCC(C)CC1 ZINC000507172196 226366877 /nfs/dbraw/zinc/36/68/77/226366877.db2.gz ZNPABBLWIKDLCB-UHFFFAOYSA-N 1 1 248.370 3.526 20 0 BHADMO Clc1ccccc1[C@@H]1CCC[N@H+]1CC1CC1 ZINC000507176131 534653578 /nfs/dbraw/zinc/65/35/78/534653578.db2.gz XLVYJTUNPGBUHU-AWEZNQCLSA-N 1 1 235.758 3.887 20 0 BHADMO Clc1ccccc1[C@H]1CCC[N@H+]1CC1CC1 ZINC000507176132 534654188 /nfs/dbraw/zinc/65/41/88/534654188.db2.gz XLVYJTUNPGBUHU-CQSZACIVSA-N 1 1 235.758 3.887 20 0 BHADMO Cc1sccc1C[N@H+](C)Cc1cccc(C)c1 ZINC000507186510 226366767 /nfs/dbraw/zinc/36/67/67/226366767.db2.gz FRKUAOXZEGLVQQ-UHFFFAOYSA-N 1 1 245.391 3.997 20 0 BHADMO CC[N@@H+](Cc1occc1C)Cc1ccc(F)cc1 ZINC000507186650 528918135 /nfs/dbraw/zinc/91/81/35/528918135.db2.gz GDRVRBILZMQORE-UHFFFAOYSA-N 1 1 247.313 3.749 20 0 BHADMO Cc1cc(F)ccc1C[N@H+](C)[C@H](C)C(C)C ZINC000507186921 533876545 /nfs/dbraw/zinc/87/65/45/533876545.db2.gz APWASIJFFJGHEH-GFCCVEGCSA-N 1 1 223.335 3.610 20 0 BHADMO Cc1cc(F)ccc1C[N@H+](C)[C@@H](C)C(C)C ZINC000507186923 533878412 /nfs/dbraw/zinc/87/84/12/533878412.db2.gz APWASIJFFJGHEH-LBPRGKRZSA-N 1 1 223.335 3.610 20 0 BHADMO CC(C)[C@H]1CCC[N@H+]1Cc1ccc(Cl)o1 ZINC000507187197 527784695 /nfs/dbraw/zinc/78/46/95/527784695.db2.gz JENPJEDDNCIFMW-LLVKDONJSA-N 1 1 227.735 3.553 20 0 BHADMO CC(C)[C@@H]1CCC[N@H+]1Cc1ccc(Cl)o1 ZINC000507187199 528674761 /nfs/dbraw/zinc/67/47/61/528674761.db2.gz JENPJEDDNCIFMW-NSHDSACASA-N 1 1 227.735 3.553 20 0 BHADMO CC[C@@H](C[N@H+](C)[C@@H](C)CC)c1ccccc1 ZINC000507187473 529472025 /nfs/dbraw/zinc/47/20/25/529472025.db2.gz KIJZKLWETZULGH-KBPBESRZSA-N 1 1 219.372 3.911 20 0 BHADMO CC[C@@H](C)[N@@H+](C)C[C@H](CC)c1ccccc1 ZINC000507187474 529343894 /nfs/dbraw/zinc/34/38/94/529343894.db2.gz KIJZKLWETZULGH-KGLIPLIRSA-N 1 1 219.372 3.911 20 0 BHADMO CC[C@H](C)[N@@H+](C)C[C@@H](CC)c1ccccc1 ZINC000507187475 529690397 /nfs/dbraw/zinc/69/03/97/529690397.db2.gz KIJZKLWETZULGH-UONOGXRCSA-N 1 1 219.372 3.911 20 0 BHADMO CC[C@@H](C)[N@@H+](C)C[C@@H](CC)c1ccccc1 ZINC000507187476 529344067 /nfs/dbraw/zinc/34/40/67/529344067.db2.gz KIJZKLWETZULGH-ZIAGYGMSSA-N 1 1 219.372 3.911 20 0 BHADMO CC[C@@H](C)[N@@H+](C)Cc1c(C)oc2ccccc21 ZINC000507187893 529344739 /nfs/dbraw/zinc/34/47/39/529344739.db2.gz NAWWMLVWTMHEDC-LLVKDONJSA-N 1 1 231.339 3.972 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1c(C)oc2ccccc21 ZINC000507187894 529691265 /nfs/dbraw/zinc/69/12/65/529691265.db2.gz NAWWMLVWTMHEDC-NSHDSACASA-N 1 1 231.339 3.972 20 0 BHADMO CC(C)[C@H]1CCC[N@H+]1Cc1cccc(F)c1F ZINC000507188569 527785065 /nfs/dbraw/zinc/78/50/65/527785065.db2.gz QFYPCHXELBUMBU-CYBMUJFWSA-N 1 1 239.309 3.585 20 0 BHADMO CCOc1cccc(C[N@@H+](CC)CC(C)C)c1 ZINC000507188956 528644299 /nfs/dbraw/zinc/64/42/99/528644299.db2.gz SIUKDHOBUPQNGV-UHFFFAOYSA-N 1 1 235.371 3.563 20 0 BHADMO CC[C@H](C)[N@@H+](C)C[C@@H]1C[C@@H]1c1ccccc1 ZINC000507188961 529690573 /nfs/dbraw/zinc/69/05/73/529690573.db2.gz SKFHBEVPALCCKK-AEGPPILISA-N 1 1 217.356 3.520 20 0 BHADMO CC[C@H](C)[N@@H+](C)C[C@H]1C[C@H]1c1ccccc1 ZINC000507188962 529691284 /nfs/dbraw/zinc/69/12/84/529691284.db2.gz SKFHBEVPALCCKK-CFVMTHIKSA-N 1 1 217.356 3.520 20 0 BHADMO CC[C@H](C)[N@@H+](C)C[C@H]1C[C@@H]1c1ccccc1 ZINC000507188963 529691396 /nfs/dbraw/zinc/69/13/96/529691396.db2.gz SKFHBEVPALCCKK-NWANDNLSSA-N 1 1 217.356 3.520 20 0 BHADMO COc1ccccc1/C=C\C[N@@H+](C)[C@@H](C)C(C)C ZINC000507188973 533956960 /nfs/dbraw/zinc/95/69/60/533956960.db2.gz SMTCBIRTDJAUIT-GDAGCXPBSA-N 1 1 247.382 3.685 20 0 BHADMO COc1ccccc1/C=C/C[N@@H+](C)[C@@H](C)C(C)C ZINC000507188974 533948483 /nfs/dbraw/zinc/94/84/83/533948483.db2.gz SMTCBIRTDJAUIT-PLWJUESGSA-N 1 1 247.382 3.685 20 0 BHADMO COc1ccccc1/C=C\C[N@@H+](C)[C@H](C)C(C)C ZINC000507188975 533959370 /nfs/dbraw/zinc/95/93/70/533959370.db2.gz SMTCBIRTDJAUIT-QQBNSCQMSA-N 1 1 247.382 3.685 20 0 BHADMO COc1ccccc1/C=C/C[N@@H+](C)[C@H](C)C(C)C ZINC000507188976 533946306 /nfs/dbraw/zinc/94/63/06/533946306.db2.gz SMTCBIRTDJAUIT-QSYFUGGGSA-N 1 1 247.382 3.685 20 0 BHADMO CC(C)[C@H](C)[N@@H+](C)C[C@@H]1C[C@@H]1c1ccccc1 ZINC000507189016 528959266 /nfs/dbraw/zinc/95/92/66/528959266.db2.gz SUYTVJPTZPOGDE-CWRNSKLLSA-N 1 1 231.383 3.766 20 0 BHADMO CC(C)[C@H](C)[N@@H+](C)C[C@H]1C[C@H]1c1ccccc1 ZINC000507189017 528959824 /nfs/dbraw/zinc/95/98/24/528959824.db2.gz SUYTVJPTZPOGDE-IMJJTQAJSA-N 1 1 231.383 3.766 20 0 BHADMO CC(C)[C@H](C)[N@@H+](C)C[C@H]1C[C@@H]1c1ccccc1 ZINC000507189018 528959114 /nfs/dbraw/zinc/95/91/14/528959114.db2.gz SUYTVJPTZPOGDE-NUEKZKHPSA-N 1 1 231.383 3.766 20 0 BHADMO CC(C)[C@@H](C)[N@@H+](C)C/C=C\c1ccc(F)cc1 ZINC000507189314 528406759 /nfs/dbraw/zinc/40/67/59/528406759.db2.gz ADCARRHTTFHVTC-CFHLNLSMSA-N 1 1 235.346 3.815 20 0 BHADMO CC(C)[C@H](C)[N@@H+](C)C/C=C/c1ccc(F)cc1 ZINC000507189315 528958486 /nfs/dbraw/zinc/95/84/86/528958486.db2.gz ADCARRHTTFHVTC-GFUIURDCSA-N 1 1 235.346 3.815 20 0 BHADMO CC(C)[C@H](C)[N@@H+](C)C/C=C\c1ccc(F)cc1 ZINC000507189316 528957590 /nfs/dbraw/zinc/95/75/90/528957590.db2.gz ADCARRHTTFHVTC-SZZPACECSA-N 1 1 235.346 3.815 20 0 BHADMO CC(C)[C@@H](C)[N@@H+](C)C/C=C/c1ccc(F)cc1 ZINC000507189317 528406269 /nfs/dbraw/zinc/40/62/69/528406269.db2.gz ADCARRHTTFHVTC-URWSZGRFSA-N 1 1 235.346 3.815 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1cc2cc(F)ccc2o1 ZINC000507189486 529691409 /nfs/dbraw/zinc/69/14/09/529691409.db2.gz VQNAYOKIBOFKPQ-JTQLQIEISA-N 1 1 235.302 3.802 20 0 BHADMO CC[C@@H](C)[N@@H+](C)Cc1cc2cc(F)ccc2o1 ZINC000507189487 529345106 /nfs/dbraw/zinc/34/51/06/529345106.db2.gz VQNAYOKIBOFKPQ-SNVBAGLBSA-N 1 1 235.302 3.802 20 0 BHADMO CC(C)[C@@H]1CCC[N@H+]1Cc1cc(F)cc(F)c1 ZINC000507189976 528674234 /nfs/dbraw/zinc/67/42/34/528674234.db2.gz XOUKANLYJJWABU-AWEZNQCLSA-N 1 1 239.309 3.585 20 0 BHADMO CC(C)[C@H]1CCC[N@H+]1Cc1cc(F)cc(F)c1 ZINC000507189977 527784022 /nfs/dbraw/zinc/78/40/22/527784022.db2.gz XOUKANLYJJWABU-CQSZACIVSA-N 1 1 239.309 3.585 20 0 BHADMO CCCC[N@@H+](Cc1cccc(COC)c1)C1CC1 ZINC000507190793 528441448 /nfs/dbraw/zinc/44/14/48/528441448.db2.gz FQUVZLQYALKZHK-UHFFFAOYSA-N 1 1 247.382 3.598 20 0 BHADMO CC(C)[C@@H](C)[N@@H+](C)Cc1cc(F)c(F)c(F)c1 ZINC000507191834 528406569 /nfs/dbraw/zinc/40/65/69/528406569.db2.gz PPXWSIUFIVIIMZ-SECBINFHSA-N 1 1 245.288 3.580 20 0 BHADMO CC(C)[C@H](C)[N@@H+](C)Cc1cc(F)c(F)c(F)c1 ZINC000507191835 528959967 /nfs/dbraw/zinc/95/99/67/528959967.db2.gz PPXWSIUFIVIIMZ-VIFPVBQESA-N 1 1 245.288 3.580 20 0 BHADMO CC(C)C[N@@H+](Cc1ccco1)CC(C)(C)C ZINC000507192871 527948798 /nfs/dbraw/zinc/94/87/98/527948798.db2.gz SUMJGGLVGGQLNS-UHFFFAOYSA-N 1 1 223.360 3.784 20 0 BHADMO Cc1ccsc1C[N@H+](C)[C@H](C)C(C)C ZINC000507193349 534469937 /nfs/dbraw/zinc/46/99/37/534469937.db2.gz NYDKAWIDCJGVPC-LLVKDONJSA-N 1 1 211.374 3.533 20 0 BHADMO Cc1ccsc1C[N@H+](C)[C@@H](C)C(C)C ZINC000507193350 534468657 /nfs/dbraw/zinc/46/86/57/534468657.db2.gz NYDKAWIDCJGVPC-NSHDSACASA-N 1 1 211.374 3.533 20 0 BHADMO CCCC[N@@H+](Cc1cccc(F)c1F)C1CC1 ZINC000507193652 528441974 /nfs/dbraw/zinc/44/19/74/528441974.db2.gz OTOIJSHKEVTQFV-UHFFFAOYSA-N 1 1 239.309 3.729 20 0 BHADMO CC(C)[C@H](C)[N@@H+](C)Cc1ccc([C@H]2C[C@H]2C)o1 ZINC000507193908 528959997 /nfs/dbraw/zinc/95/99/97/528959997.db2.gz VRMFXQBYKVTMDY-DYEKYZERSA-N 1 1 235.371 3.879 20 0 BHADMO CC(C)[C@H](C)[N@@H+](C)Cc1ccc([C@@H]2C[C@H]2C)o1 ZINC000507193909 528959984 /nfs/dbraw/zinc/95/99/84/528959984.db2.gz VRMFXQBYKVTMDY-MBNYWOFBSA-N 1 1 235.371 3.879 20 0 BHADMO CC(C)[C@H](C)[N@@H+](C)Cc1ccc([C@H]2C[C@@H]2C)o1 ZINC000507193910 528959302 /nfs/dbraw/zinc/95/93/02/528959302.db2.gz VRMFXQBYKVTMDY-OBJOEFQTSA-N 1 1 235.371 3.879 20 0 BHADMO CC(C)[C@H](C)[N@@H+](C)Cc1ccc([C@@H]2C[C@@H]2C)o1 ZINC000507193911 528959570 /nfs/dbraw/zinc/95/95/70/528959570.db2.gz VRMFXQBYKVTMDY-SGMGOOAPSA-N 1 1 235.371 3.879 20 0 BHADMO Cc1sccc1C[N@H+](C)[C@@H](C)C(C)C ZINC000507193971 226367001 /nfs/dbraw/zinc/36/70/01/226367001.db2.gz WNFQRGFWTBNTDP-JTQLQIEISA-N 1 1 211.374 3.533 20 0 BHADMO Cc1sccc1C[N@H+](C)[C@H](C)C(C)C ZINC000507193972 226367278 /nfs/dbraw/zinc/36/72/78/226367278.db2.gz WNFQRGFWTBNTDP-SNVBAGLBSA-N 1 1 211.374 3.533 20 0 BHADMO Cc1ccc([C@H](C)[N@@H+](C)Cc2ccccn2)cc1 ZINC000507194356 226367205 /nfs/dbraw/zinc/36/72/05/226367205.db2.gz XKFAASIQXDYZNT-AWEZNQCLSA-N 1 1 240.350 3.583 20 0 BHADMO Cc1ccc([C@@H](C)[N@@H+](C)Cc2ccccn2)cc1 ZINC000507194357 226367034 /nfs/dbraw/zinc/36/70/34/226367034.db2.gz XKFAASIQXDYZNT-CQSZACIVSA-N 1 1 240.350 3.583 20 0 BHADMO Cc1ccccc1[C@H]1CC[N@H+](CCC(C)C)C1 ZINC000507195184 226367280 /nfs/dbraw/zinc/36/72/80/226367280.db2.gz IHUWQGKRPAACBT-HNNXBMFYSA-N 1 1 231.383 3.830 20 0 BHADMO Cc1ccccc1[C@@H]1CC[N@H+](CCC(C)C)C1 ZINC000507195191 226366977 /nfs/dbraw/zinc/36/69/77/226366977.db2.gz IHUWQGKRPAACBT-OAHLLOKOSA-N 1 1 231.383 3.830 20 0 BHADMO CC(C)[C@@H](C)[N@@H+](C)Cc1cccc2cc[nH]c21 ZINC000507200879 528407537 /nfs/dbraw/zinc/40/75/37/528407537.db2.gz DWFHFLHJJHKABR-GFCCVEGCSA-N 1 1 230.355 3.644 20 0 BHADMO CC(C)[C@H](C)[N@@H+](C)Cc1cccc2cc[nH]c21 ZINC000507200880 528959258 /nfs/dbraw/zinc/95/92/58/528959258.db2.gz DWFHFLHJJHKABR-LBPRGKRZSA-N 1 1 230.355 3.644 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@H](C)C(C)C)cc1F ZINC000507206798 226367094 /nfs/dbraw/zinc/36/70/94/226367094.db2.gz ALOYPTMMSSJQGZ-GFCCVEGCSA-N 1 1 223.335 3.610 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@@H](C)C(C)C)cc1F ZINC000507206799 226367158 /nfs/dbraw/zinc/36/71/58/226367158.db2.gz ALOYPTMMSSJQGZ-LBPRGKRZSA-N 1 1 223.335 3.610 20 0 BHADMO CC[N@@H+](Cc1cc(C)cc(Cl)c1)C1CC1 ZINC000507207337 528764754 /nfs/dbraw/zinc/76/47/54/528764754.db2.gz BTMRRWFLOCCJFY-UHFFFAOYSA-N 1 1 223.747 3.633 20 0 BHADMO CC(C)[C@@H](C)[N@@H+](C)Cc1cccc2[nH]ccc21 ZINC000507208999 528407377 /nfs/dbraw/zinc/40/73/77/528407377.db2.gz GUUQHWGOOAYXCL-GFCCVEGCSA-N 1 1 230.355 3.644 20 0 BHADMO CC(C)[C@H](C)[N@@H+](C)Cc1cccc2[nH]ccc21 ZINC000507209330 528959409 /nfs/dbraw/zinc/95/94/09/528959409.db2.gz GUUQHWGOOAYXCL-LBPRGKRZSA-N 1 1 230.355 3.644 20 0 BHADMO CCCC[N@@H+](Cc1ccsc1C)C1CC1 ZINC000507211995 528446190 /nfs/dbraw/zinc/44/61/90/528446190.db2.gz NNQZNWLHFDAQEJ-UHFFFAOYSA-N 1 1 223.385 3.821 20 0 BHADMO Cc1ccccc1[C@@H](C)[N@@H+](C)Cc1ccoc1 ZINC000507212005 226367525 /nfs/dbraw/zinc/36/75/25/226367525.db2.gz NOAMOKIRKWCTPK-CYBMUJFWSA-N 1 1 229.323 3.781 20 0 BHADMO Cc1ccccc1[C@H](C)[N@@H+](C)Cc1ccoc1 ZINC000507212006 226367482 /nfs/dbraw/zinc/36/74/82/226367482.db2.gz NOAMOKIRKWCTPK-ZDUSSCGKSA-N 1 1 229.323 3.781 20 0 BHADMO 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CC[C@@H](C[N@@H+](CC)C1CC1)c1ccccc1 ZINC000507221196 529472482 /nfs/dbraw/zinc/47/24/82/529472482.db2.gz GQTIRVPVEPESJO-ZDUSSCGKSA-N 1 1 217.356 3.665 20 0 BHADMO CC[N@@H+](C/C=C\c1ccc(Cl)cc1)C1CC1 ZINC000507221199 527871371 /nfs/dbraw/zinc/87/13/71/527871371.db2.gz GRCATUJVFFKPHW-ARJAWSKDSA-N 1 1 235.758 3.838 20 0 BHADMO CC[N@@H+](C/C=C/c1ccc(Cl)cc1)C1CC1 ZINC000507221200 527870942 /nfs/dbraw/zinc/87/09/42/527870942.db2.gz GRCATUJVFFKPHW-ONEGZZNKSA-N 1 1 235.758 3.838 20 0 BHADMO CCCC[N@@H+](Cc1cccc2[nH]ccc21)C1CC1 ZINC000507221267 528443398 /nfs/dbraw/zinc/44/33/98/528443398.db2.gz HQPYXPBRMQDBNP-UHFFFAOYSA-N 1 1 242.366 3.932 20 0 BHADMO Cc1sccc1C[N@@H+]1CCC[C@@H]1C(C)C ZINC000507221420 226367516 /nfs/dbraw/zinc/36/75/16/226367516.db2.gz JNVMPOGABAIOIL-CYBMUJFWSA-N 1 1 223.385 3.677 20 0 BHADMO Cc1sccc1C[N@@H+]1CCC[C@H]1C(C)C ZINC000507221421 226367518 /nfs/dbraw/zinc/36/75/18/226367518.db2.gz JNVMPOGABAIOIL-ZDUSSCGKSA-N 1 1 223.385 3.677 20 0 BHADMO CCOc1ccc(C[N@@H+](C)[C@H](C)C(C)C)cc1 ZINC000507221501 226367514 /nfs/dbraw/zinc/36/75/14/226367514.db2.gz KQLDCWHSHNEGBF-CYBMUJFWSA-N 1 1 235.371 3.562 20 0 BHADMO CCOc1ccc(C[N@@H+](C)[C@@H](C)C(C)C)cc1 ZINC000507221502 226367339 /nfs/dbraw/zinc/36/73/39/226367339.db2.gz KQLDCWHSHNEGBF-ZDUSSCGKSA-N 1 1 235.371 3.562 20 0 BHADMO CC[N@@H+](Cc1cc2cc(F)ccc2o1)C1CC1 ZINC000507221531 528767797 /nfs/dbraw/zinc/76/77/97/528767797.db2.gz KXVMRBGMVRTPTH-UHFFFAOYSA-N 1 1 233.286 3.556 20 0 BHADMO CCCC[N@@H+](Cc1c(F)cccc1F)C1CC1 ZINC000507221572 528441213 /nfs/dbraw/zinc/44/12/13/528441213.db2.gz LPUWQMRRNNWXFK-UHFFFAOYSA-N 1 1 239.309 3.729 20 0 BHADMO CCCC[N@H+](Cc1c(F)cccc1F)C1CC1 ZINC000507221572 528441204 /nfs/dbraw/zinc/44/12/04/528441204.db2.gz LPUWQMRRNNWXFK-UHFFFAOYSA-N 1 1 239.309 3.729 20 0 BHADMO CCC[N@@H+](Cc1ccc(Cl)s1)C1CC1 ZINC000507225430 528136682 /nfs/dbraw/zinc/13/66/82/528136682.db2.gz CZDZNGZYAMRZAI-UHFFFAOYSA-N 1 1 229.776 3.776 20 0 BHADMO 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CC(C)CCn1cccc1C[N@@H+](C)[C@@H](C)C1CC1 ZINC000507435063 324170356 /nfs/dbraw/zinc/17/03/56/324170356.db2.gz VNRMIIDCYHECDR-AWEZNQCLSA-N 1 1 248.414 3.765 20 0 BHADMO CC(C)CCn1cccc1C[N@@H+](C)[C@H](C)C1CC1 ZINC000507435064 324170294 /nfs/dbraw/zinc/17/02/94/324170294.db2.gz VNRMIIDCYHECDR-CQSZACIVSA-N 1 1 248.414 3.765 20 0 BHADMO COc1c(C)cc(C[N@@H+](C)[C@H](C)C2CC2)cc1C ZINC000507435380 324170401 /nfs/dbraw/zinc/17/04/01/324170401.db2.gz XJRFFIVMKRDQQW-CYBMUJFWSA-N 1 1 247.382 3.542 20 0 BHADMO COc1c(C)cc(C[N@@H+](C)[C@@H](C)C2CC2)cc1C ZINC000507435381 324170236 /nfs/dbraw/zinc/17/02/36/324170236.db2.gz XJRFFIVMKRDQQW-ZDUSSCGKSA-N 1 1 247.382 3.542 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@H](C)C2CC2)c(C)c1 ZINC000507439465 324170253 /nfs/dbraw/zinc/17/02/53/324170253.db2.gz DQVZMKIZIRWUOQ-CYBMUJFWSA-N 1 1 217.356 3.534 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@@H](C)C2CC2)c(C)c1 ZINC000507439467 324170363 /nfs/dbraw/zinc/17/03/63/324170363.db2.gz DQVZMKIZIRWUOQ-ZDUSSCGKSA-N 1 1 217.356 3.534 20 0 BHADMO C[C@H](C1CC1)[N@@H+](C)Cc1ccc(F)cc1Cl ZINC000507439777 324170378 /nfs/dbraw/zinc/17/03/78/324170378.db2.gz FUEGXHVLTXKURA-SECBINFHSA-N 1 1 241.737 3.709 20 0 BHADMO C[C@@H](C1CC1)[N@@H+](C)Cc1ccc(F)cc1Cl ZINC000507439779 324170241 /nfs/dbraw/zinc/17/02/41/324170241.db2.gz FUEGXHVLTXKURA-VIFPVBQESA-N 1 1 241.737 3.709 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@H](C)C2CC2)cc1C ZINC000507440487 324170312 /nfs/dbraw/zinc/17/03/12/324170312.db2.gz HUCAOWCGTFCRMS-CYBMUJFWSA-N 1 1 217.356 3.534 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@@H](C)C2CC2)cc1C ZINC000507440488 324170884 /nfs/dbraw/zinc/17/08/84/324170884.db2.gz HUCAOWCGTFCRMS-ZDUSSCGKSA-N 1 1 217.356 3.534 20 0 BHADMO Cc1oc2ccccc2c1C[N@H+](C)[C@H](C)C1CC1 ZINC000507440600 324170258 /nfs/dbraw/zinc/17/02/58/324170258.db2.gz JQCOKXBYUKZBRK-LLVKDONJSA-N 1 1 243.350 3.972 20 0 BHADMO Cc1oc2ccccc2c1C[N@H+](C)[C@@H](C)C1CC1 ZINC000507440601 324170860 /nfs/dbraw/zinc/17/08/60/324170860.db2.gz JQCOKXBYUKZBRK-NSHDSACASA-N 1 1 243.350 3.972 20 0 BHADMO Cc1cc(NC(C)C)c[nH+]c1N1CCCC[C@H]1C ZINC000507441149 324170826 /nfs/dbraw/zinc/17/08/26/324170826.db2.gz KJBFIRDQEHEZEK-CYBMUJFWSA-N 1 1 247.386 3.589 20 0 BHADMO Cc1cc(NC(C)C)c[nH+]c1N1CCCC[C@@H]1C ZINC000507441153 388384024 /nfs/dbraw/zinc/38/40/24/388384024.db2.gz KJBFIRDQEHEZEK-ZDUSSCGKSA-N 1 1 247.386 3.589 20 0 BHADMO C/C(=C\c1ccccc1)C[N@H+](C)[C@@H](C)C1CC1 ZINC000507441298 388384702 /nfs/dbraw/zinc/38/47/02/388384702.db2.gz MIDXZYOGMOZMSI-CMPYXILNSA-N 1 1 229.367 3.820 20 0 BHADMO C/C(=C/c1ccccc1)C[N@H+](C)[C@@H](C)C1CC1 ZINC000507441299 388384372 /nfs/dbraw/zinc/38/43/72/388384372.db2.gz MIDXZYOGMOZMSI-FZDNWWAKSA-N 1 1 229.367 3.820 20 0 BHADMO C/C(=C/c1ccccc1)C[N@H+](C)[C@H](C)C1CC1 ZINC000507441300 388384199 /nfs/dbraw/zinc/38/41/99/388384199.db2.gz MIDXZYOGMOZMSI-YBEMTRGBSA-N 1 1 229.367 3.820 20 0 BHADMO C/C(=C\c1ccccc1)C[N@H+](C)[C@H](C)C1CC1 ZINC000507441301 388384776 /nfs/dbraw/zinc/38/47/76/388384776.db2.gz MIDXZYOGMOZMSI-YPDDLIOESA-N 1 1 229.367 3.820 20 0 BHADMO C[C@H](C1CC1)[N@@H+](C)C[C@H]1C[C@@H]1c1ccccc1 ZINC000507441770 388384659 /nfs/dbraw/zinc/38/46/59/388384659.db2.gz OUTBBPQGGMCESS-DAXOMENPSA-N 1 1 229.367 3.520 20 0 BHADMO C[C@H](C1CC1)[N@@H+](C)C[C@@H]1C[C@@H]1c1ccccc1 ZINC000507441773 388384227 /nfs/dbraw/zinc/38/42/27/388384227.db2.gz OUTBBPQGGMCESS-UHOFOFEASA-N 1 1 229.367 3.520 20 0 BHADMO C[C@H](C1CC1)[N@@H+](C)C[C@H]1C[C@H]1c1ccccc1 ZINC000507441775 388384774 /nfs/dbraw/zinc/38/47/74/388384774.db2.gz OUTBBPQGGMCESS-WQVCFCJDSA-N 1 1 229.367 3.520 20 0 BHADMO C[C@H](C1CC1)[N@@H+](C)Cc1cc(Cl)ccc1F ZINC000507443653 388384328 /nfs/dbraw/zinc/38/43/28/388384328.db2.gz UCRZZTHCWGRTDE-SECBINFHSA-N 1 1 241.737 3.709 20 0 BHADMO C[C@@H](C1CC1)[N@@H+](C)Cc1cc(Cl)ccc1F ZINC000507443655 388384272 /nfs/dbraw/zinc/38/42/72/388384272.db2.gz UCRZZTHCWGRTDE-VIFPVBQESA-N 1 1 241.737 3.709 20 0 BHADMO CC[C@@H](C[N@@H+](C)[C@@H](C)C1CC1)c1ccccc1 ZINC000507449001 388384640 /nfs/dbraw/zinc/38/46/40/388384640.db2.gz FAHRQYDRHLLYRG-KBPBESRZSA-N 1 1 231.383 3.911 20 0 BHADMO CC[C@@H](C[N@@H+](C)[C@H](C)C1CC1)c1ccccc1 ZINC000507449002 388384664 /nfs/dbraw/zinc/38/46/64/388384664.db2.gz FAHRQYDRHLLYRG-KGLIPLIRSA-N 1 1 231.383 3.911 20 0 BHADMO CC[C@H](C[N@@H+](C)[C@@H](C)C1CC1)c1ccccc1 ZINC000507449003 388384137 /nfs/dbraw/zinc/38/41/37/388384137.db2.gz FAHRQYDRHLLYRG-UONOGXRCSA-N 1 1 231.383 3.911 20 0 BHADMO CC[C@H](C[N@@H+](C)[C@H](C)C1CC1)c1ccccc1 ZINC000507449004 388384364 /nfs/dbraw/zinc/38/43/64/388384364.db2.gz FAHRQYDRHLLYRG-ZIAGYGMSSA-N 1 1 231.383 3.911 20 0 BHADMO Cc1cc(C)cc(C[N@H+](C)[C@H](C)C2CC2)c1 ZINC000507449279 388384475 /nfs/dbraw/zinc/38/44/75/388384475.db2.gz GXJDAFLOFHUBRG-CYBMUJFWSA-N 1 1 217.356 3.534 20 0 BHADMO Cc1cc(C)cc(C[N@H+](C)[C@@H](C)C2CC2)c1 ZINC000507449282 388384074 /nfs/dbraw/zinc/38/40/74/388384074.db2.gz GXJDAFLOFHUBRG-ZDUSSCGKSA-N 1 1 217.356 3.534 20 0 BHADMO C[C@H](C1CC1)[N@@H+](C)Cc1cccc(Cl)c1F ZINC000507449701 388384551 /nfs/dbraw/zinc/38/45/51/388384551.db2.gz IIOZELJOJROGHI-SECBINFHSA-N 1 1 241.737 3.709 20 0 BHADMO C[C@@H](C1CC1)[N@@H+](C)Cc1cccc(Cl)c1F ZINC000507449702 388384450 /nfs/dbraw/zinc/38/44/50/388384450.db2.gz IIOZELJOJROGHI-VIFPVBQESA-N 1 1 241.737 3.709 20 0 BHADMO C[C@H](C1CC1)[N@@H+](C)Cc1ccc(Cl)c(F)c1 ZINC000507452484 388384186 /nfs/dbraw/zinc/38/41/86/388384186.db2.gz VVVMJNKTKTZTEM-SECBINFHSA-N 1 1 241.737 3.709 20 0 BHADMO C[C@@H](C1CC1)[N@@H+](C)Cc1ccc(Cl)c(F)c1 ZINC000507452485 388384438 /nfs/dbraw/zinc/38/44/38/388384438.db2.gz VVVMJNKTKTZTEM-VIFPVBQESA-N 1 1 241.737 3.709 20 0 BHADMO CC[C@H](C)C[N@@H+](C)Cc1ccsc1C ZINC000507494556 529650779 /nfs/dbraw/zinc/65/07/79/529650779.db2.gz XVOMGHPNEXDMDK-JTQLQIEISA-N 1 1 211.374 3.534 20 0 BHADMO CC[C@@H](C)C[N@@H+](C)Cc1ccsc1C ZINC000507494562 529314241 /nfs/dbraw/zinc/31/42/41/529314241.db2.gz XVOMGHPNEXDMDK-SNVBAGLBSA-N 1 1 211.374 3.534 20 0 BHADMO Cc1sccc1C[N@H+](CC(C)C)C(C)C ZINC000507502555 226369281 /nfs/dbraw/zinc/36/92/81/226369281.db2.gz CHEVQLKMYAHJGW-UHFFFAOYSA-N 1 1 225.401 3.923 20 0 BHADMO CC[C@@H]1CCC[N@@H+](Cc2ccsc2C)C1 ZINC000507555896 529298673 /nfs/dbraw/zinc/29/86/73/529298673.db2.gz VAXOIGBZIGVXKA-GFCCVEGCSA-N 1 1 223.385 3.679 20 0 BHADMO CC[C@H]1CCC[N@@H+](Cc2ccsc2C)C1 ZINC000507555897 529217754 /nfs/dbraw/zinc/21/77/54/529217754.db2.gz VAXOIGBZIGVXKA-LBPRGKRZSA-N 1 1 223.385 3.679 20 0 BHADMO CCC[N@@H+](C)Cc1ccc(Oc2ccccc2)o1 ZINC000507609686 527853153 /nfs/dbraw/zinc/85/31/53/527853153.db2.gz FLTGSNAXFJZVRI-UHFFFAOYSA-N 1 1 245.322 3.914 20 0 BHADMO CC[N@@H+](Cc1ccc(Cl)c(C)c1)C1CC1 ZINC000507616525 528781343 /nfs/dbraw/zinc/78/13/43/528781343.db2.gz CUDOCFJYSKACPC-UHFFFAOYSA-N 1 1 223.747 3.633 20 0 BHADMO CC(C)[N@@H+](C)Cc1ccc(Oc2ccccc2)o1 ZINC000507619528 528834225 /nfs/dbraw/zinc/83/42/25/528834225.db2.gz KLZVLEVNLCKGBS-UHFFFAOYSA-N 1 1 245.322 3.912 20 0 BHADMO C[N@H+](Cc1ccc(C2CCC2)cc1)CC1CC1 ZINC000507630137 529984366 /nfs/dbraw/zinc/98/43/66/529984366.db2.gz NNWZHOILZRXQGO-UHFFFAOYSA-N 1 1 229.367 3.796 20 0 BHADMO COc1c(C)cc(C[N@@H+](C)CCC(C)C)cc1C ZINC000507647832 533395265 /nfs/dbraw/zinc/39/52/65/533395265.db2.gz IEFUWARQCBMSCZ-UHFFFAOYSA-N 1 1 249.398 3.790 20 0 BHADMO C[N@@H+](CCOC(C)(C)C)CCC1CCCCC1 ZINC000507650564 529920897 /nfs/dbraw/zinc/92/08/97/529920897.db2.gz YBVMMTWALCIRIY-UHFFFAOYSA-N 1 1 241.419 3.704 20 0 BHADMO CC[C@H](C)[N@@H+](CCOC(C)C)Cc1ccccc1 ZINC000507693959 529694006 /nfs/dbraw/zinc/69/40/06/529694006.db2.gz MUYRCKFEFIPLNZ-HNNXBMFYSA-N 1 1 249.398 3.712 20 0 BHADMO CC[C@@H](C)[N@@H+](CCOC(C)C)Cc1ccccc1 ZINC000507693960 529347911 /nfs/dbraw/zinc/34/79/11/529347911.db2.gz MUYRCKFEFIPLNZ-OAHLLOKOSA-N 1 1 249.398 3.712 20 0 BHADMO CCC[N@@H+](C)CCSc1ccc(Cl)cc1 ZINC000507694633 527825561 /nfs/dbraw/zinc/82/55/61/527825561.db2.gz ZQBYIKMHBZHFHA-UHFFFAOYSA-N 1 1 243.803 3.774 20 0 BHADMO CC[C@H](C)[N@H+](Cc1ccccc1)CC(C)C ZINC000507695164 529695377 /nfs/dbraw/zinc/69/53/77/529695377.db2.gz SWEIEJKSVZIFRE-AWEZNQCLSA-N 1 1 219.372 3.943 20 0 BHADMO CC[C@@H](C)[N@H+](Cc1ccccc1)CC(C)C ZINC000507695165 529349374 /nfs/dbraw/zinc/34/93/74/529349374.db2.gz SWEIEJKSVZIFRE-CQSZACIVSA-N 1 1 219.372 3.943 20 0 BHADMO CCC[N@@H+](Cc1ccccc1)[C@@H](C)CC ZINC000507710742 528145803 /nfs/dbraw/zinc/14/58/03/528145803.db2.gz RLSHUGJOTXIMSU-ZDUSSCGKSA-N 1 1 205.345 3.697 20 0 BHADMO CCC[N@@H+](Cc1cc(C)ccc1C)C1CC1 ZINC000507787086 528130537 /nfs/dbraw/zinc/13/05/37/528130537.db2.gz MQWXFNFYTTYECQ-UHFFFAOYSA-N 1 1 217.356 3.678 20 0 BHADMO Cc1ccc(C[N@H+](CC(C)C)C2CCCC2)nc1 ZINC000507788602 533881292 /nfs/dbraw/zinc/88/12/92/533881292.db2.gz NZPZSCHGUGCHCL-UHFFFAOYSA-N 1 1 246.398 3.791 20 0 BHADMO COc1cccc(C[N@@H+](CCC(C)C)C2CC2)c1 ZINC000507792985 533473068 /nfs/dbraw/zinc/47/30/68/533473068.db2.gz UXYVUMOBESXGNL-UHFFFAOYSA-N 1 1 247.382 3.706 20 0 BHADMO CCC[N@@H+](CC(C)C)C[C@@H]1CCO[C@@H](CC)C1 ZINC000507797580 527928826 /nfs/dbraw/zinc/92/88/26/527928826.db2.gz SAVDNAFQYGBAPD-CABCVRRESA-N 1 1 241.419 3.560 20 0 BHADMO CCC[N@@H+](CC(C)C)C[C@H]1CCO[C@@H](CC)C1 ZINC000507797581 527928257 /nfs/dbraw/zinc/92/82/57/527928257.db2.gz SAVDNAFQYGBAPD-GJZGRUSLSA-N 1 1 241.419 3.560 20 0 BHADMO CCC[N@@H+](CC(C)C)C[C@@H]1CCO[C@H](CC)C1 ZINC000507797582 527928838 /nfs/dbraw/zinc/92/88/38/527928838.db2.gz SAVDNAFQYGBAPD-HUUCEWRRSA-N 1 1 241.419 3.560 20 0 BHADMO CCC[N@@H+](CC(C)C)C[C@H]1CCO[C@H](CC)C1 ZINC000507797583 527928975 /nfs/dbraw/zinc/92/89/75/527928975.db2.gz SAVDNAFQYGBAPD-LSDHHAIUSA-N 1 1 241.419 3.560 20 0 BHADMO CC[C@H]1C[C@H](C[N@@H+](CC(C)C)C(C)C)CCO1 ZINC000507798515 529326423 /nfs/dbraw/zinc/32/64/23/529326423.db2.gz RIUFAVJVPSPPLT-CABCVRRESA-N 1 1 241.419 3.558 20 0 BHADMO CC[C@H]1C[C@@H](C[N@@H+](CC(C)C)C(C)C)CCO1 ZINC000507798516 529317287 /nfs/dbraw/zinc/31/72/87/529317287.db2.gz RIUFAVJVPSPPLT-GJZGRUSLSA-N 1 1 241.419 3.558 20 0 BHADMO CC[C@@H]1C[C@H](C[N@@H+](CC(C)C)C(C)C)CCO1 ZINC000507798517 529441624 /nfs/dbraw/zinc/44/16/24/529441624.db2.gz RIUFAVJVPSPPLT-HUUCEWRRSA-N 1 1 241.419 3.558 20 0 BHADMO CC[C@@H]1C[C@@H](C[N@@H+](CC(C)C)C(C)C)CCO1 ZINC000507798518 529425312 /nfs/dbraw/zinc/42/53/12/529425312.db2.gz RIUFAVJVPSPPLT-LSDHHAIUSA-N 1 1 241.419 3.558 20 0 BHADMO Cc1cc(C[N@H+](C)[C@H](C)C2CC2)ccc1Cl ZINC000507803802 226371010 /nfs/dbraw/zinc/37/10/10/226371010.db2.gz LDNKXMSMYIJRMV-LLVKDONJSA-N 1 1 237.774 3.879 20 0 BHADMO Cc1cc(C[N@H+](C)[C@@H](C)C2CC2)ccc1Cl ZINC000507803803 226371039 /nfs/dbraw/zinc/37/10/39/226371039.db2.gz LDNKXMSMYIJRMV-NSHDSACASA-N 1 1 237.774 3.879 20 0 BHADMO CC[C@H](C)C[N@@H+](CC)C[C@H]1CCO[C@@H](CC)C1 ZINC000507803889 529658366 /nfs/dbraw/zinc/65/83/66/529658366.db2.gz LYMPNCBGMRSKPL-KKUMJFAQSA-N 1 1 241.419 3.560 20 0 BHADMO CC[C@H](C)C[N@@H+](CC)C[C@@H]1CCO[C@H](CC)C1 ZINC000507803890 529658436 /nfs/dbraw/zinc/65/84/36/529658436.db2.gz LYMPNCBGMRSKPL-RRFJBIMHSA-N 1 1 241.419 3.560 20 0 BHADMO CC[C@H](C)C[N@@H+](CC)C[C@H]1CCO[C@H](CC)C1 ZINC000507803891 529658445 /nfs/dbraw/zinc/65/84/45/529658445.db2.gz LYMPNCBGMRSKPL-SOUVJXGZSA-N 1 1 241.419 3.560 20 0 BHADMO CC[C@H](C)C[N@@H+](CC)C[C@@H]1CCO[C@@H](CC)C1 ZINC000507803892 529658509 /nfs/dbraw/zinc/65/85/09/529658509.db2.gz LYMPNCBGMRSKPL-ZNMIVQPWSA-N 1 1 241.419 3.560 20 0 BHADMO Cc1cc(C[N@H+]2CCC23CCC3)ccc1Cl ZINC000507804446 533595559 /nfs/dbraw/zinc/59/55/59/533595559.db2.gz NEVXDCAFHSKGHI-UHFFFAOYSA-N 1 1 235.758 3.777 20 0 BHADMO CC[C@@H]1C[C@@H](C[N@@H+](CC)[C@H](C)C(C)C)CCO1 ZINC000507805213 529425552 /nfs/dbraw/zinc/42/55/52/529425552.db2.gz PLIGNIHKOYSCMR-QLFBSQMISA-N 1 1 241.419 3.558 20 0 BHADMO CC[C@@H]1C[C@H](C[N@@H+](CC)[C@H](C)C(C)C)CCO1 ZINC000507805214 529441839 /nfs/dbraw/zinc/44/18/39/529441839.db2.gz PLIGNIHKOYSCMR-RBSFLKMASA-N 1 1 241.419 3.558 20 0 BHADMO CC[C@@H]1C[C@H](C[N@@H+](CC)[C@@H](C)C(C)C)CCO1 ZINC000507805215 529441674 /nfs/dbraw/zinc/44/16/74/529441674.db2.gz PLIGNIHKOYSCMR-RRFJBIMHSA-N 1 1 241.419 3.558 20 0 BHADMO CC[C@@H]1C[C@@H](C[N@@H+](CC)[C@@H](C)C(C)C)CCO1 ZINC000507805216 529425657 /nfs/dbraw/zinc/42/56/57/529425657.db2.gz 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226371460 /nfs/dbraw/zinc/37/14/60/226371460.db2.gz JPLXGUDKGOHKEJ-LHRNQBEKSA-N 1 1 241.378 3.963 20 0 BHADMO C[C@@H](C1CC1)[N@@H+](C/C=C\c1ccccc1)C1CC1 ZINC000508013979 226371480 /nfs/dbraw/zinc/37/14/80/226371480.db2.gz JPLXGUDKGOHKEJ-PODYEWJSSA-N 1 1 241.378 3.963 20 0 BHADMO Cc1ccc(C[N@H+]([C@H](C)C2CC2)C2CC2)cc1 ZINC000508013982 533905725 /nfs/dbraw/zinc/90/57/25/533905725.db2.gz JQFANFKJBLZTIF-CYBMUJFWSA-N 1 1 229.367 3.758 20 0 BHADMO Cc1ccc(C[N@H+]([C@@H](C)C2CC2)C2CC2)cc1 ZINC000508013984 533907629 /nfs/dbraw/zinc/90/76/29/533907629.db2.gz JQFANFKJBLZTIF-ZDUSSCGKSA-N 1 1 229.367 3.758 20 0 BHADMO CC(C)[N@@H+](Cc1ccc(F)cc1Cl)C1CC1 ZINC000508015197 528940509 /nfs/dbraw/zinc/94/05/09/528940509.db2.gz WLSHYGJPMDOHKV-UHFFFAOYSA-N 1 1 241.737 3.852 20 0 BHADMO Cc1ccc(C[N@H+](C(C)C)C2CC2)c(C)c1 ZINC000508015580 533842828 /nfs/dbraw/zinc/84/28/28/533842828.db2.gz XZGTVHCFFAQFCU-UHFFFAOYSA-N 1 1 217.356 3.676 20 0 BHADMO C/C(=C/c1ccccc1)C[N@H+](C(C)C)C1CC1 ZINC000508015903 527502491 /nfs/dbraw/zinc/50/24/91/527502491.db2.gz ZWUWVRKZCQHLHD-KAMYIIQDSA-N 1 1 229.367 3.963 20 0 BHADMO C/C(=C\c1ccccc1)C[N@H+](C(C)C)C1CC1 ZINC000508015904 527530414 /nfs/dbraw/zinc/53/04/14/527530414.db2.gz ZWUWVRKZCQHLHD-SDNWHVSQSA-N 1 1 229.367 3.963 20 0 BHADMO COc1ccc(C[N@@H+](C)[C@H](C)CC(C)C)cc1 ZINC000508020477 226371646 /nfs/dbraw/zinc/37/16/46/226371646.db2.gz HKJBMNGEONTFQW-CYBMUJFWSA-N 1 1 235.371 3.562 20 0 BHADMO COc1ccc(C[N@@H+](C)[C@@H](C)CC(C)C)cc1 ZINC000508020478 226371468 /nfs/dbraw/zinc/37/14/68/226371468.db2.gz HKJBMNGEONTFQW-ZDUSSCGKSA-N 1 1 235.371 3.562 20 0 BHADMO CC(C)C[N@@H+](C[C@@H]1C[C@@H]1c1ccccc1)C1CC1 ZINC000508020764 527943191 /nfs/dbraw/zinc/94/31/91/527943191.db2.gz JFUVEIXRQXMKAS-DOTOQJQBSA-N 1 1 243.394 3.911 20 0 BHADMO CC(C)C[N@@H+](C[C@H]1C[C@@H]1c1ccccc1)C1CC1 ZINC000508020768 527945587 /nfs/dbraw/zinc/94/55/87/527945587.db2.gz JFUVEIXRQXMKAS-NVXWUHKLSA-N 1 1 243.394 3.911 20 0 BHADMO CC(C)C[N@@H+](C[C@H]1C[C@H]1c1ccccc1)C1CC1 ZINC000508020769 527945075 /nfs/dbraw/zinc/94/50/75/527945075.db2.gz JFUVEIXRQXMKAS-WBVHZDCISA-N 1 1 243.394 3.911 20 0 BHADMO CC(C)C[C@H](C)[N@@H+](C)Cc1ccccc1N(C)C ZINC000508021644 528468034 /nfs/dbraw/zinc/46/80/34/528468034.db2.gz OIOILDBRYSQPRL-AWEZNQCLSA-N 1 1 248.414 3.619 20 0 BHADMO CC(C)C[C@@H](C)[N@@H+](C)Cc1ccccc1N(C)C ZINC000508021645 528258537 /nfs/dbraw/zinc/25/85/37/528258537.db2.gz OIOILDBRYSQPRL-CQSZACIVSA-N 1 1 248.414 3.619 20 0 BHADMO CC(C)C[C@@H](C)[N@@H+](C)Cc1cccc(F)c1 ZINC000508023780 528259039 /nfs/dbraw/zinc/25/90/39/528259039.db2.gz AGXDIWAIRODCFH-GFCCVEGCSA-N 1 1 223.335 3.692 20 0 BHADMO CC(C)C[C@H](C)[N@@H+](C)Cc1cccc(F)c1 ZINC000508023781 528468329 /nfs/dbraw/zinc/46/83/29/528468329.db2.gz AGXDIWAIRODCFH-LBPRGKRZSA-N 1 1 223.335 3.692 20 0 BHADMO Cc1ccsc1C[N@H+](CC(C)C)C1CC1 ZINC000508023930 534469433 /nfs/dbraw/zinc/46/94/33/534469433.db2.gz CUWLSWYWQKCPOG-UHFFFAOYSA-N 1 1 223.385 3.677 20 0 BHADMO CC(C)[N@@H+](Cc1cc(Cl)ccc1F)C1CC1 ZINC000508024717 528936384 /nfs/dbraw/zinc/93/63/84/528936384.db2.gz DTILFTKMEGYWLD-UHFFFAOYSA-N 1 1 241.737 3.852 20 0 BHADMO Cc1ccc(C[N@H+](C(C)C)C2CC2)cc1C ZINC000508025965 533841556 /nfs/dbraw/zinc/84/15/56/533841556.db2.gz IKYUNYPWUQXQIX-UHFFFAOYSA-N 1 1 217.356 3.676 20 0 BHADMO CC(C)C[C@@H](C)[N@@H+](C)Cc1ccccc1F ZINC000508028521 528258329 /nfs/dbraw/zinc/25/83/29/528258329.db2.gz QMUYVNQSPUSUNC-GFCCVEGCSA-N 1 1 223.335 3.692 20 0 BHADMO CC(C)C[C@H](C)[N@@H+](C)Cc1ccccc1F ZINC000508028522 528467637 /nfs/dbraw/zinc/46/76/37/528467637.db2.gz QMUYVNQSPUSUNC-LBPRGKRZSA-N 1 1 223.335 3.692 20 0 BHADMO CC(C)C[C@@H](C)[N@@H+](C)Cc1ccc(F)cc1 ZINC000508029140 528258521 /nfs/dbraw/zinc/25/85/21/528258521.db2.gz SVGFIVYIBXMSTR-GFCCVEGCSA-N 1 1 223.335 3.692 20 0 BHADMO CC(C)C[C@H](C)[N@@H+](C)Cc1ccc(F)cc1 ZINC000508029142 528467851 /nfs/dbraw/zinc/46/78/51/528467851.db2.gz SVGFIVYIBXMSTR-LBPRGKRZSA-N 1 1 223.335 3.692 20 0 BHADMO Cc1cccc(C[N@H+]([C@H](C)C2CC2)C2CC2)c1 ZINC000508035740 226371723 /nfs/dbraw/zinc/37/17/23/226371723.db2.gz AIAWOXYZAIUABY-CYBMUJFWSA-N 1 1 229.367 3.758 20 0 BHADMO Cc1cccc(C[N@H+]([C@@H](C)C2CC2)C2CC2)c1 ZINC000508035742 226371721 /nfs/dbraw/zinc/37/17/21/226371721.db2.gz AIAWOXYZAIUABY-ZDUSSCGKSA-N 1 1 229.367 3.758 20 0 BHADMO CC(C)C[C@@H](C)[N@@H+](C)Cc1ccc(F)c(F)c1 ZINC000508037831 528258675 /nfs/dbraw/zinc/25/86/75/528258675.db2.gz AXFBOINLYFBPDK-LLVKDONJSA-N 1 1 241.325 3.831 20 0 BHADMO CC(C)C[C@H](C)[N@@H+](C)Cc1ccc(F)c(F)c1 ZINC000508037837 528467418 /nfs/dbraw/zinc/46/74/18/528467418.db2.gz AXFBOINLYFBPDK-NSHDSACASA-N 1 1 241.325 3.831 20 0 BHADMO Cc1ccsc1C[N@H+](C)[C@H](C)CC(C)C ZINC000508038184 534469718 /nfs/dbraw/zinc/46/97/18/534469718.db2.gz BTWVJMHYDXWZBR-GFCCVEGCSA-N 1 1 225.401 3.923 20 0 BHADMO Cc1ccsc1C[N@H+](C)[C@@H](C)CC(C)C ZINC000508038230 534470499 /nfs/dbraw/zinc/47/04/99/534470499.db2.gz BTWVJMHYDXWZBR-LBPRGKRZSA-N 1 1 225.401 3.923 20 0 BHADMO CCc1ccc(C[N@@H+](C(C)C)C2CC2)cc1 ZINC000508038934 529631572 /nfs/dbraw/zinc/63/15/72/529631572.db2.gz DOARZRLPLALWNY-UHFFFAOYSA-N 1 1 217.356 3.622 20 0 BHADMO CC(C)C[C@H](C)[N@@H+](C)C[C@H]1CC=CCC1 ZINC000508039045 528467942 /nfs/dbraw/zinc/46/79/42/528467942.db2.gz FTMBLBDVZJOMBJ-KBPBESRZSA-N 1 1 209.377 3.709 20 0 BHADMO CC(C)C[C@@H](C)[N@@H+](C)C[C@H]1CC=CCC1 ZINC000508039046 528259160 /nfs/dbraw/zinc/25/91/60/528259160.db2.gz FTMBLBDVZJOMBJ-KGLIPLIRSA-N 1 1 209.377 3.709 20 0 BHADMO CC(C)C[C@H](C)[N@@H+](C)C[C@@H]1CC=CCC1 ZINC000508039047 528467187 /nfs/dbraw/zinc/46/71/87/528467187.db2.gz FTMBLBDVZJOMBJ-UONOGXRCSA-N 1 1 209.377 3.709 20 0 BHADMO CC(C)C[C@@H](C)[N@@H+](C)C[C@@H]1CC=CCC1 ZINC000508039048 528258917 /nfs/dbraw/zinc/25/89/17/528258917.db2.gz FTMBLBDVZJOMBJ-ZIAGYGMSSA-N 1 1 209.377 3.709 20 0 BHADMO Cc1ccc(C)c(C[N@H+](C(C)C)C2CC2)c1 ZINC000508039158 226371567 /nfs/dbraw/zinc/37/15/67/226371567.db2.gz PAQRMJSPVRPYEN-UHFFFAOYSA-N 1 1 217.356 3.676 20 0 BHADMO CC(C)[N@@H+](Cc1cccc(Cl)c1F)C1CC1 ZINC000508041942 528943823 /nfs/dbraw/zinc/94/38/23/528943823.db2.gz NNJMHDKXVWZJFI-UHFFFAOYSA-N 1 1 241.737 3.852 20 0 BHADMO Cc1ccc(C[N@H+]([C@H](C)C2CC2)C2CC2)cc1F ZINC000508043131 533907049 /nfs/dbraw/zinc/90/70/49/533907049.db2.gz SZMLHKOETMTIMV-GFCCVEGCSA-N 1 1 247.357 3.897 20 0 BHADMO Cc1ccc(C[N@H+]([C@@H](C)C2CC2)C2CC2)cc1F ZINC000508043133 533906260 /nfs/dbraw/zinc/90/62/60/533906260.db2.gz SZMLHKOETMTIMV-LBPRGKRZSA-N 1 1 247.357 3.897 20 0 BHADMO CCC(CC)C[N@@H+]([C@H](C)C1CC1)C1CC1 ZINC000508043277 528751808 /nfs/dbraw/zinc/75/18/08/528751808.db2.gz ULLXKUWHRUAMJF-LLVKDONJSA-N 1 1 209.377 3.686 20 0 BHADMO CCC(CC)C[N@@H+]([C@@H](C)C1CC1)C1CC1 ZINC000508043278 528751438 /nfs/dbraw/zinc/75/14/38/528751438.db2.gz ULLXKUWHRUAMJF-NSHDSACASA-N 1 1 209.377 3.686 20 0 BHADMO CC(C)[N@@H+](Cc1ccc(Cl)c(F)c1)C1CC1 ZINC000508043431 528939695 /nfs/dbraw/zinc/93/96/95/528939695.db2.gz WBBKHCDKJSHKPR-UHFFFAOYSA-N 1 1 241.737 3.852 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@H](C)CC(C)C)s1 ZINC000508051943 226371739 /nfs/dbraw/zinc/37/17/39/226371739.db2.gz JHNCLSGJBFAOMT-LLVKDONJSA-N 1 1 225.401 3.923 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@@H](C)CC(C)C)s1 ZINC000508051944 226371844 /nfs/dbraw/zinc/37/18/44/226371844.db2.gz JHNCLSGJBFAOMT-NSHDSACASA-N 1 1 225.401 3.923 20 0 BHADMO COc1ccccc1C[N@@H+](C)[C@H](C)CC(C)C ZINC000508053956 534062208 /nfs/dbraw/zinc/06/22/08/534062208.db2.gz SDQALERTPOZEAA-CYBMUJFWSA-N 1 1 235.371 3.562 20 0 BHADMO COc1ccccc1C[N@@H+](C)[C@@H](C)CC(C)C ZINC000508053957 534062496 /nfs/dbraw/zinc/06/24/96/534062496.db2.gz SDQALERTPOZEAA-ZDUSSCGKSA-N 1 1 235.371 3.562 20 0 BHADMO CC(C)C[C@@H](C)[N@@H+](C)Cc1cccs1 ZINC000508054806 528258436 /nfs/dbraw/zinc/25/84/36/528258436.db2.gz QAIXWTFGMVQCAV-LLVKDONJSA-N 1 1 211.374 3.615 20 0 BHADMO CC(C)C[C@H](C)[N@@H+](C)Cc1cccs1 ZINC000508054807 528468223 /nfs/dbraw/zinc/46/82/23/528468223.db2.gz QAIXWTFGMVQCAV-NSHDSACASA-N 1 1 211.374 3.615 20 0 BHADMO Cc1cc(Cl)cc(C[N@@H+]2CCC[C@H]2C)c1 ZINC000508492006 226373020 /nfs/dbraw/zinc/37/30/20/226373020.db2.gz UODLDGKZLQNYMN-LLVKDONJSA-N 1 1 223.747 3.633 20 0 BHADMO Cc1cc(Cl)cc(C[N@@H+]2CCC[C@@H]2C)c1 ZINC000508492016 226373062 /nfs/dbraw/zinc/37/30/62/226373062.db2.gz UODLDGKZLQNYMN-NSHDSACASA-N 1 1 223.747 3.633 20 0 BHADMO CCCC[N@@H+](Cc1cn[nH]c1C)C1CCCCC1 ZINC000508506311 528441424 /nfs/dbraw/zinc/44/14/24/528441424.db2.gz RIBFVYLPEGXLJX-UHFFFAOYSA-N 1 1 249.402 3.653 20 0 BHADMO CCCC[N@H+](Cc1cn[nH]c1C)C1CCCCC1 ZINC000508506311 528441418 /nfs/dbraw/zinc/44/14/18/528441418.db2.gz RIBFVYLPEGXLJX-UHFFFAOYSA-N 1 1 249.402 3.653 20 0 BHADMO CCCC[N@@H+](Cc1c[nH]nc1C)C1CCCCC1 ZINC000508506311 528441407 /nfs/dbraw/zinc/44/14/07/528441407.db2.gz RIBFVYLPEGXLJX-UHFFFAOYSA-N 1 1 249.402 3.653 20 0 BHADMO CC(C)C[N@@H+](Cc1ccc(F)c(F)c1)C(C)C ZINC000508517464 527944882 /nfs/dbraw/zinc/94/48/82/527944882.db2.gz HIXVMFNCMNFVCR-UHFFFAOYSA-N 1 1 241.325 3.831 20 0 BHADMO CCOc1ccc(C[N@@H+](CC2CC2)C(C)C)cc1 ZINC000508544582 528432025 /nfs/dbraw/zinc/43/20/25/528432025.db2.gz YYTKBCIKYIRGFS-UHFFFAOYSA-N 1 1 247.382 3.706 20 0 BHADMO COc1ccccc1C[N@@H+](CC(C)C)C(C)C ZINC000508577676 534062817 /nfs/dbraw/zinc/06/28/17/534062817.db2.gz ITUADPCODMHYQM-UHFFFAOYSA-N 1 1 235.371 3.562 20 0 BHADMO CCC[N@H+](Cc1ccccc1OC)CC(C)C ZINC000508579918 528149063 /nfs/dbraw/zinc/14/90/63/528149063.db2.gz CYHKIBAHLYWWHZ-UHFFFAOYSA-N 1 1 235.371 3.563 20 0 BHADMO CCC[N@H+](Cc1ccc(Cl)o1)CC(C)C ZINC000508581197 528136469 /nfs/dbraw/zinc/13/64/69/528136469.db2.gz HUILNENWPLCQFH-UHFFFAOYSA-N 1 1 229.751 3.801 20 0 BHADMO CCC[N@H+](Cc1cccc(COC)c1)CC(C)C ZINC000508583117 528140706 /nfs/dbraw/zinc/14/07/06/528140706.db2.gz PEVVJAJIQDYCII-UHFFFAOYSA-N 1 1 249.398 3.701 20 0 BHADMO CCC[N@H+](Cc1cccs1)CC(C)C ZINC000508585270 528149854 /nfs/dbraw/zinc/14/98/54/528149854.db2.gz CBKMKYRTEKPINU-UHFFFAOYSA-N 1 1 211.374 3.616 20 0 BHADMO CCC[N@H+](Cc1ccc(F)cc1F)CC1CC1 ZINC000508590462 528139836 /nfs/dbraw/zinc/13/98/36/528139836.db2.gz WJMNTRNHOUZHFV-UHFFFAOYSA-N 1 1 239.309 3.587 20 0 BHADMO C[N@@H+](CCC1=CCCCC1)CC1CCC1 ZINC000508591784 529875492 /nfs/dbraw/zinc/87/54/92/529875492.db2.gz ZXPQIISDKFHDBC-UHFFFAOYSA-N 1 1 207.361 3.609 20 0 BHADMO CCC(CC)C[N@@H+](CC)Cc1ccc(C)cn1 ZINC000508593879 528743321 /nfs/dbraw/zinc/74/33/21/528743321.db2.gz HAUYEVXJOMWPPV-UHFFFAOYSA-N 1 1 234.387 3.648 20 0 BHADMO Cc1sccc1C[N@@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC000508596261 226373237 /nfs/dbraw/zinc/37/32/37/226373237.db2.gz RJDBPRHVLPESIU-OKILXGFUSA-N 1 1 235.396 3.679 20 0 BHADMO CCC[N@H+](Cc1sccc1OC)CC(C)C ZINC000508601094 528156777 /nfs/dbraw/zinc/15/67/77/528156777.db2.gz SQOBWXLRKNIUID-UHFFFAOYSA-N 1 1 241.400 3.625 20 0 BHADMO CC[N@H+](Cc1ccc(C)cc1C)CC1CC1 ZINC000508602025 528777363 /nfs/dbraw/zinc/77/73/63/528777363.db2.gz BSBTZWQQKYOXRZ-UHFFFAOYSA-N 1 1 217.356 3.535 20 0 BHADMO CCC[N@@H+](CC1CC1)[C@H]1CCc2ccccc21 ZINC000508608853 528029384 /nfs/dbraw/zinc/02/93/84/528029384.db2.gz MUUKUWQKXFDNFO-INIZCTEOSA-N 1 1 229.367 3.796 20 0 BHADMO CCC[N@@H+](CC1CC1)[C@@H]1CCc2ccccc21 ZINC000508608856 528028795 /nfs/dbraw/zinc/02/87/95/528028795.db2.gz MUUKUWQKXFDNFO-MRXNPFEDSA-N 1 1 229.367 3.796 20 0 BHADMO CCC[N@H+](Cc1ccc(OC)cc1)CC(C)C ZINC000508610349 528139739 /nfs/dbraw/zinc/13/97/39/528139739.db2.gz WNRNCUQKJPDENT-UHFFFAOYSA-N 1 1 235.371 3.563 20 0 BHADMO C[N@@H+](Cc1ccc(C2CCC2)cc1)C1CCC1 ZINC000508616146 529984432 /nfs/dbraw/zinc/98/44/32/529984432.db2.gz SZSQULAYUQZIJS-UHFFFAOYSA-N 1 1 229.367 3.938 20 0 BHADMO CCC[N@@H+](CC1CC1)[C@H](C)c1ccccc1OC ZINC000508630385 528029282 /nfs/dbraw/zinc/02/92/82/528029282.db2.gz DVNWUHJHRHPGEI-CYBMUJFWSA-N 1 1 247.382 3.878 20 0 BHADMO CCC[N@@H+](CC1CC1)[C@@H](C)c1ccccc1OC ZINC000508630391 528028516 /nfs/dbraw/zinc/02/85/16/528028516.db2.gz DVNWUHJHRHPGEI-ZDUSSCGKSA-N 1 1 247.382 3.878 20 0 BHADMO CC[C@H]1C[C@H](C)C[N@H+]1Cc1ccsc1C ZINC000508634489 529325568 /nfs/dbraw/zinc/32/55/68/529325568.db2.gz GCCNIWYXPSJXOP-GWCFXTLKSA-N 1 1 223.385 3.677 20 0 BHADMO CC[C@@H]1C[C@H](C)C[N@H+]1Cc1ccsc1C ZINC000508634498 529439955 /nfs/dbraw/zinc/43/99/55/529439955.db2.gz GCCNIWYXPSJXOP-GXFFZTMASA-N 1 1 223.385 3.677 20 0 BHADMO CC[C@H]1C[C@@H](C)C[N@H+]1Cc1ccsc1C ZINC000508634500 529316334 /nfs/dbraw/zinc/31/63/34/529316334.db2.gz GCCNIWYXPSJXOP-MFKMUULPSA-N 1 1 223.385 3.677 20 0 BHADMO CC[C@@H]1C[C@@H](C)C[N@H+]1Cc1ccsc1C ZINC000508634503 529423265 /nfs/dbraw/zinc/42/32/65/529423265.db2.gz GCCNIWYXPSJXOP-ZWNOBZJWSA-N 1 1 223.385 3.677 20 0 BHADMO C/C(=C/c1ccccc1)C[N@H+]1CCCSCC1 ZINC000508635638 527506703 /nfs/dbraw/zinc/50/67/03/527506703.db2.gz CHBVKAYZGKVIEV-OWBHPGMISA-N 1 1 247.407 3.529 20 0 BHADMO C/C(=C\c1ccccc1)C[N@H+]1CCCSCC1 ZINC000508635645 527533033 /nfs/dbraw/zinc/53/30/33/527533033.db2.gz CHBVKAYZGKVIEV-WYMLVPIESA-N 1 1 247.407 3.529 20 0 BHADMO CC[N@@H+](Cc1ccccc1OC)CC(C)(C)C ZINC000508644357 528842462 /nfs/dbraw/zinc/84/24/62/528842462.db2.gz VSTAJVULSIRDGO-UHFFFAOYSA-N 1 1 235.371 3.563 20 0 BHADMO CCC[N@H+](Cc1ccc(OCC)cc1)CC1CC1 ZINC000508672299 528139225 /nfs/dbraw/zinc/13/92/25/528139225.db2.gz RGNOYSPNYXPDFU-UHFFFAOYSA-N 1 1 247.382 3.707 20 0 BHADMO CC[N@@H+](CCc1ccc(OC)cc1)CC(C)(C)C ZINC000508709024 528586760 /nfs/dbraw/zinc/58/67/60/528586760.db2.gz GSLNQWYQQHDMHL-UHFFFAOYSA-N 1 1 249.398 3.606 20 0 BHADMO CC[N@@H+](CCc1cccs1)C[C@H]1CC=CCC1 ZINC000508710126 528599041 /nfs/dbraw/zinc/59/90/41/528599041.db2.gz SEIBNXBHMJFPIM-AWEZNQCLSA-N 1 1 249.423 3.969 20 0 BHADMO CC[N@@H+](CCc1cccs1)C[C@@H]1CC=CCC1 ZINC000508710130 528596887 /nfs/dbraw/zinc/59/68/87/528596887.db2.gz SEIBNXBHMJFPIM-CQSZACIVSA-N 1 1 249.423 3.969 20 0 BHADMO COc1ccc(CC[N@@H+](CC(C)C)C(C)C)cc1 ZINC000508710181 533477440 /nfs/dbraw/zinc/47/74/40/533477440.db2.gz SRUIIVPVNWIYPH-UHFFFAOYSA-N 1 1 249.398 3.604 20 0 BHADMO CC[C@@H](C[N@@H+](CC)[C@H](C)COC)c1ccccc1 ZINC000508725387 529472752 /nfs/dbraw/zinc/47/27/52/529472752.db2.gz HNBPMSCGETWRIQ-CABCVRRESA-N 1 1 249.398 3.537 20 0 BHADMO CC[C@@H](C[N@@H+](CC)[C@@H](C)COC)c1ccccc1 ZINC000508725388 529472207 /nfs/dbraw/zinc/47/22/07/529472207.db2.gz HNBPMSCGETWRIQ-GJZGRUSLSA-N 1 1 249.398 3.537 20 0 BHADMO CC[C@H](C[N@@H+](CC)[C@H](C)COC)c1ccccc1 ZINC000508725389 529334329 /nfs/dbraw/zinc/33/43/29/529334329.db2.gz HNBPMSCGETWRIQ-HUUCEWRRSA-N 1 1 249.398 3.537 20 0 BHADMO CC[C@H](C[N@@H+](CC)[C@@H](C)COC)c1ccccc1 ZINC000508725390 529334684 /nfs/dbraw/zinc/33/46/84/529334684.db2.gz HNBPMSCGETWRIQ-LSDHHAIUSA-N 1 1 249.398 3.537 20 0 BHADMO CC[N@@H+](CCc1cccs1)CC(C)(C)C ZINC000508734793 528596964 /nfs/dbraw/zinc/59/69/64/528596964.db2.gz PWEFIZOCGSZURF-UHFFFAOYSA-N 1 1 225.401 3.659 20 0 BHADMO Cc1cc(Cl)cc(C[N@H+]2CCC23CCC3)c1 ZINC000508747299 226373707 /nfs/dbraw/zinc/37/37/07/226373707.db2.gz MONPVOBDWDEEPK-UHFFFAOYSA-N 1 1 235.758 3.777 20 0 BHADMO CC(C)C[N@H+](Cc1ccccc1)CC1CC1 ZINC000508748702 527948088 /nfs/dbraw/zinc/94/80/88/527948088.db2.gz SIRQHRQTKJQFNH-UHFFFAOYSA-N 1 1 217.356 3.555 20 0 BHADMO CC(C)CC[N@@H+](Cc1ccccn1)C1CCCC1 ZINC000508822473 527719884 /nfs/dbraw/zinc/71/98/84/527719884.db2.gz OGQHGCCGRGBBRP-UHFFFAOYSA-N 1 1 246.398 3.872 20 0 BHADMO CC(C)CC[N@@H+](Cc1ccncc1)C1CCCC1 ZINC000508837334 527720794 /nfs/dbraw/zinc/72/07/94/527720794.db2.gz LXFCUELUFVJTAM-UHFFFAOYSA-N 1 1 246.398 3.872 20 0 BHADMO CC(C)CC[N@@H+](CC1CC1)C1CCCC1 ZINC000508838032 527711372 /nfs/dbraw/zinc/71/13/72/527711372.db2.gz HOTHFXVPWRWUBI-UHFFFAOYSA-N 1 1 209.377 3.687 20 0 BHADMO Cc1ccc(C[N@@H+](C)Cc2ccccc2)c(C)c1 ZINC000508895752 533876542 /nfs/dbraw/zinc/87/65/42/533876542.db2.gz XPISRDBBPOVKGL-UHFFFAOYSA-N 1 1 239.362 3.935 20 0 BHADMO C[C@H](F)CC[N@H+]1C[C@H](c2ccccc2)C(C)(C)C1 ZINC000508960796 226373854 /nfs/dbraw/zinc/37/38/54/226373854.db2.gz AKAYEWONTIVPHG-DZGCQCFKSA-N 1 1 249.373 3.860 20 0 BHADMO C[C@@H](F)CC[N@H+]1C[C@@H](c2ccccc2)C(C)(C)C1 ZINC000508960797 534277426 /nfs/dbraw/zinc/27/74/26/534277426.db2.gz AKAYEWONTIVPHG-HIFRSBDPSA-N 1 1 249.373 3.860 20 0 BHADMO C[C@@H](F)CC[N@H+]1C[C@H](c2ccccc2)C(C)(C)C1 ZINC000508960798 534276982 /nfs/dbraw/zinc/27/69/82/534276982.db2.gz AKAYEWONTIVPHG-UKRRQHHQSA-N 1 1 249.373 3.860 20 0 BHADMO C[C@H](F)CC[N@H+]1C[C@@H](c2ccccc2)C(C)(C)C1 ZINC000508960799 226373926 /nfs/dbraw/zinc/37/39/26/226373926.db2.gz AKAYEWONTIVPHG-ZFWWWQNUSA-N 1 1 249.373 3.860 20 0 BHADMO CC1(C)C[N@@H+](CCCCF)C[C@H]1c1ccccc1 ZINC000508962312 529117668 /nfs/dbraw/zinc/11/76/68/529117668.db2.gz JBEILBIAAJYCOT-HNNXBMFYSA-N 1 1 249.373 3.862 20 0 BHADMO CC1(C)C[N@@H+](CCCCF)C[C@@H]1c1ccccc1 ZINC000508962314 386200998 /nfs/dbraw/zinc/20/09/98/386200998.db2.gz JBEILBIAAJYCOT-OAHLLOKOSA-N 1 1 249.373 3.862 20 0 BHADMO Cc1cccc(C2=CC[N@@H+](CCCCF)CC2)c1 ZINC000508966649 226373831 /nfs/dbraw/zinc/37/38/31/226373831.db2.gz QDZZNZWAQYDUIG-UHFFFAOYSA-N 1 1 247.357 3.834 20 0 BHADMO Cc1cccc(C2=CC[N@@H+](CC[C@H](C)F)CC2)c1 ZINC000508968181 226373883 /nfs/dbraw/zinc/37/38/83/226373883.db2.gz VNMNZMWHWALBDT-AWEZNQCLSA-N 1 1 247.357 3.832 20 0 BHADMO Cc1cccc(C2=CC[N@@H+](CC[C@@H](C)F)CC2)c1 ZINC000508968182 226373953 /nfs/dbraw/zinc/37/39/53/226373953.db2.gz VNMNZMWHWALBDT-CQSZACIVSA-N 1 1 247.357 3.832 20 0 BHADMO Cc1cccc([C@H]2CC[N@@H+](CCCCF)C2)c1 ZINC000508976279 226373829 /nfs/dbraw/zinc/37/38/29/226373829.db2.gz ICSCGKSZBBRHKJ-HNNXBMFYSA-N 1 1 235.346 3.534 20 0 BHADMO Cc1cccc([C@@H]2CC[N@@H+](CCCCF)C2)c1 ZINC000508976287 226373876 /nfs/dbraw/zinc/37/38/76/226373876.db2.gz ICSCGKSZBBRHKJ-OAHLLOKOSA-N 1 1 235.346 3.534 20 0 BHADMO Cc1cccc([C@@H]2CC[N@H+](CC[C@H](C)F)C2)c1 ZINC000508978649 226373857 /nfs/dbraw/zinc/37/38/57/226373857.db2.gz QTRFJFNPCMYZFW-DZGCQCFKSA-N 1 1 235.346 3.532 20 0 BHADMO Cc1cccc([C@H]2CC[N@H+](CC[C@@H](C)F)C2)c1 ZINC000508978651 226373973 /nfs/dbraw/zinc/37/39/73/226373973.db2.gz QTRFJFNPCMYZFW-HIFRSBDPSA-N 1 1 235.346 3.532 20 0 BHADMO Cc1cccc([C@@H]2CC[N@H+](CC[C@@H](C)F)C2)c1 ZINC000508978652 226374033 /nfs/dbraw/zinc/37/40/33/226374033.db2.gz QTRFJFNPCMYZFW-UKRRQHHQSA-N 1 1 235.346 3.532 20 0 BHADMO Cc1cccc([C@H]2CC[N@H+](CC[C@H](C)F)C2)c1 ZINC000508978654 226373897 /nfs/dbraw/zinc/37/38/97/226373897.db2.gz QTRFJFNPCMYZFW-ZFWWWQNUSA-N 1 1 235.346 3.532 20 0 BHADMO Cc1cc(C)cc([C@H]2CC[N@@H+](CCCCF)C2)c1 ZINC000508989666 226374059 /nfs/dbraw/zinc/37/40/59/226374059.db2.gz CUHXEZKWUHIZJS-HNNXBMFYSA-N 1 1 249.373 3.842 20 0 BHADMO Cc1cc(C)cc([C@@H]2CC[N@@H+](CCCCF)C2)c1 ZINC000508989667 226374086 /nfs/dbraw/zinc/37/40/86/226374086.db2.gz CUHXEZKWUHIZJS-OAHLLOKOSA-N 1 1 249.373 3.842 20 0 BHADMO Cc1cc(C)cc([C@H]2CC[N@H+](CC[C@@H](C)F)C2)c1 ZINC000508990594 226374103 /nfs/dbraw/zinc/37/41/03/226374103.db2.gz LFVGTTDDAAVWOT-CABCVRRESA-N 1 1 249.373 3.841 20 0 BHADMO Cc1cc(C)cc([C@H]2CC[N@H+](CC[C@H](C)F)C2)c1 ZINC000508990595 226374164 /nfs/dbraw/zinc/37/41/64/226374164.db2.gz LFVGTTDDAAVWOT-GJZGRUSLSA-N 1 1 249.373 3.841 20 0 BHADMO Cc1cc(C)cc([C@@H]2CC[N@H+](CC[C@@H](C)F)C2)c1 ZINC000508990596 226374135 /nfs/dbraw/zinc/37/41/35/226374135.db2.gz LFVGTTDDAAVWOT-HUUCEWRRSA-N 1 1 249.373 3.841 20 0 BHADMO Cc1cc(C)cc([C@@H]2CC[N@H+](CC[C@H](C)F)C2)c1 ZINC000508990597 226374071 /nfs/dbraw/zinc/37/40/71/226374071.db2.gz LFVGTTDDAAVWOT-LSDHHAIUSA-N 1 1 249.373 3.841 20 0 BHADMO C[C@@H](F)CC[N@H+]1Cc2ccccc2C(C)(C)C1 ZINC000508990825 534277410 /nfs/dbraw/zinc/27/74/10/534277410.db2.gz KDIVHDIMULZKOZ-GFCCVEGCSA-N 1 1 235.346 3.528 20 0 BHADMO C[C@H](F)CC[N@H+]1Cc2ccccc2C(C)(C)C1 ZINC000508990826 226374089 /nfs/dbraw/zinc/37/40/89/226374089.db2.gz KDIVHDIMULZKOZ-LBPRGKRZSA-N 1 1 235.346 3.528 20 0 BHADMO COCCCC[N@H+]1CCCC[C@H]1CCC(C)C ZINC000509005303 229261186 /nfs/dbraw/zinc/26/11/86/229261186.db2.gz AYADQNHZMVVWDL-HNNXBMFYSA-N 1 1 241.419 3.704 20 0 BHADMO COCCCC[N@H+]1CCCC[C@@H]1CCC(C)C ZINC000509005306 229261499 /nfs/dbraw/zinc/26/14/99/229261499.db2.gz AYADQNHZMVVWDL-OAHLLOKOSA-N 1 1 241.419 3.704 20 0 BHADMO CC1(C)C[N@@H+](CCCCF)Cc2ccccc21 ZINC000509007571 529117729 /nfs/dbraw/zinc/11/77/29/529117729.db2.gz SMUHPIXWTGQPQI-UHFFFAOYSA-N 1 1 235.346 3.530 20 0 BHADMO C[C@H](F)CC[N@H+]1CCC[C@@H]1/C=C\c1ccccc1 ZINC000509007713 229261328 /nfs/dbraw/zinc/26/13/28/229261328.db2.gz JLIJMHFQFJVOKC-JMBLZNSLSA-N 1 1 247.357 3.912 20 0 BHADMO C[C@H](F)CC[N@H+]1CCC[C@@H]1/C=C/c1ccccc1 ZINC000509007715 229261004 /nfs/dbraw/zinc/26/10/04/229261004.db2.gz JLIJMHFQFJVOKC-KTMLPXRHSA-N 1 1 247.357 3.912 20 0 BHADMO C[C@H](F)CC[N@H+]1CCC[C@H]1/C=C/c1ccccc1 ZINC000509007717 229261544 /nfs/dbraw/zinc/26/15/44/229261544.db2.gz JLIJMHFQFJVOKC-OOCSTFOJSA-N 1 1 247.357 3.912 20 0 BHADMO C[C@H](F)CC[N@H+]1CCC[C@H]1/C=C\c1ccccc1 ZINC000509007718 229261176 /nfs/dbraw/zinc/26/11/76/229261176.db2.gz JLIJMHFQFJVOKC-SYMMMWLZSA-N 1 1 247.357 3.912 20 0 BHADMO FCCCC[N@H+]1CCC[C@@H]1/C=C\c1ccccc1 ZINC000509009192 229261082 /nfs/dbraw/zinc/26/10/82/229261082.db2.gz YQMDNIBMYPQVEI-BLIJAFNYSA-N 1 1 247.357 3.914 20 0 BHADMO FCCCC[N@H+]1CCC[C@H]1/C=C/c1ccccc1 ZINC000509009193 229261525 /nfs/dbraw/zinc/26/15/25/229261525.db2.gz YQMDNIBMYPQVEI-OFAQMXQXSA-N 1 1 247.357 3.914 20 0 BHADMO FCCCC[N@H+]1CCC[C@@H]1/C=C/c1ccccc1 ZINC000509009194 229261559 /nfs/dbraw/zinc/26/15/59/229261559.db2.gz YQMDNIBMYPQVEI-SIFUEBAJSA-N 1 1 247.357 3.914 20 0 BHADMO FCCCC[N@H+]1CCC[C@H]1/C=C\c1ccccc1 ZINC000509009195 229261319 /nfs/dbraw/zinc/26/13/19/229261319.db2.gz YQMDNIBMYPQVEI-SNGWPZLWSA-N 1 1 247.357 3.914 20 0 BHADMO C[C@@H](F)CC[N@H+]1CCCC12CCCCC2 ZINC000509019959 534276557 /nfs/dbraw/zinc/27/65/57/534276557.db2.gz ATTIJHQDGBBPQF-GFCCVEGCSA-N 1 1 213.340 3.533 20 0 BHADMO C[C@H](F)CC[N@H+]1CCCC12CCCCC2 ZINC000509019961 229260893 /nfs/dbraw/zinc/26/08/93/229260893.db2.gz ATTIJHQDGBBPQF-LBPRGKRZSA-N 1 1 213.340 3.533 20 0 BHADMO FCCCC[N@H+]1CCCC12CCCCC2 ZINC000509020520 229260965 /nfs/dbraw/zinc/26/09/65/229260965.db2.gz FCGDQXGQZOKKGW-UHFFFAOYSA-N 1 1 213.340 3.535 20 0 BHADMO CC(C)[N@@H+](CCCCF)C1CCCCC1 ZINC000509020639 528879971 /nfs/dbraw/zinc/87/99/71/528879971.db2.gz CFOYNFIQINLSAH-UHFFFAOYSA-N 1 1 215.356 3.779 20 0 BHADMO CC(C)C[C@H]1CCCC[N@H+]1CC[C@@H](C)F ZINC000509021296 528585202 /nfs/dbraw/zinc/58/52/02/528585202.db2.gz JLFIKPBOYWMQOC-CHWSQXEVSA-N 1 1 215.356 3.635 20 0 BHADMO CC(C)C[C@@H]1CCCC[N@H+]1CC[C@@H](C)F ZINC000509021298 528373316 /nfs/dbraw/zinc/37/33/16/528373316.db2.gz JLFIKPBOYWMQOC-OLZOCXBDSA-N 1 1 215.356 3.635 20 0 BHADMO CC(C)C[C@H]1CCCC[N@H+]1CC[C@H](C)F ZINC000509021299 528584762 /nfs/dbraw/zinc/58/47/62/528584762.db2.gz JLFIKPBOYWMQOC-QWHCGFSZSA-N 1 1 215.356 3.635 20 0 BHADMO CC(C)C[C@@H]1CCCC[N@H+]1CC[C@H](C)F ZINC000509021300 528373525 /nfs/dbraw/zinc/37/35/25/528373525.db2.gz JLFIKPBOYWMQOC-STQMWFEESA-N 1 1 215.356 3.635 20 0 BHADMO CCC(C)(C)[C@H]1CCC[N@H+]1CCCCF ZINC000509022402 528599464 /nfs/dbraw/zinc/59/94/64/528599464.db2.gz LEQMWJOJRUBKTB-GFCCVEGCSA-N 1 1 215.356 3.637 20 0 BHADMO CCC(C)(C)[C@@H]1CCC[N@H+]1CCCCF ZINC000509022403 528598690 /nfs/dbraw/zinc/59/86/90/528598690.db2.gz LEQMWJOJRUBKTB-LBPRGKRZSA-N 1 1 215.356 3.637 20 0 BHADMO CCC(C)(C)[C@@H]1CCC[N@H+]1CC[C@@H](C)F ZINC000509023048 528598613 /nfs/dbraw/zinc/59/86/13/528598613.db2.gz PDBDDOXVBRSPPE-NEPJUHHUSA-N 1 1 215.356 3.635 20 0 BHADMO CC(C)C[C@H]1CCCC[N@H+]1CCCCF ZINC000509023075 528585224 /nfs/dbraw/zinc/58/52/24/528585224.db2.gz UMJMKYCLXHJSRL-CYBMUJFWSA-N 1 1 215.356 3.637 20 0 BHADMO CC(C)C[C@@H]1CCCC[N@H+]1CCCCF ZINC000509023076 528371284 /nfs/dbraw/zinc/37/12/84/528371284.db2.gz UMJMKYCLXHJSRL-ZDUSSCGKSA-N 1 1 215.356 3.637 20 0 BHADMO CCC(C)(C)[C@H]1CCC[N@H+]1CC[C@H](C)F ZINC000509023161 528599565 /nfs/dbraw/zinc/59/95/65/528599565.db2.gz PDBDDOXVBRSPPE-NWDGAFQWSA-N 1 1 215.356 3.635 20 0 BHADMO CCC(C)(C)[C@@H]1CCC[N@H+]1CC[C@H](C)F ZINC000509023164 528598753 /nfs/dbraw/zinc/59/87/53/528598753.db2.gz PDBDDOXVBRSPPE-RYUDHWBXSA-N 1 1 215.356 3.635 20 0 BHADMO CCC(C)(C)[C@H]1CCC[N@H+]1CC[C@@H](C)F ZINC000509023165 528599933 /nfs/dbraw/zinc/59/99/33/528599933.db2.gz PDBDDOXVBRSPPE-VXGBXAGGSA-N 1 1 215.356 3.635 20 0 BHADMO C[C@@H](F)CC[N@@H+](C)CCc1ccc(Cl)cc1 ZINC000509023169 534275762 /nfs/dbraw/zinc/27/57/62/534275762.db2.gz VEQDOZOTWACVIF-LLVKDONJSA-N 1 1 243.753 3.562 20 0 BHADMO C[C@H](F)CC[N@@H+](C)CCc1ccc(Cl)cc1 ZINC000509023175 229261443 /nfs/dbraw/zinc/26/14/43/229261443.db2.gz VEQDOZOTWACVIF-NSHDSACASA-N 1 1 243.753 3.562 20 0 BHADMO C[N@@H+](CCCCF)CCc1ccc(Cl)cc1 ZINC000509023358 529882583 /nfs/dbraw/zinc/88/25/83/529882583.db2.gz VJPPPBUSQWLZBO-UHFFFAOYSA-N 1 1 243.753 3.564 20 0 BHADMO CC(C)[N@H+](CC[C@@H](C)F)C1CCCCC1 ZINC000509024032 528913332 /nfs/dbraw/zinc/91/33/32/528913332.db2.gz SVZJTWABEJEKAB-GFCCVEGCSA-N 1 1 215.356 3.778 20 0 BHADMO CC(C)[N@H+](CC[C@H](C)F)C1CCCCC1 ZINC000509024034 528913059 /nfs/dbraw/zinc/91/30/59/528913059.db2.gz SVZJTWABEJEKAB-LBPRGKRZSA-N 1 1 215.356 3.778 20 0 BHADMO CC[C@H]1CCC[N@@H+](Cc2cccc(C)c2)C1 ZINC000509036289 529217348 /nfs/dbraw/zinc/21/73/48/529217348.db2.gz ATFMDDMIEWCEAW-AWEZNQCLSA-N 1 1 217.356 3.617 20 0 BHADMO CC[C@@H]1CCC[N@@H+](Cc2cccc(C)c2)C1 ZINC000509036292 529298628 /nfs/dbraw/zinc/29/86/28/529298628.db2.gz ATFMDDMIEWCEAW-CQSZACIVSA-N 1 1 217.356 3.617 20 0 BHADMO Cc1sccc1C[N@@H+]1CC[C@@H](C(C)C)C1 ZINC000509041274 229260576 /nfs/dbraw/zinc/26/05/76/229260576.db2.gz XJFCTJNUKOPTRK-GFCCVEGCSA-N 1 1 223.385 3.534 20 0 BHADMO Cc1sccc1C[N@@H+]1CC[C@H](C(C)C)C1 ZINC000509041275 229260910 /nfs/dbraw/zinc/26/09/10/229260910.db2.gz XJFCTJNUKOPTRK-LBPRGKRZSA-N 1 1 223.385 3.534 20 0 BHADMO CCOCC[N@@H+](Cc1ccccc1)CC(C)(C)C ZINC000509055014 528727430 /nfs/dbraw/zinc/72/74/30/528727430.db2.gz LBJBUWMURVTJEM-UHFFFAOYSA-N 1 1 249.398 3.571 20 0 BHADMO CC[C@H]1CCC[N@@H+](CCCOc2ccccc2)C1 ZINC000509056424 529217071 /nfs/dbraw/zinc/21/70/71/529217071.db2.gz XNZPQLJBQCEWPS-HNNXBMFYSA-N 1 1 247.382 3.578 20 0 BHADMO CC[C@@H]1CCC[N@@H+](CCCOc2ccccc2)C1 ZINC000509056425 529298917 /nfs/dbraw/zinc/29/89/17/529298917.db2.gz XNZPQLJBQCEWPS-OAHLLOKOSA-N 1 1 247.382 3.578 20 0 BHADMO CC[C@@H]1CCC[N@@H+](Cc2ccccc2Cl)C1 ZINC000509056586 529298885 /nfs/dbraw/zinc/29/88/85/529298885.db2.gz KLHJLUHETQGSTC-GFCCVEGCSA-N 1 1 237.774 3.962 20 0 BHADMO CC[C@H]1CCC[N@@H+](Cc2ccccc2Cl)C1 ZINC000509056587 529216783 /nfs/dbraw/zinc/21/67/83/529216783.db2.gz KLHJLUHETQGSTC-LBPRGKRZSA-N 1 1 237.774 3.962 20 0 BHADMO CCC[N@@H+](CCOc1c(C)cccc1C)C1CC1 ZINC000509077098 528103977 /nfs/dbraw/zinc/10/39/77/528103977.db2.gz IILDREHNYJMNPC-UHFFFAOYSA-N 1 1 247.382 3.557 20 0 BHADMO CCC[N@@H+](Cc1cc(C)cc(C)c1)C1CC1 ZINC000509081933 528129738 /nfs/dbraw/zinc/12/97/38/528129738.db2.gz JEGXFXFNGVLPFW-UHFFFAOYSA-N 1 1 217.356 3.678 20 0 BHADMO Cc1cc(Cl)cc(C[N@H+]2CC[C@@](C)(F)C2)c1 ZINC000509113169 229262545 /nfs/dbraw/zinc/26/25/45/229262545.db2.gz RHQNCOWHXWYCOD-CYBMUJFWSA-N 1 1 241.737 3.582 20 0 BHADMO Cc1cc(Cl)cc(C[N@@H+]2CC[C@@](C)(F)C2)c1 ZINC000509113169 229262541 /nfs/dbraw/zinc/26/25/41/229262541.db2.gz RHQNCOWHXWYCOD-CYBMUJFWSA-N 1 1 241.737 3.582 20 0 BHADMO Cc1cc(Cl)cc(C[N@H+]2CC[C@](C)(F)C2)c1 ZINC000509113170 229262046 /nfs/dbraw/zinc/26/20/46/229262046.db2.gz RHQNCOWHXWYCOD-ZDUSSCGKSA-N 1 1 241.737 3.582 20 0 BHADMO Cc1cc(Cl)cc(C[N@@H+]2CC[C@](C)(F)C2)c1 ZINC000509113170 229262042 /nfs/dbraw/zinc/26/20/42/229262042.db2.gz RHQNCOWHXWYCOD-ZDUSSCGKSA-N 1 1 241.737 3.582 20 0 BHADMO CCC[N@@H+](CCCCOC)CC1CCCCC1 ZINC000509261414 528063477 /nfs/dbraw/zinc/06/34/77/528063477.db2.gz BRTINQOHLFNDOK-UHFFFAOYSA-N 1 1 241.419 3.705 20 0 BHADMO CC[N@@H+](CC[C@@H](C)F)Cc1ccc(Cl)cc1 ZINC000509262278 528585190 /nfs/dbraw/zinc/58/51/90/528585190.db2.gz GKEHSTMHCWITLC-LLVKDONJSA-N 1 1 243.753 3.910 20 0 BHADMO CC[N@@H+](CC[C@H](C)F)Cc1ccc(Cl)cc1 ZINC000509262281 528584630 /nfs/dbraw/zinc/58/46/30/528584630.db2.gz GKEHSTMHCWITLC-NSHDSACASA-N 1 1 243.753 3.910 20 0 BHADMO CC[N@@H+](CCCCF)Cc1ccc(Cl)cc1 ZINC000509262369 528432217 /nfs/dbraw/zinc/43/22/17/528432217.db2.gz GWUACCWOMYCKMG-UHFFFAOYSA-N 1 1 243.753 3.912 20 0 BHADMO CC[N@@H+](CC[C@@H](C)F)[C@@H](C)c1ccc(F)cc1 ZINC000509263914 528585243 /nfs/dbraw/zinc/58/52/43/528585243.db2.gz OGCUWONMTLKMGG-NEPJUHHUSA-N 1 1 241.325 3.957 20 0 BHADMO CC[N@@H+](CC[C@H](C)F)[C@H](C)c1ccc(F)cc1 ZINC000509263915 528584312 /nfs/dbraw/zinc/58/43/12/528584312.db2.gz OGCUWONMTLKMGG-NWDGAFQWSA-N 1 1 241.325 3.957 20 0 BHADMO CC[N@@H+](CC[C@H](C)F)[C@@H](C)c1ccc(F)cc1 ZINC000509263916 528585282 /nfs/dbraw/zinc/58/52/82/528585282.db2.gz OGCUWONMTLKMGG-RYUDHWBXSA-N 1 1 241.325 3.957 20 0 BHADMO CC[N@@H+](CC[C@@H](C)F)[C@H](C)c1ccc(F)cc1 ZINC000509263917 528584459 /nfs/dbraw/zinc/58/44/59/528584459.db2.gz OGCUWONMTLKMGG-VXGBXAGGSA-N 1 1 241.325 3.957 20 0 BHADMO CC(C)(C)C[C@H]1CCC[N@H+]1CCCCF ZINC000509264237 527703771 /nfs/dbraw/zinc/70/37/71/527703771.db2.gz PFWXEOGYGCQTAZ-GFCCVEGCSA-N 1 1 215.356 3.637 20 0 BHADMO CC(C)(C)C[C@@H]1CCC[N@H+]1CCCCF ZINC000509264238 527698379 /nfs/dbraw/zinc/69/83/79/527698379.db2.gz PFWXEOGYGCQTAZ-LBPRGKRZSA-N 1 1 215.356 3.637 20 0 BHADMO FCCCC[N@H+]1CCC[C@H]1CCc1ccccc1 ZINC000509264943 229266754 /nfs/dbraw/zinc/26/67/54/229266754.db2.gz TXTDJWBDBKCIMU-INIZCTEOSA-N 1 1 249.373 3.833 20 0 BHADMO FCCCC[N@H+]1CCC[C@@H]1CCc1ccccc1 ZINC000509264944 229266850 /nfs/dbraw/zinc/26/68/50/229266850.db2.gz TXTDJWBDBKCIMU-MRXNPFEDSA-N 1 1 249.373 3.833 20 0 BHADMO CC[N@@H+](CCCCF)[C@H](C)c1ccc(F)cc1 ZINC000509265343 528432641 /nfs/dbraw/zinc/43/26/41/528432641.db2.gz UNVDCSSSNHCSSO-GFCCVEGCSA-N 1 1 241.325 3.958 20 0 BHADMO CC[N@@H+](CCCCF)[C@@H](C)c1ccc(F)cc1 ZINC000509265344 528432572 /nfs/dbraw/zinc/43/25/72/528432572.db2.gz UNVDCSSSNHCSSO-LBPRGKRZSA-N 1 1 241.325 3.958 20 0 BHADMO C[C@@H](F)CC[N@H+]1CCC[C@@H]1CCc1ccccc1 ZINC000509265607 534276691 /nfs/dbraw/zinc/27/66/91/534276691.db2.gz WKBIEZGKHOQSGA-GDBMZVCRSA-N 1 1 249.373 3.832 20 0 BHADMO C[C@H](F)CC[N@H+]1CCC[C@@H]1CCc1ccccc1 ZINC000509265608 229266995 /nfs/dbraw/zinc/26/69/95/229266995.db2.gz WKBIEZGKHOQSGA-GOEBONIOSA-N 1 1 249.373 3.832 20 0 BHADMO C[C@H](F)CC[N@H+]1CCC[C@H]1CCc1ccccc1 ZINC000509265609 229266276 /nfs/dbraw/zinc/26/62/76/229266276.db2.gz WKBIEZGKHOQSGA-HOCLYGCPSA-N 1 1 249.373 3.832 20 0 BHADMO C[C@@H](F)CC[N@H+]1CCC[C@H]1CCc1ccccc1 ZINC000509265610 534276458 /nfs/dbraw/zinc/27/64/58/534276458.db2.gz WKBIEZGKHOQSGA-ZBFHGGJFSA-N 1 1 249.373 3.832 20 0 BHADMO C[C@@H](F)CC[N@H+]1CCC[C@H]1CC(C)(C)C ZINC000509266655 534276454 /nfs/dbraw/zinc/27/64/54/534276454.db2.gz ZKVBXCWRSTUQJB-NEPJUHHUSA-N 1 1 215.356 3.635 20 0 BHADMO C[C@H](F)CC[N@H+]1CCC[C@@H]1CC(C)(C)C ZINC000509266656 229266293 /nfs/dbraw/zinc/26/62/93/229266293.db2.gz ZKVBXCWRSTUQJB-NWDGAFQWSA-N 1 1 215.356 3.635 20 0 BHADMO C[C@H](F)CC[N@H+]1CCC[C@H]1CC(C)(C)C ZINC000509266657 229266340 /nfs/dbraw/zinc/26/63/40/229266340.db2.gz ZKVBXCWRSTUQJB-RYUDHWBXSA-N 1 1 215.356 3.635 20 0 BHADMO C[C@@H](F)CC[N@H+]1CCC[C@@H]1CC(C)(C)C ZINC000509266659 534276252 /nfs/dbraw/zinc/27/62/52/534276252.db2.gz ZKVBXCWRSTUQJB-VXGBXAGGSA-N 1 1 215.356 3.635 20 0 BHADMO CC[N@@H+](CCCCF)Cc1cccc(Cl)c1 ZINC000509274796 528432755 /nfs/dbraw/zinc/43/27/55/528432755.db2.gz BPZZAVDFPZKQNT-UHFFFAOYSA-N 1 1 243.753 3.912 20 0 BHADMO CC[N@@H+](CC[C@@H](C)F)Cc1cccc(Cl)c1 ZINC000509276591 528584332 /nfs/dbraw/zinc/58/43/32/528584332.db2.gz KVXSJXFUPFVPSV-LLVKDONJSA-N 1 1 243.753 3.910 20 0 BHADMO CC[N@@H+](CC[C@H](C)F)Cc1cccc(Cl)c1 ZINC000509276593 528585746 /nfs/dbraw/zinc/58/57/46/528585746.db2.gz KVXSJXFUPFVPSV-NSHDSACASA-N 1 1 243.753 3.910 20 0 BHADMO Cc1ccc([C@@H](C)[N@@H+](C)CCCCF)cc1 ZINC000509276636 229266932 /nfs/dbraw/zinc/26/69/32/229266932.db2.gz LFWQHJNTDINSIC-CYBMUJFWSA-N 1 1 223.335 3.738 20 0 BHADMO Cc1ccc([C@H](C)[N@@H+](C)CCCCF)cc1 ZINC000509276637 229267020 /nfs/dbraw/zinc/26/70/20/229267020.db2.gz LFWQHJNTDINSIC-ZDUSSCGKSA-N 1 1 223.335 3.738 20 0 BHADMO Cc1ccc([C@@H](C)[N@H+](C)CC[C@@H](C)F)cc1 ZINC000509277584 229268820 /nfs/dbraw/zinc/26/88/20/229268820.db2.gz VIBMXWDPNNJYJV-CHWSQXEVSA-N 1 1 223.335 3.736 20 0 BHADMO Cc1ccc([C@H](C)[N@H+](C)CC[C@@H](C)F)cc1 ZINC000509277585 229268520 /nfs/dbraw/zinc/26/85/20/229268520.db2.gz VIBMXWDPNNJYJV-OLZOCXBDSA-N 1 1 223.335 3.736 20 0 BHADMO Cc1ccc([C@@H](C)[N@H+](C)CC[C@H](C)F)cc1 ZINC000509277586 229268921 /nfs/dbraw/zinc/26/89/21/229268921.db2.gz VIBMXWDPNNJYJV-QWHCGFSZSA-N 1 1 223.335 3.736 20 0 BHADMO Cc1ccc([C@H](C)[N@H+](C)CC[C@H](C)F)cc1 ZINC000509277587 229268563 /nfs/dbraw/zinc/26/85/63/229268563.db2.gz VIBMXWDPNNJYJV-STQMWFEESA-N 1 1 223.335 3.736 20 0 BHADMO Cc1ccccc1[C@@H]1CCC[N@H+]1CCCCF ZINC000509279330 229268673 /nfs/dbraw/zinc/26/86/73/229268673.db2.gz MIKKKZVHWMEFBB-HNNXBMFYSA-N 1 1 235.346 3.882 20 0 BHADMO Cc1ccccc1[C@H]1CCC[N@H+]1CCCCF ZINC000509279331 229268701 /nfs/dbraw/zinc/26/87/01/229268701.db2.gz MIKKKZVHWMEFBB-OAHLLOKOSA-N 1 1 235.346 3.882 20 0 BHADMO CC(C)C[N@@H+](CCCCF)C1CCCC1 ZINC000509280129 527938931 /nfs/dbraw/zinc/93/89/31/527938931.db2.gz VDQWQEVJKRXTAP-UHFFFAOYSA-N 1 1 215.356 3.637 20 0 BHADMO CC(C)C[N@@H+](CC[C@@H](C)F)C1CCCC1 ZINC000509280363 527941223 /nfs/dbraw/zinc/94/12/23/527941223.db2.gz WRJACWFZMLKRLJ-GFCCVEGCSA-N 1 1 215.356 3.635 20 0 BHADMO CC(C)C[N@@H+](CC[C@H](C)F)C1CCCC1 ZINC000509280364 527940342 /nfs/dbraw/zinc/94/03/42/527940342.db2.gz WRJACWFZMLKRLJ-LBPRGKRZSA-N 1 1 215.356 3.635 20 0 BHADMO Cc1ccccc1[C@H]1CCC[N@@H+]1CC[C@H](C)F ZINC000509280604 229267838 /nfs/dbraw/zinc/26/78/38/229267838.db2.gz WCRJNXRUMNBPOU-DZGCQCFKSA-N 1 1 235.346 3.880 20 0 BHADMO Cc1ccccc1[C@@H]1CCC[N@@H+]1CC[C@@H](C)F ZINC000509280606 229267685 /nfs/dbraw/zinc/26/76/85/229267685.db2.gz WCRJNXRUMNBPOU-HIFRSBDPSA-N 1 1 235.346 3.880 20 0 BHADMO Cc1ccccc1[C@H]1CCC[N@@H+]1CC[C@@H](C)F ZINC000509280608 229268000 /nfs/dbraw/zinc/26/80/00/229268000.db2.gz WCRJNXRUMNBPOU-UKRRQHHQSA-N 1 1 235.346 3.880 20 0 BHADMO Cc1ccccc1[C@@H]1CCC[N@@H+]1CC[C@H](C)F ZINC000509280609 229268838 /nfs/dbraw/zinc/26/88/38/229268838.db2.gz WCRJNXRUMNBPOU-ZFWWWQNUSA-N 1 1 235.346 3.880 20 0 BHADMO FCCCC[N@H+]1CCC[C@H]1C1CCCCC1 ZINC000509294861 229268787 /nfs/dbraw/zinc/26/87/87/229268787.db2.gz CTDAFPHDYOSZPZ-AWEZNQCLSA-N 1 1 227.367 3.781 20 0 BHADMO FCCCC[N@H+]1CCC[C@@H]1C1CCCCC1 ZINC000509294869 229268764 /nfs/dbraw/zinc/26/87/64/229268764.db2.gz CTDAFPHDYOSZPZ-CQSZACIVSA-N 1 1 227.367 3.781 20 0 BHADMO Cc1cccc([C@H]2CCC[N@@H+]2CC[C@H](C)F)c1 ZINC000509295174 534765346 /nfs/dbraw/zinc/76/53/46/534765346.db2.gz FSVGSZUAYNKQPE-DZGCQCFKSA-N 1 1 235.346 3.880 20 0 BHADMO Cc1cccc([C@@H]2CCC[N@@H+]2CC[C@@H](C)F)c1 ZINC000509295175 229267983 /nfs/dbraw/zinc/26/79/83/229267983.db2.gz FSVGSZUAYNKQPE-HIFRSBDPSA-N 1 1 235.346 3.880 20 0 BHADMO Cc1cccc([C@H]2CCC[N@@H+]2CC[C@@H](C)F)c1 ZINC000509295176 534764851 /nfs/dbraw/zinc/76/48/51/534764851.db2.gz FSVGSZUAYNKQPE-UKRRQHHQSA-N 1 1 235.346 3.880 20 0 BHADMO Cc1cccc([C@@H]2CCC[N@@H+]2CC[C@H](C)F)c1 ZINC000509295177 229268719 /nfs/dbraw/zinc/26/87/19/229268719.db2.gz FSVGSZUAYNKQPE-ZFWWWQNUSA-N 1 1 235.346 3.880 20 0 BHADMO CCCCC[N@@H+](CC[C@@H](C)F)C(C)C ZINC000509295196 528182096 /nfs/dbraw/zinc/18/20/96/528182096.db2.gz FWHFQQKTQLOJBJ-GFCCVEGCSA-N 1 1 203.345 3.635 20 0 BHADMO CCCCC[N@@H+](CC[C@H](C)F)C(C)C ZINC000509295200 528182267 /nfs/dbraw/zinc/18/22/67/528182267.db2.gz FWHFQQKTQLOJBJ-LBPRGKRZSA-N 1 1 203.345 3.635 20 0 BHADMO C[C@H](F)CC[N@@H+](C)CCCCc1ccccc1 ZINC000509295566 229268124 /nfs/dbraw/zinc/26/81/24/229268124.db2.gz GZXVLCIYLAMLLS-AWEZNQCLSA-N 1 1 237.362 3.689 20 0 BHADMO C[C@@H](F)CC[N@@H+](C)CCCCc1ccccc1 ZINC000509295568 534275429 /nfs/dbraw/zinc/27/54/29/534275429.db2.gz GZXVLCIYLAMLLS-CQSZACIVSA-N 1 1 237.362 3.689 20 0 BHADMO CC[C@@H](c1ccccc1)[N@@H+](CC)CCCCOC ZINC000509296466 529256588 /nfs/dbraw/zinc/25/65/88/529256588.db2.gz LDIARAJHGGISHC-INIZCTEOSA-N 1 1 249.398 3.886 20 0 BHADMO CC[C@H](c1ccccc1)[N@@H+](CC)CCCCOC ZINC000509296467 529181516 /nfs/dbraw/zinc/18/15/16/529181516.db2.gz LDIARAJHGGISHC-MRXNPFEDSA-N 1 1 249.398 3.886 20 0 BHADMO Cc1cccc([C@@H]2CCC[N@H+]2CCCCF)c1 ZINC000509296809 229268684 /nfs/dbraw/zinc/26/86/84/229268684.db2.gz PTLHEWGVTDHCBD-HNNXBMFYSA-N 1 1 235.346 3.882 20 0 BHADMO Cc1cccc([C@H]2CCC[N@H+]2CCCCF)c1 ZINC000509296810 534763789 /nfs/dbraw/zinc/76/37/89/534763789.db2.gz PTLHEWGVTDHCBD-OAHLLOKOSA-N 1 1 235.346 3.882 20 0 BHADMO CCCCC[N@@H+](CC1CC(OCC)C1)C(C)C ZINC000509296855 528166740 /nfs/dbraw/zinc/16/67/40/528166740.db2.gz QGPJRYNRHMYWJY-UHFFFAOYSA-N 1 1 241.419 3.702 20 0 BHADMO C[N@@H+](CCCCF)CCCCc1ccccc1 ZINC000509296987 529882749 /nfs/dbraw/zinc/88/27/49/529882749.db2.gz RZJMHYIHJVXYDP-UHFFFAOYSA-N 1 1 237.362 3.691 20 0 BHADMO C[C@H](F)CC[N@H+]1CCC[C@@H]1C1CCCCC1 ZINC000509297062 229268509 /nfs/dbraw/zinc/26/85/09/229268509.db2.gz TVFDIYLVVJMIEM-GXTWGEPZSA-N 1 1 227.367 3.779 20 0 BHADMO C[C@H](F)CC[N@H+]1CCC[C@H]1C1CCCCC1 ZINC000509297063 229267795 /nfs/dbraw/zinc/26/77/95/229267795.db2.gz TVFDIYLVVJMIEM-JSGCOSHPSA-N 1 1 227.367 3.779 20 0 BHADMO C[C@@H](F)CC[N@H+]1CCC[C@H]1C1CCCCC1 ZINC000509297064 534276474 /nfs/dbraw/zinc/27/64/74/534276474.db2.gz TVFDIYLVVJMIEM-OCCSQVGLSA-N 1 1 227.367 3.779 20 0 BHADMO C[C@@H](F)CC[N@H+]1CCC[C@@H]1C1CCCCC1 ZINC000509297065 534276449 /nfs/dbraw/zinc/27/64/49/534276449.db2.gz TVFDIYLVVJMIEM-TZMCWYRMSA-N 1 1 227.367 3.779 20 0 BHADMO CCCCC[N@@H+](CCCCF)C(C)C ZINC000509297089 528168323 /nfs/dbraw/zinc/16/83/23/528168323.db2.gz UKQCKEYQUKPQII-UHFFFAOYSA-N 1 1 203.345 3.637 20 0 BHADMO FCCCC[N@@H+](CC1CCCCC1)C1CC1 ZINC000509309871 229267900 /nfs/dbraw/zinc/26/79/00/229267900.db2.gz IPDWWBPYDCUFOA-UHFFFAOYSA-N 1 1 227.367 3.781 20 0 BHADMO C[C@@H](F)CC[N@@H+](CC1CCCCC1)C1CC1 ZINC000509310097 534275341 /nfs/dbraw/zinc/27/53/41/534275341.db2.gz KFHFLSJRDJIUQY-GFCCVEGCSA-N 1 1 227.367 3.779 20 0 BHADMO C[C@H](F)CC[N@@H+](CC1CCCCC1)C1CC1 ZINC000509310098 229269544 /nfs/dbraw/zinc/26/95/44/229269544.db2.gz KFHFLSJRDJIUQY-LBPRGKRZSA-N 1 1 227.367 3.779 20 0 BHADMO CC[C@@H]1c2ccsc2CC[N@@H+]1CC[C@H](C)F ZINC000509310619 529486475 /nfs/dbraw/zinc/48/64/75/529486475.db2.gz MSDWTENWMNEENH-CMPLNLGQSA-N 1 1 241.375 3.805 20 0 BHADMO CC[C@H]1c2ccsc2CC[N@@H+]1CC[C@H](C)F ZINC000509310620 529345697 /nfs/dbraw/zinc/34/56/97/529345697.db2.gz MSDWTENWMNEENH-JQWIXIFHSA-N 1 1 241.375 3.805 20 0 BHADMO CC[C@H]1c2ccsc2CC[N@@H+]1CC[C@@H](C)F ZINC000509310621 529345649 /nfs/dbraw/zinc/34/56/49/529345649.db2.gz MSDWTENWMNEENH-PWSUYJOCSA-N 1 1 241.375 3.805 20 0 BHADMO CC[C@@H]1c2ccsc2CC[N@@H+]1CC[C@@H](C)F ZINC000509310622 529486735 /nfs/dbraw/zinc/48/67/35/529486735.db2.gz MSDWTENWMNEENH-ZYHUDNBSSA-N 1 1 241.375 3.805 20 0 BHADMO CCc1ccc(C[N@@H+](CCCCF)C2CC2)cc1 ZINC000509311116 529637442 /nfs/dbraw/zinc/63/74/42/529637442.db2.gz SSQQTZRDMYHWCX-UHFFFAOYSA-N 1 1 249.373 3.963 20 0 BHADMO CCOC1CC(C[N@@H+](CC)CC(CC)CC)C1 ZINC000509311214 528497345 /nfs/dbraw/zinc/49/73/45/528497345.db2.gz RFQYJTBDJBKPNR-UHFFFAOYSA-N 1 1 241.419 3.560 20 0 BHADMO CC(C)C[N@@H+](CCCCF)Cc1ccccc1 ZINC000509311965 527938777 /nfs/dbraw/zinc/93/87/77/527938777.db2.gz AWXTVIFKCKAAHM-UHFFFAOYSA-N 1 1 237.362 3.894 20 0 BHADMO CC(C)c1ccc(C[N@H+](C)CC[C@@H](C)F)cc1 ZINC000509311993 528090381 /nfs/dbraw/zinc/09/03/81/528090381.db2.gz BJSWAAGHLIERID-CYBMUJFWSA-N 1 1 237.362 3.990 20 0 BHADMO CC(C)c1ccc(C[N@H+](C)CC[C@H](C)F)cc1 ZINC000509311994 528090598 /nfs/dbraw/zinc/09/05/98/528090598.db2.gz BJSWAAGHLIERID-ZDUSSCGKSA-N 1 1 237.362 3.990 20 0 BHADMO CC[N@@H+](CC[C@@H](C)F)Cc1ccccc1Cl ZINC000509312332 528585412 /nfs/dbraw/zinc/58/54/12/528585412.db2.gz BNOIQEPLHCNNMX-LLVKDONJSA-N 1 1 243.753 3.910 20 0 BHADMO CC[N@@H+](CC[C@H](C)F)Cc1ccccc1Cl ZINC000509312333 528585037 /nfs/dbraw/zinc/58/50/37/528585037.db2.gz BNOIQEPLHCNNMX-NSHDSACASA-N 1 1 243.753 3.910 20 0 BHADMO CC[N@@H+](CCCCF)Cc1ccccc1Cl ZINC000509312366 528432695 /nfs/dbraw/zinc/43/26/95/528432695.db2.gz BWOUYPIQZCNBGC-UHFFFAOYSA-N 1 1 243.753 3.912 20 0 BHADMO CC[C@@H]1c2ccsc2CC[N@@H+]1CCCCF ZINC000509312483 529486728 /nfs/dbraw/zinc/48/67/28/529486728.db2.gz XGNYSWBUSZCXTO-GFCCVEGCSA-N 1 1 241.375 3.807 20 0 BHADMO CC[C@H]1c2ccsc2CC[N@@H+]1CCCCF ZINC000509312484 529345549 /nfs/dbraw/zinc/34/55/49/529345549.db2.gz XGNYSWBUSZCXTO-LBPRGKRZSA-N 1 1 241.375 3.807 20 0 BHADMO CC(C)[N@@H+](CC[C@@H](C)F)Cc1ccc(F)cc1 ZINC000509312491 528914002 /nfs/dbraw/zinc/91/40/02/528914002.db2.gz XKDQTLPHCJMSBC-GFCCVEGCSA-N 1 1 241.325 3.784 20 0 BHADMO CC(C)[N@@H+](CC[C@H](C)F)Cc1ccc(F)cc1 ZINC000509312492 528913412 /nfs/dbraw/zinc/91/34/12/528913412.db2.gz XKDQTLPHCJMSBC-LBPRGKRZSA-N 1 1 241.325 3.784 20 0 BHADMO CC(C)C[N@@H+](CC[C@H](C)F)Cc1ccccc1 ZINC000509313117 527941341 /nfs/dbraw/zinc/94/13/41/527941341.db2.gz GMOHYPFBTZMXAJ-AWEZNQCLSA-N 1 1 237.362 3.893 20 0 BHADMO CC(C)C[N@@H+](CC[C@@H](C)F)Cc1ccccc1 ZINC000509313118 527941309 /nfs/dbraw/zinc/94/13/09/527941309.db2.gz GMOHYPFBTZMXAJ-CQSZACIVSA-N 1 1 237.362 3.893 20 0 BHADMO CC(C)c1ccc(C[N@@H+](C)CCCCF)cc1 ZINC000509313478 528091174 /nfs/dbraw/zinc/09/11/74/528091174.db2.gz ILHAPNCFNKRXGE-UHFFFAOYSA-N 1 1 237.362 3.992 20 0 BHADMO CCC[N@@H+](CC[C@@H](C)F)Cc1ccc(F)cc1 ZINC000509313480 528103118 /nfs/dbraw/zinc/10/31/18/528103118.db2.gz INVRZXIJFYXLQN-GFCCVEGCSA-N 1 1 241.325 3.786 20 0 BHADMO CCC[N@@H+](CC[C@H](C)F)Cc1ccc(F)cc1 ZINC000509313481 528103988 /nfs/dbraw/zinc/10/39/88/528103988.db2.gz INVRZXIJFYXLQN-LBPRGKRZSA-N 1 1 241.325 3.786 20 0 BHADMO CCC[N@@H+](CCCCF)Cc1ccc(F)cc1 ZINC000509315305 528063122 /nfs/dbraw/zinc/06/31/22/528063122.db2.gz RQYAJZFAUDOQDK-UHFFFAOYSA-N 1 1 241.325 3.787 20 0 BHADMO COCCCC[N@@H+](CCC(C)C)C1CCCC1 ZINC000509328738 533256141 /nfs/dbraw/zinc/25/61/41/533256141.db2.gz UEQLHWCKISBFBS-UHFFFAOYSA-N 1 1 241.419 3.704 20 0 BHADMO COCCCC[N@@H+](C)[C@@H](C)c1ccc(C)cc1C ZINC000509328841 533252943 /nfs/dbraw/zinc/25/29/43/533252943.db2.gz VDRFSWDRNSYQAM-HNNXBMFYSA-N 1 1 249.398 3.723 20 0 BHADMO COCCCC[N@@H+](C)[C@H](C)c1ccc(C)cc1C ZINC000509328842 533253104 /nfs/dbraw/zinc/25/31/04/533253104.db2.gz VDRFSWDRNSYQAM-OAHLLOKOSA-N 1 1 249.398 3.723 20 0 BHADMO Cc1ccccc1[C@@H](C)[N@H+](C)CC[C@@H](C)F ZINC000509328893 229269448 /nfs/dbraw/zinc/26/94/48/229269448.db2.gz VWZIGERYRLRSDA-CHWSQXEVSA-N 1 1 223.335 3.736 20 0 BHADMO Cc1ccccc1[C@H](C)[N@H+](C)CC[C@@H](C)F ZINC000509328894 229269691 /nfs/dbraw/zinc/26/96/91/229269691.db2.gz VWZIGERYRLRSDA-OLZOCXBDSA-N 1 1 223.335 3.736 20 0 BHADMO Cc1ccccc1[C@@H](C)[N@H+](C)CC[C@H](C)F ZINC000509328895 229269491 /nfs/dbraw/zinc/26/94/91/229269491.db2.gz VWZIGERYRLRSDA-QWHCGFSZSA-N 1 1 223.335 3.736 20 0 BHADMO Cc1ccccc1[C@H](C)[N@H+](C)CC[C@H](C)F ZINC000509328896 229270559 /nfs/dbraw/zinc/27/05/59/229270559.db2.gz VWZIGERYRLRSDA-STQMWFEESA-N 1 1 223.335 3.736 20 0 BHADMO C[C@H]1[C@H](c2ccccc2)CC[N@H+]1CCCCF ZINC000509329769 229270721 /nfs/dbraw/zinc/27/07/21/229270721.db2.gz AYUGCDLPMGGUIF-DZGCQCFKSA-N 1 1 235.346 3.614 20 0 BHADMO C[C@@H]1[C@@H](c2ccccc2)CC[N@H+]1CCCCF ZINC000509329770 229269201 /nfs/dbraw/zinc/26/92/01/229269201.db2.gz AYUGCDLPMGGUIF-HIFRSBDPSA-N 1 1 235.346 3.614 20 0 BHADMO C[C@@H]1[C@H](c2ccccc2)CC[N@H+]1CCCCF ZINC000509329772 229269852 /nfs/dbraw/zinc/26/98/52/229269852.db2.gz AYUGCDLPMGGUIF-UKRRQHHQSA-N 1 1 235.346 3.614 20 0 BHADMO C[C@H]1[C@@H](c2ccccc2)CC[N@H+]1CCCCF ZINC000509329774 229270868 /nfs/dbraw/zinc/27/08/68/229270868.db2.gz AYUGCDLPMGGUIF-ZFWWWQNUSA-N 1 1 235.346 3.614 20 0 BHADMO C[C@H](F)CC[N@H+]1CC[C@H](c2ccccc2)[C@H]1C ZINC000509332233 229271176 /nfs/dbraw/zinc/27/11/76/229271176.db2.gz RPZXNDMKSOCZIU-GUTXKFCHSA-N 1 1 235.346 3.613 20 0 BHADMO C[C@H](F)CC[N@H+]1CC[C@@H](c2ccccc2)[C@H]1C ZINC000509332234 229271567 /nfs/dbraw/zinc/27/15/67/229271567.db2.gz RPZXNDMKSOCZIU-GZBFAFLISA-N 1 1 235.346 3.613 20 0 BHADMO C[C@H](F)CC[N@H+]1CC[C@@H](c2ccccc2)[C@@H]1C ZINC000509332235 229271496 /nfs/dbraw/zinc/27/14/96/229271496.db2.gz RPZXNDMKSOCZIU-KCQAQPDRSA-N 1 1 235.346 3.613 20 0 BHADMO C[C@H](F)CC[N@H+]1CC[C@H](c2ccccc2)[C@@H]1C ZINC000509332236 229271941 /nfs/dbraw/zinc/27/19/41/229271941.db2.gz RPZXNDMKSOCZIU-YDHLFZDLSA-N 1 1 235.346 3.613 20 0 BHADMO CC(C)C[N@@H+](CCCCF)CC(C)(C)C ZINC000509340732 527939231 /nfs/dbraw/zinc/93/92/31/527939231.db2.gz HAADYADZZAXOID-UHFFFAOYSA-N 1 1 217.372 3.740 20 0 BHADMO CCC[C@@H](C)[C@H]1CCC[N@H+]1CCCCF ZINC000509341837 528905761 /nfs/dbraw/zinc/90/57/61/528905761.db2.gz KJJCCOKUGXCJMR-CHWSQXEVSA-N 1 1 215.356 3.637 20 0 BHADMO CCC[C@@H](C)[C@@H]1CCC[N@H+]1CCCCF ZINC000509341838 528903865 /nfs/dbraw/zinc/90/38/65/528903865.db2.gz KJJCCOKUGXCJMR-OLZOCXBDSA-N 1 1 215.356 3.637 20 0 BHADMO CCC[C@H](C)[C@H]1CCC[N@H+]1CCCCF ZINC000509341839 528080569 /nfs/dbraw/zinc/08/05/69/528080569.db2.gz KJJCCOKUGXCJMR-QWHCGFSZSA-N 1 1 215.356 3.637 20 0 BHADMO CCC[C@H](C)[C@@H]1CCC[N@H+]1CCCCF ZINC000509341840 528073713 /nfs/dbraw/zinc/07/37/13/528073713.db2.gz KJJCCOKUGXCJMR-STQMWFEESA-N 1 1 215.356 3.637 20 0 BHADMO CC(C)CC[C@H]1CCC[N@H+]1CC[C@@H](C)F ZINC000509342330 527857168 /nfs/dbraw/zinc/85/71/68/527857168.db2.gz LXHHWYPROQIMDO-CHWSQXEVSA-N 1 1 215.356 3.635 20 0 BHADMO CC(C)CC[C@@H]1CCC[N@H+]1CC[C@@H](C)F ZINC000509342331 527820054 /nfs/dbraw/zinc/82/00/54/527820054.db2.gz LXHHWYPROQIMDO-OLZOCXBDSA-N 1 1 215.356 3.635 20 0 BHADMO CC(C)CC[C@H]1CCC[N@H+]1CC[C@H](C)F ZINC000509342332 527857011 /nfs/dbraw/zinc/85/70/11/527857011.db2.gz LXHHWYPROQIMDO-QWHCGFSZSA-N 1 1 215.356 3.635 20 0 BHADMO CC(C)CC[C@@H]1CCC[N@H+]1CC[C@H](C)F ZINC000509342333 527820141 /nfs/dbraw/zinc/82/01/41/527820141.db2.gz LXHHWYPROQIMDO-STQMWFEESA-N 1 1 215.356 3.635 20 0 BHADMO CCCCC[C@@H]1CCC[N@H+]1CC[C@@H](C)F ZINC000509342386 528261359 /nfs/dbraw/zinc/26/13/59/528261359.db2.gz HXGOMLFBWCCKEN-CHWSQXEVSA-N 1 1 215.356 3.779 20 0 BHADMO CCCCC[C@H]1CCC[N@H+]1CC[C@@H](C)F ZINC000509342387 528275213 /nfs/dbraw/zinc/27/52/13/528275213.db2.gz HXGOMLFBWCCKEN-OLZOCXBDSA-N 1 1 215.356 3.779 20 0 BHADMO CCCCC[C@@H]1CCC[N@H+]1CC[C@H](C)F ZINC000509342388 528261436 /nfs/dbraw/zinc/26/14/36/528261436.db2.gz HXGOMLFBWCCKEN-QWHCGFSZSA-N 1 1 215.356 3.779 20 0 BHADMO CCCCC[C@H]1CCC[N@H+]1CC[C@H](C)F ZINC000509342389 528274928 /nfs/dbraw/zinc/27/49/28/528274928.db2.gz HXGOMLFBWCCKEN-STQMWFEESA-N 1 1 215.356 3.779 20 0 BHADMO CC(C)C[N@@H+](CC[C@@H](C)F)CC(C)(C)C ZINC000509343744 527941276 /nfs/dbraw/zinc/94/12/76/527941276.db2.gz QTFNIZFBCCCLBR-GFCCVEGCSA-N 1 1 217.372 3.739 20 0 BHADMO CC(C)C[N@@H+](CC[C@H](C)F)CC(C)(C)C ZINC000509343745 527941402 /nfs/dbraw/zinc/94/14/02/527941402.db2.gz QTFNIZFBCCCLBR-LBPRGKRZSA-N 1 1 217.372 3.739 20 0 BHADMO CCC[C@H](C)[C@@H]1CCC[N@H+]1CC[C@H](C)F ZINC000509344142 528073508 /nfs/dbraw/zinc/07/35/08/528073508.db2.gz SMNCTWGPJMRVHG-AVGNSLFASA-N 1 1 215.356 3.635 20 0 BHADMO CCC[C@H](C)[C@H]1CCC[N@H+]1CC[C@H](C)F ZINC000509344143 528082064 /nfs/dbraw/zinc/08/20/64/528082064.db2.gz SMNCTWGPJMRVHG-RWMBFGLXSA-N 1 1 215.356 3.635 20 0 BHADMO CCC[C@H](C)[C@@H]1CCC[N@H+]1CC[C@@H](C)F ZINC000509344144 528074501 /nfs/dbraw/zinc/07/45/01/528074501.db2.gz SMNCTWGPJMRVHG-XQQFMLRXSA-N 1 1 215.356 3.635 20 0 BHADMO CCC[C@H](C)[C@H]1CCC[N@H+]1CC[C@@H](C)F ZINC000509344145 528082317 /nfs/dbraw/zinc/08/23/17/528082317.db2.gz SMNCTWGPJMRVHG-YNEHKIRRSA-N 1 1 215.356 3.635 20 0 BHADMO CCCCC[C@@H]1CCC[N@H+]1CCCCF ZINC000509346907 528261293 /nfs/dbraw/zinc/26/12/93/528261293.db2.gz YSENAPFIEDOLHS-CYBMUJFWSA-N 1 1 215.356 3.781 20 0 BHADMO CCCCC[C@H]1CCC[N@H+]1CCCCF ZINC000509346908 528274967 /nfs/dbraw/zinc/27/49/67/528274967.db2.gz YSENAPFIEDOLHS-ZDUSSCGKSA-N 1 1 215.356 3.781 20 0 BHADMO CC[C@@H](C)C[N@@H+](C)Cc1cc(F)c(F)cc1F ZINC000509347826 529314751 /nfs/dbraw/zinc/31/47/51/529314751.db2.gz FMJVTDYMILHICL-SECBINFHSA-N 1 1 245.288 3.582 20 0 BHADMO CC[C@H](C)C[N@@H+](C)Cc1cc(F)c(F)cc1F ZINC000509347827 529650790 /nfs/dbraw/zinc/65/07/90/529650790.db2.gz FMJVTDYMILHICL-VIFPVBQESA-N 1 1 245.288 3.582 20 0 BHADMO CC(C)C[N@@H+](Cc1ccccc1N(C)C)C(C)C ZINC000509355882 527949477 /nfs/dbraw/zinc/94/94/77/527949477.db2.gz FPRWQMNXLBXSLL-UHFFFAOYSA-N 1 1 248.414 3.619 20 0 BHADMO CCC[C@@H]1[C@H](C)CCC[N@H+]1CCCCF ZINC000509363787 527877401 /nfs/dbraw/zinc/87/74/01/527877401.db2.gz BWPDOMYJGYHLCG-CHWSQXEVSA-N 1 1 215.356 3.637 20 0 BHADMO CCC[C@H]1[C@H](C)CCC[N@H+]1CCCCF ZINC000509363788 528444521 /nfs/dbraw/zinc/44/45/21/528444521.db2.gz BWPDOMYJGYHLCG-OLZOCXBDSA-N 1 1 215.356 3.637 20 0 BHADMO CCC[C@@H]1[C@@H](C)CCC[N@H+]1CCCCF ZINC000509363791 527876533 /nfs/dbraw/zinc/87/65/33/527876533.db2.gz BWPDOMYJGYHLCG-QWHCGFSZSA-N 1 1 215.356 3.637 20 0 BHADMO CCC[C@H]1[C@@H](C)CCC[N@H+]1CCCCF ZINC000509363792 528442405 /nfs/dbraw/zinc/44/24/05/528442405.db2.gz BWPDOMYJGYHLCG-STQMWFEESA-N 1 1 215.356 3.637 20 0 BHADMO CCC[C@@H]1[C@H](C)CCC[N@H+]1CC[C@H](C)F ZINC000509367781 527878100 /nfs/dbraw/zinc/87/81/00/527878100.db2.gz VUQDXHUEJWDNSR-FRRDWIJNSA-N 1 1 215.356 3.635 20 0 BHADMO CCC[C@@H]1[C@H](C)CCC[N@H+]1CC[C@@H](C)F ZINC000509367782 527877714 /nfs/dbraw/zinc/87/77/14/527877714.db2.gz VUQDXHUEJWDNSR-JHJVBQTASA-N 1 1 215.356 3.635 20 0 BHADMO CCC[C@@H]1[C@@H](C)CCC[N@H+]1CC[C@H](C)F ZINC000509367783 527875773 /nfs/dbraw/zinc/87/57/73/527875773.db2.gz VUQDXHUEJWDNSR-RWMBFGLXSA-N 1 1 215.356 3.635 20 0 BHADMO CCC[C@@H]1[C@@H](C)CCC[N@H+]1CC[C@@H](C)F ZINC000509367784 527876642 /nfs/dbraw/zinc/87/66/42/527876642.db2.gz VUQDXHUEJWDNSR-YNEHKIRRSA-N 1 1 215.356 3.635 20 0 BHADMO CCOc1cccc(C[N@@H+](C)C[C@H](C)CC)c1 ZINC000509372409 528643131 /nfs/dbraw/zinc/64/31/31/528643131.db2.gz MTFPGRKVFLUEHW-CYBMUJFWSA-N 1 1 235.371 3.563 20 0 BHADMO CCOc1cccc(C[N@@H+](C)C[C@@H](C)CC)c1 ZINC000509372410 528642969 /nfs/dbraw/zinc/64/29/69/528642969.db2.gz MTFPGRKVFLUEHW-ZDUSSCGKSA-N 1 1 235.371 3.563 20 0 BHADMO CC(C)C[N@@H+](Cc1cccc(F)c1F)C(C)C ZINC000509384163 527945201 /nfs/dbraw/zinc/94/52/01/527945201.db2.gz GHIDFEFARRDHGM-UHFFFAOYSA-N 1 1 241.325 3.831 20 0 BHADMO CC(C)C[N@@H+](Cc1ccc(Cl)o1)C(C)C ZINC000509387281 527944459 /nfs/dbraw/zinc/94/44/59/527944459.db2.gz NZXRADNOLUSNAM-UHFFFAOYSA-N 1 1 229.751 3.799 20 0 BHADMO CC(C)C[N@@H+](C[C@H]1CC=CCC1)C(C)C ZINC000509387650 527945601 /nfs/dbraw/zinc/94/56/01/527945601.db2.gz OTZLHYZEQGYDFD-AWEZNQCLSA-N 1 1 209.377 3.709 20 0 BHADMO CC(C)C[N@@H+](C[C@@H]1CC=CCC1)C(C)C ZINC000509387653 527943766 /nfs/dbraw/zinc/94/37/66/527943766.db2.gz OTZLHYZEQGYDFD-CQSZACIVSA-N 1 1 209.377 3.709 20 0 BHADMO C[C@@H](F)CC[N@@H+]([C@H](C)c1ccccc1)C1CC1 ZINC000509391097 534275411 /nfs/dbraw/zinc/27/54/11/534275411.db2.gz DBHRPUYVRWLTQL-CHWSQXEVSA-N 1 1 235.346 3.960 20 0 BHADMO C[C@@H](F)CC[N@@H+]([C@@H](C)c1ccccc1)C1CC1 ZINC000509391098 534275260 /nfs/dbraw/zinc/27/52/60/534275260.db2.gz DBHRPUYVRWLTQL-OLZOCXBDSA-N 1 1 235.346 3.960 20 0 BHADMO C[C@H](c1ccccc1)[N@H+](CC[C@H](C)F)C1CC1 ZINC000509391099 229272655 /nfs/dbraw/zinc/27/26/55/229272655.db2.gz DBHRPUYVRWLTQL-QWHCGFSZSA-N 1 1 235.346 3.960 20 0 BHADMO C[C@H](F)CC[N@@H+]([C@@H](C)c1ccccc1)C1CC1 ZINC000509391100 229273058 /nfs/dbraw/zinc/27/30/58/229273058.db2.gz DBHRPUYVRWLTQL-STQMWFEESA-N 1 1 235.346 3.960 20 0 BHADMO CC[C@H](C)C[N@@H+](C)C[C@@H]1C[C@@H]1c1ccccc1 ZINC000509393911 529651205 /nfs/dbraw/zinc/65/12/05/529651205.db2.gz TXFWASPTTTWBCF-CWRNSKLLSA-N 1 1 231.383 3.768 20 0 BHADMO CC[C@H](C)C[N@@H+](C)C[C@H]1C[C@H]1c1ccccc1 ZINC000509393912 529651091 /nfs/dbraw/zinc/65/10/91/529651091.db2.gz TXFWASPTTTWBCF-IMJJTQAJSA-N 1 1 231.383 3.768 20 0 BHADMO CC[C@H](C)C[N@@H+](C)C[C@H]1C[C@@H]1c1ccccc1 ZINC000509393913 529650739 /nfs/dbraw/zinc/65/07/39/529650739.db2.gz TXFWASPTTTWBCF-NUEKZKHPSA-N 1 1 231.383 3.768 20 0 BHADMO C[C@H](c1ccccc1)[N@@H+](CCCCF)C1CC1 ZINC000509394593 229272632 /nfs/dbraw/zinc/27/26/32/229272632.db2.gz ZLWVAEIDANTZLA-CYBMUJFWSA-N 1 1 235.346 3.962 20 0 BHADMO C[C@@H](c1ccccc1)[N@@H+](CCCCF)C1CC1 ZINC000509394594 534104319 /nfs/dbraw/zinc/10/43/19/534104319.db2.gz ZLWVAEIDANTZLA-ZDUSSCGKSA-N 1 1 235.346 3.962 20 0 BHADMO CC[C@@H](C)C[N@@H+](C)Cc1cccc2cc[nH]c21 ZINC000509399231 529314257 /nfs/dbraw/zinc/31/42/57/529314257.db2.gz AYNFFMHHMGADRU-GFCCVEGCSA-N 1 1 230.355 3.646 20 0 BHADMO CC[C@H](C)C[N@@H+](C)Cc1cccc2cc[nH]c21 ZINC000509399232 529650798 /nfs/dbraw/zinc/65/07/98/529650798.db2.gz AYNFFMHHMGADRU-LBPRGKRZSA-N 1 1 230.355 3.646 20 0 BHADMO CC[C@H](C)C[N@@H+](C)C/C=C\c1ccccc1OC ZINC000509400880 529650898 /nfs/dbraw/zinc/65/08/98/529650898.db2.gz QVQGVTGKKTXDBH-GDAGCXPBSA-N 1 1 247.382 3.686 20 0 BHADMO CC[C@H](C)C[N@@H+](C)C/C=C/c1ccccc1OC ZINC000509400881 529651175 /nfs/dbraw/zinc/65/11/75/529651175.db2.gz QVQGVTGKKTXDBH-PLWJUESGSA-N 1 1 247.382 3.686 20 0 BHADMO CC[C@@H](C)C[N@@H+](C)C/C=C\c1ccccc1OC ZINC000509400883 529313553 /nfs/dbraw/zinc/31/35/53/529313553.db2.gz QVQGVTGKKTXDBH-QQBNSCQMSA-N 1 1 247.382 3.686 20 0 BHADMO CC[C@@H](C)C[N@@H+](C)C/C=C/c1ccccc1OC ZINC000509400885 529314084 /nfs/dbraw/zinc/31/40/84/529314084.db2.gz QVQGVTGKKTXDBH-QSYFUGGGSA-N 1 1 247.382 3.686 20 0 BHADMO CC[C@@H](C)C[N@@H+](C)Cc1cc(F)c(F)c(F)c1 ZINC000509402008 529314773 /nfs/dbraw/zinc/31/47/73/529314773.db2.gz VRACREJGFWCHIM-SECBINFHSA-N 1 1 245.288 3.582 20 0 BHADMO CC[C@H](C)C[N@@H+](C)Cc1cc(F)c(F)c(F)c1 ZINC000509402009 529650907 /nfs/dbraw/zinc/65/09/07/529650907.db2.gz VRACREJGFWCHIM-VIFPVBQESA-N 1 1 245.288 3.582 20 0 BHADMO CCc1ccc(C[N@@H+](CC(C)C)C(C)C)o1 ZINC000509406572 529636875 /nfs/dbraw/zinc/63/68/75/529636875.db2.gz XOJQLOLUJSAWEP-UHFFFAOYSA-N 1 1 223.360 3.708 20 0 BHADMO CCC[N@@H+]1CC=C(c2ccc(OCC)cc2)CC1 ZINC000509433413 528181077 /nfs/dbraw/zinc/18/10/77/528181077.db2.gz CZRLWSNVFQFYES-UHFFFAOYSA-N 1 1 245.366 3.584 20 0 BHADMO Clc1ccccc1C1=CC[N@@H+](CC2CC2)CC1 ZINC000509466838 229275902 /nfs/dbraw/zinc/27/59/02/229275902.db2.gz ZHOAOSBHCBPRNB-UHFFFAOYSA-N 1 1 247.769 3.839 20 0 BHADMO CC(C)[N@@H+]1CC=C(c2ccccc2Cl)CC1 ZINC000509481439 528985816 /nfs/dbraw/zinc/98/58/16/528985816.db2.gz UBNMZFFDHLTMIV-UHFFFAOYSA-N 1 1 235.758 3.838 20 0 BHADMO CCC[N@@H+]1CC=C(c2ccccc2Cl)CC1 ZINC000509516160 528180630 /nfs/dbraw/zinc/18/06/30/528180630.db2.gz JYFZLCYZDIRGBA-UHFFFAOYSA-N 1 1 235.758 3.839 20 0 BHADMO CC[C@@H]1CCC[N@@H+](Cc2ccc(C)s2)C1 ZINC000509544874 529298334 /nfs/dbraw/zinc/29/83/34/529298334.db2.gz RXKDGINRTLVDBW-GFCCVEGCSA-N 1 1 223.385 3.679 20 0 BHADMO CC[C@H]1CCC[N@@H+](Cc2ccc(C)s2)C1 ZINC000509544875 529216752 /nfs/dbraw/zinc/21/67/52/529216752.db2.gz RXKDGINRTLVDBW-LBPRGKRZSA-N 1 1 223.385 3.679 20 0 BHADMO CC[C@@H]1CCC[N@@H+](Cc2cccc(F)c2F)C1 ZINC000509546085 529298549 /nfs/dbraw/zinc/29/85/49/529298549.db2.gz UKYWYXWPFCIJQE-LLVKDONJSA-N 1 1 239.309 3.587 20 0 BHADMO CC[C@H]1CCC[N@@H+](Cc2cccc(F)c2F)C1 ZINC000509546087 529216992 /nfs/dbraw/zinc/21/69/92/529216992.db2.gz UKYWYXWPFCIJQE-NSHDSACASA-N 1 1 239.309 3.587 20 0 BHADMO CC[C@@H]1CCC[N@@H+](Cc2sccc2C)C1 ZINC000509549553 529299421 /nfs/dbraw/zinc/29/94/21/529299421.db2.gz OTDRHSYKGWGKKB-GFCCVEGCSA-N 1 1 223.385 3.679 20 0 BHADMO CC[C@H]1CCC[N@@H+](Cc2sccc2C)C1 ZINC000509549555 529218051 /nfs/dbraw/zinc/21/80/51/529218051.db2.gz OTDRHSYKGWGKKB-LBPRGKRZSA-N 1 1 223.385 3.679 20 0 BHADMO CC[C@@H]1CCC[N@@H+](Cc2cccc3cc[nH]c32)C1 ZINC000509562085 529298759 /nfs/dbraw/zinc/29/87/59/529298759.db2.gz XUOCPTNFSMFYCO-CYBMUJFWSA-N 1 1 242.366 3.790 20 0 BHADMO CC[C@H]1CCC[N@@H+](Cc2cccc3cc[nH]c32)C1 ZINC000509562086 529216940 /nfs/dbraw/zinc/21/69/40/529216940.db2.gz XUOCPTNFSMFYCO-ZDUSSCGKSA-N 1 1 242.366 3.790 20 0 BHADMO CC[C@@H]1CCC[N@@H+](Cc2cccc3[nH]ccc32)C1 ZINC000509574450 529298564 /nfs/dbraw/zinc/29/85/64/529298564.db2.gz JAZIVOGEPGCIMJ-CYBMUJFWSA-N 1 1 242.366 3.790 20 0 BHADMO CC[C@H]1CCC[N@@H+](Cc2cccc3[nH]ccc32)C1 ZINC000509574454 529216879 /nfs/dbraw/zinc/21/68/79/529216879.db2.gz JAZIVOGEPGCIMJ-ZDUSSCGKSA-N 1 1 242.366 3.790 20 0 BHADMO C[N@@H+](CCCCc1ccccc1)Cc1ccco1 ZINC000509585548 529885505 /nfs/dbraw/zinc/88/55/05/529885505.db2.gz GQMBKNNKYTXYFH-UHFFFAOYSA-N 1 1 243.350 3.734 20 0 BHADMO C[N@H+](Cc1cc(Cl)cc(Cl)c1)CC1CC1 ZINC000509585645 529977518 /nfs/dbraw/zinc/97/75/18/529977518.db2.gz GYYIQXGYKWZVFC-UHFFFAOYSA-N 1 1 244.165 3.835 20 0 BHADMO CCC[N@H+](CCc1cccs1)CC[C@@H](C)F ZINC000509617435 528116026 /nfs/dbraw/zinc/11/60/26/528116026.db2.gz AEPDZEXXJVYHRW-GFCCVEGCSA-N 1 1 243.391 3.751 20 0 BHADMO CCC[N@H+](CCc1cccs1)CC[C@H](C)F ZINC000509617436 528115042 /nfs/dbraw/zinc/11/50/42/528115042.db2.gz AEPDZEXXJVYHRW-LBPRGKRZSA-N 1 1 243.391 3.751 20 0 BHADMO CC[C@H]1Cc2ccccc2C[N@H+]1CC[C@@H](C)F ZINC000509619791 529330098 /nfs/dbraw/zinc/33/00/98/529330098.db2.gz RYYDUMKCWDIUAF-DOMZBBRYSA-N 1 1 235.346 3.571 20 0 BHADMO CC[C@@H]1Cc2ccccc2C[N@H+]1CC[C@@H](C)F ZINC000509619793 529463152 /nfs/dbraw/zinc/46/31/52/529463152.db2.gz RYYDUMKCWDIUAF-IUODEOHRSA-N 1 1 235.346 3.571 20 0 BHADMO CC[C@@H]1Cc2ccccc2C[N@H+]1CC[C@H](C)F ZINC000509619795 529463099 /nfs/dbraw/zinc/46/30/99/529463099.db2.gz RYYDUMKCWDIUAF-SWLSCSKDSA-N 1 1 235.346 3.571 20 0 BHADMO CC[C@H]1Cc2ccccc2C[N@H+]1CC[C@H](C)F ZINC000509619796 529330016 /nfs/dbraw/zinc/33/00/16/529330016.db2.gz RYYDUMKCWDIUAF-WFASDCNBSA-N 1 1 235.346 3.571 20 0 BHADMO C[C@H](F)CC[N@H+]1CCCC[C@@H]1c1ccccc1 ZINC000509625217 488314684 /nfs/dbraw/zinc/31/46/84/488314684.db2.gz KHNOVRBDQICQSI-DZGCQCFKSA-N 1 1 235.346 3.962 20 0 BHADMO C[C@@H](F)CC[N@H+]1CCCC[C@H]1c1ccccc1 ZINC000509625221 488314815 /nfs/dbraw/zinc/31/48/15/488314815.db2.gz KHNOVRBDQICQSI-HIFRSBDPSA-N 1 1 235.346 3.962 20 0 BHADMO C[C@@H](F)CC[N@H+]1CCCC[C@@H]1c1ccccc1 ZINC000509625223 488314984 /nfs/dbraw/zinc/31/49/84/488314984.db2.gz KHNOVRBDQICQSI-UKRRQHHQSA-N 1 1 235.346 3.962 20 0 BHADMO C[C@H](F)CC[N@H+]1CCCC[C@H]1c1ccccc1 ZINC000509625226 488314904 /nfs/dbraw/zinc/31/49/04/488314904.db2.gz KHNOVRBDQICQSI-ZFWWWQNUSA-N 1 1 235.346 3.962 20 0 BHADMO CCC[N@@H+](CCCCF)CCc1cccs1 ZINC000509625689 528063906 /nfs/dbraw/zinc/06/39/06/528063906.db2.gz ZTZTWPXANNZVRO-UHFFFAOYSA-N 1 1 243.391 3.752 20 0 BHADMO FCCCC[N@H+]1CCCC[C@H]1c1ccccc1 ZINC000509627279 488314824 /nfs/dbraw/zinc/31/48/24/488314824.db2.gz YCBTXTMEDMMMCE-HNNXBMFYSA-N 1 1 235.346 3.963 20 0 BHADMO FCCCC[N@H+]1CCCC[C@@H]1c1ccccc1 ZINC000509627280 488314907 /nfs/dbraw/zinc/31/49/07/488314907.db2.gz YCBTXTMEDMMMCE-OAHLLOKOSA-N 1 1 235.346 3.963 20 0 BHADMO C[C@@H](F)CC[N@H+]1CCC[C@]1(C)Cc1ccccc1 ZINC000509636401 534276186 /nfs/dbraw/zinc/27/61/86/534276186.db2.gz HEGJHUIOZAETBD-GDBMZVCRSA-N 1 1 249.373 3.832 20 0 BHADMO C[C@H](F)CC[N@H+]1CCC[C@]1(C)Cc1ccccc1 ZINC000509636402 229278286 /nfs/dbraw/zinc/27/82/86/229278286.db2.gz HEGJHUIOZAETBD-GOEBONIOSA-N 1 1 249.373 3.832 20 0 BHADMO C[C@H](F)CC[N@H+]1CCC[C@@]1(C)Cc1ccccc1 ZINC000509636403 229279154 /nfs/dbraw/zinc/27/91/54/229279154.db2.gz HEGJHUIOZAETBD-HOCLYGCPSA-N 1 1 249.373 3.832 20 0 BHADMO C[C@@H](F)CC[N@H+]1CCC[C@@]1(C)Cc1ccccc1 ZINC000509636404 534276591 /nfs/dbraw/zinc/27/65/91/534276591.db2.gz HEGJHUIOZAETBD-ZBFHGGJFSA-N 1 1 249.373 3.832 20 0 BHADMO Cc1ccccc1C[C@H]1CCC[N@@H+]1CC[C@@H](C)F ZINC000509639752 229279905 /nfs/dbraw/zinc/27/99/05/229279905.db2.gz DOKVEJLNSJENFA-GDBMZVCRSA-N 1 1 249.373 3.750 20 0 BHADMO Cc1ccccc1C[C@H]1CCC[N@@H+]1CC[C@H](C)F ZINC000509639754 229280012 /nfs/dbraw/zinc/28/00/12/229280012.db2.gz DOKVEJLNSJENFA-GOEBONIOSA-N 1 1 249.373 3.750 20 0 BHADMO Cc1ccccc1C[C@@H]1CCC[N@@H+]1CC[C@H](C)F ZINC000509639755 534815515 /nfs/dbraw/zinc/81/55/15/534815515.db2.gz DOKVEJLNSJENFA-HOCLYGCPSA-N 1 1 249.373 3.750 20 0 BHADMO Cc1ccccc1C[C@@H]1CCC[N@@H+]1CC[C@@H](C)F ZINC000509639756 534816810 /nfs/dbraw/zinc/81/68/10/534816810.db2.gz DOKVEJLNSJENFA-ZBFHGGJFSA-N 1 1 249.373 3.750 20 0 BHADMO C[C@@]1(Cc2ccccc2)CCC[N@H+]1CCCCF ZINC000509640825 534270115 /nfs/dbraw/zinc/27/01/15/534270115.db2.gz NZIOQWWLBSMKJZ-INIZCTEOSA-N 1 1 249.373 3.833 20 0 BHADMO C[C@]1(Cc2ccccc2)CCC[N@H+]1CCCCF ZINC000509640827 229279801 /nfs/dbraw/zinc/27/98/01/229279801.db2.gz NZIOQWWLBSMKJZ-MRXNPFEDSA-N 1 1 249.373 3.833 20 0 BHADMO CCC1CCC([N@@H+](C)CC[C@H](C)F)CC1 ZINC000509642023 527841543 /nfs/dbraw/zinc/84/15/43/527841543.db2.gz IQMMDPOKALVIGM-HIFPTAJRSA-N 1 1 215.356 3.635 20 0 BHADMO CCC1CCC([N@@H+](C)CC[C@@H](C)F)CC1 ZINC000509642029 527840818 /nfs/dbraw/zinc/84/08/18/527840818.db2.gz IQMMDPOKALVIGM-PNESKVBLSA-N 1 1 215.356 3.635 20 0 BHADMO CCC1CCC([N@@H+](C)CCCCF)CC1 ZINC000509643193 527840579 /nfs/dbraw/zinc/84/05/79/527840579.db2.gz MTNRTQVMXMXEKO-UHFFFAOYSA-N 1 1 215.356 3.637 20 0 BHADMO C[C@H](F)CC[N@H+]1CC[C@H]1c1ccc(Cl)cc1 ZINC000509643436 229279719 /nfs/dbraw/zinc/27/97/19/229279719.db2.gz NQNUQZVPCMLOKX-GWCFXTLKSA-N 1 1 241.737 3.835 20 0 BHADMO C[C@H](F)CC[N@H+]1CC[C@@H]1c1ccc(Cl)cc1 ZINC000509643444 229279784 /nfs/dbraw/zinc/27/97/84/229279784.db2.gz NQNUQZVPCMLOKX-GXFFZTMASA-N 1 1 241.737 3.835 20 0 BHADMO C[C@@H](F)CC[N@H+]1CC[C@H]1c1ccc(Cl)cc1 ZINC000509643446 534277020 /nfs/dbraw/zinc/27/70/20/534277020.db2.gz NQNUQZVPCMLOKX-MFKMUULPSA-N 1 1 241.737 3.835 20 0 BHADMO C[C@@H](F)CC[N@H+]1CC[C@@H]1c1ccc(Cl)cc1 ZINC000509643448 534277110 /nfs/dbraw/zinc/27/71/10/534277110.db2.gz NQNUQZVPCMLOKX-ZWNOBZJWSA-N 1 1 241.737 3.835 20 0 BHADMO Cc1ccccc1C[C@@H]1CCC[N@H+]1CCCCF ZINC000509644489 534816766 /nfs/dbraw/zinc/81/67/66/534816766.db2.gz SLYQVVSNMDFBOB-INIZCTEOSA-N 1 1 249.373 3.752 20 0 BHADMO Cc1ccccc1C[C@H]1CCC[N@H+]1CCCCF ZINC000509644490 229280044 /nfs/dbraw/zinc/28/00/44/229280044.db2.gz SLYQVVSNMDFBOB-MRXNPFEDSA-N 1 1 249.373 3.752 20 0 BHADMO CC[C@H](C)[C@@H](C)[N@@H+](CC[C@@H](C)F)C1CC1 ZINC000509648513 529202786 /nfs/dbraw/zinc/20/27/86/529202786.db2.gz BTDVKBSDQWUFNI-QJPTWQEYSA-N 1 1 215.356 3.634 20 0 BHADMO CC[C@H](C)[C@@H](C)[N@@H+](CC[C@H](C)F)C1CC1 ZINC000509648514 529202868 /nfs/dbraw/zinc/20/28/68/529202868.db2.gz BTDVKBSDQWUFNI-SDDRHHMPSA-N 1 1 215.356 3.634 20 0 BHADMO CC[C@H](C)[C@H](C)[N@@H+](CC[C@H](C)F)C1CC1 ZINC000509648515 529238038 /nfs/dbraw/zinc/23/80/38/529238038.db2.gz BTDVKBSDQWUFNI-SRVKXCTJSA-N 1 1 215.356 3.634 20 0 BHADMO CC[C@H](C)[C@H](C)[N@@H+](CC[C@@H](C)F)C1CC1 ZINC000509648516 529238058 /nfs/dbraw/zinc/23/80/58/529238058.db2.gz BTDVKBSDQWUFNI-TUAOUCFPSA-N 1 1 215.356 3.634 20 0 BHADMO CC[C@@H](C)[C@H](C)[N@@H+](CCCCF)C1CC1 ZINC000509650410 529411533 /nfs/dbraw/zinc/41/15/33/529411533.db2.gz HFANVZFKUNGSIH-NEPJUHHUSA-N 1 1 215.356 3.635 20 0 BHADMO CC[C@H](C)[C@@H](C)[N@@H+](CCCCF)C1CC1 ZINC000509650411 529202849 /nfs/dbraw/zinc/20/28/49/529202849.db2.gz HFANVZFKUNGSIH-NWDGAFQWSA-N 1 1 215.356 3.635 20 0 BHADMO CC[C@H](C)[C@H](C)[N@@H+](CCCCF)C1CC1 ZINC000509650412 529238291 /nfs/dbraw/zinc/23/82/91/529238291.db2.gz HFANVZFKUNGSIH-RYUDHWBXSA-N 1 1 215.356 3.635 20 0 BHADMO CC[C@@H](C)[C@@H](C)[N@@H+](CCCCF)C1CC1 ZINC000509650413 529391593 /nfs/dbraw/zinc/39/15/93/529391593.db2.gz HFANVZFKUNGSIH-VXGBXAGGSA-N 1 1 215.356 3.635 20 0 BHADMO C[C@@H]1[C@@H](Cc2ccccc2)CC[N@H+]1CCCCF ZINC000509653590 229280643 /nfs/dbraw/zinc/28/06/43/229280643.db2.gz BDSASBLBKARPRS-GDBMZVCRSA-N 1 1 249.373 3.689 20 0 BHADMO C[C@H]1[C@@H](Cc2ccccc2)CC[N@H+]1CCCCF ZINC000509653591 229280437 /nfs/dbraw/zinc/28/04/37/229280437.db2.gz BDSASBLBKARPRS-GOEBONIOSA-N 1 1 249.373 3.689 20 0 BHADMO C[C@H]1[C@H](Cc2ccccc2)CC[N@H+]1CCCCF ZINC000509653592 229280485 /nfs/dbraw/zinc/28/04/85/229280485.db2.gz BDSASBLBKARPRS-HOCLYGCPSA-N 1 1 249.373 3.689 20 0 BHADMO C[C@@H]1[C@H](Cc2ccccc2)CC[N@H+]1CCCCF ZINC000509653593 229279389 /nfs/dbraw/zinc/27/93/89/229279389.db2.gz BDSASBLBKARPRS-ZBFHGGJFSA-N 1 1 249.373 3.689 20 0 BHADMO C[C@H](F)CC[N@H+]1CC[C@@H](Cc2ccccc2)[C@@H]1C ZINC000509654208 229279915 /nfs/dbraw/zinc/27/99/15/229279915.db2.gz CYLIMLWQSLPHQG-DZKIICNBSA-N 1 1 249.373 3.688 20 0 BHADMO C[C@H](F)CC[N@H+]1CC[C@@H](Cc2ccccc2)[C@H]1C ZINC000509654210 229279480 /nfs/dbraw/zinc/27/94/80/229279480.db2.gz CYLIMLWQSLPHQG-LZWOXQAQSA-N 1 1 249.373 3.688 20 0 BHADMO C[C@H](F)CC[N@H+]1CC[C@H](Cc2ccccc2)[C@@H]1C ZINC000509654212 229280544 /nfs/dbraw/zinc/28/05/44/229280544.db2.gz CYLIMLWQSLPHQG-OFQRWUPVSA-N 1 1 249.373 3.688 20 0 BHADMO C[C@H](F)CC[N@H+]1CC[C@H](Cc2ccccc2)[C@H]1C ZINC000509654214 229280611 /nfs/dbraw/zinc/28/06/11/229280611.db2.gz CYLIMLWQSLPHQG-SQWLQELKSA-N 1 1 249.373 3.688 20 0 BHADMO FCCCC[N@H+]1CCC[C@@H](Cc2ccccc2)C1 ZINC000509656772 229279684 /nfs/dbraw/zinc/27/96/84/229279684.db2.gz KKIWKOLAQZFSKN-INIZCTEOSA-N 1 1 249.373 3.691 20 0 BHADMO FCCCC[N@H+]1CCC[C@H](Cc2ccccc2)C1 ZINC000509656773 229279508 /nfs/dbraw/zinc/27/95/08/229279508.db2.gz KKIWKOLAQZFSKN-MRXNPFEDSA-N 1 1 249.373 3.691 20 0 BHADMO C[C@@H](F)CC[N@H+]1CCC[C@H](Cc2ccccc2)C1 ZINC000509658424 534276126 /nfs/dbraw/zinc/27/61/26/534276126.db2.gz QIXCVNYWONGARO-GDBMZVCRSA-N 1 1 249.373 3.689 20 0 BHADMO C[C@H](F)CC[N@H+]1CCC[C@H](Cc2ccccc2)C1 ZINC000509658425 229279335 /nfs/dbraw/zinc/27/93/35/229279335.db2.gz QIXCVNYWONGARO-GOEBONIOSA-N 1 1 249.373 3.689 20 0 BHADMO C[C@H](F)CC[N@H+]1CCC[C@@H](Cc2ccccc2)C1 ZINC000509658426 229280090 /nfs/dbraw/zinc/28/00/90/229280090.db2.gz QIXCVNYWONGARO-HOCLYGCPSA-N 1 1 249.373 3.689 20 0 BHADMO 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20 0 BHADMO C[C@H](F)CC[N@H+]1CC[C@@H](c2ccccc2)[C@H](C)C1 ZINC000509659954 229280256 /nfs/dbraw/zinc/28/02/56/229280256.db2.gz ZINYRWYECDJATR-IJEWVQPXSA-N 1 1 249.373 3.860 20 0 BHADMO C[C@H](F)CC[N@H+]1CC[C@@H](c2ccccc2)[C@@H](C)C1 ZINC000509659955 229279965 /nfs/dbraw/zinc/27/99/65/229279965.db2.gz ZINYRWYECDJATR-OFQRWUPVSA-N 1 1 249.373 3.860 20 0 BHADMO C[C@H](F)CC[N@H+]1CC[C@H](c2ccccc2)[C@H](C)C1 ZINC000509659956 229280577 /nfs/dbraw/zinc/28/05/77/229280577.db2.gz ZINYRWYECDJATR-YCPHGPKFSA-N 1 1 249.373 3.860 20 0 BHADMO C[C@@H](F)CC[N@H+]1CCCCC[C@@H]1c1ccco1 ZINC000509663461 534276578 /nfs/dbraw/zinc/27/65/78/534276578.db2.gz DEIXAQYCRAXUII-CHWSQXEVSA-N 1 1 239.334 3.945 20 0 BHADMO C[C@@H](F)CC[N@H+]1CCCCC[C@H]1c1ccco1 ZINC000509663463 534276272 /nfs/dbraw/zinc/27/62/72/534276272.db2.gz DEIXAQYCRAXUII-OLZOCXBDSA-N 1 1 239.334 3.945 20 0 BHADMO C[C@H](F)CC[N@H+]1CCCCC[C@@H]1c1ccco1 ZINC000509663465 229281200 /nfs/dbraw/zinc/28/12/00/229281200.db2.gz DEIXAQYCRAXUII-QWHCGFSZSA-N 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3.606 20 0 BHADMO Cc1ccc(C[C@@H](C)[N@H+](C)CC[C@@H](C)F)cc1 ZINC000509685029 534113873 /nfs/dbraw/zinc/11/38/73/534113873.db2.gz MLZBSQRQDFBUEJ-ZIAGYGMSSA-N 1 1 237.362 3.606 20 0 BHADMO CC(C)(C)[C@@H]1CCC[N@@H+](CCCCF)CC1 ZINC000509688070 526652953 /nfs/dbraw/zinc/65/29/53/526652953.db2.gz LDUCWKIWIZFSIT-CYBMUJFWSA-N 1 1 229.383 3.884 20 0 BHADMO CC(C)(C)[C@H]1CCC[N@@H+](CCCCF)CC1 ZINC000509688072 526720595 /nfs/dbraw/zinc/72/05/95/526720595.db2.gz LDUCWKIWIZFSIT-ZDUSSCGKSA-N 1 1 229.383 3.884 20 0 BHADMO COCCCC[N@H+]1CCC[C@H](C(C)(C)C)CC1 ZINC000509689595 229283940 /nfs/dbraw/zinc/28/39/40/229283940.db2.gz VEKJGDMYRRMUAK-AWEZNQCLSA-N 1 1 241.419 3.561 20 0 BHADMO COCCCC[N@H+]1CCC[C@@H](C(C)(C)C)CC1 ZINC000509689596 229283655 /nfs/dbraw/zinc/28/36/55/229283655.db2.gz VEKJGDMYRRMUAK-CQSZACIVSA-N 1 1 241.419 3.561 20 0 BHADMO FCCCC[N@H+]1CCCC2(CCCCC2)C1 ZINC000509693577 229283689 /nfs/dbraw/zinc/28/36/89/229283689.db2.gz ABZNOKYXRXOWIZ-UHFFFAOYSA-N 1 1 227.367 3.782 20 0 BHADMO FCCCC[N@H+]1CCCC[C@H]1Cc1ccccc1 ZINC000509694043 229282812 /nfs/dbraw/zinc/28/28/12/229282812.db2.gz BWDDWPXQQSDSRJ-INIZCTEOSA-N 1 1 249.373 3.833 20 0 BHADMO FCCCC[N@H+]1CCCC[C@@H]1Cc1ccccc1 ZINC000509694044 229283582 /nfs/dbraw/zinc/28/35/82/229283582.db2.gz BWDDWPXQQSDSRJ-MRXNPFEDSA-N 1 1 249.373 3.833 20 0 BHADMO C[C@H](F)CC[N@H+]1C[C@@H](c2ccccc2)C[C@H]1C ZINC000509694652 229283730 /nfs/dbraw/zinc/28/37/30/229283730.db2.gz DSNFUEDIIDBVQO-GUTXKFCHSA-N 1 1 235.346 3.613 20 0 BHADMO C[C@H](F)CC[N@H+]1C[C@H](c2ccccc2)C[C@H]1C ZINC000509694654 229283949 /nfs/dbraw/zinc/28/39/49/229283949.db2.gz DSNFUEDIIDBVQO-GZBFAFLISA-N 1 1 235.346 3.613 20 0 BHADMO C[C@H](F)CC[N@H+]1C[C@H](c2ccccc2)C[C@@H]1C ZINC000509694655 229283898 /nfs/dbraw/zinc/28/38/98/229283898.db2.gz DSNFUEDIIDBVQO-KCQAQPDRSA-N 1 1 235.346 3.613 20 0 BHADMO C[C@H](F)CC[N@H+]1C[C@@H](c2ccccc2)C[C@@H]1C ZINC000509694656 229282789 /nfs/dbraw/zinc/28/27/89/229282789.db2.gz DSNFUEDIIDBVQO-YDHLFZDLSA-N 1 1 235.346 3.613 20 0 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/nfs/dbraw/zinc/58/45/18/528584518.db2.gz WHOSVBLDNDGPHJ-FRRDWIJNSA-N 1 1 215.356 3.635 20 0 BHADMO CC[N@@H+](CC[C@H](C)F)[C@@H]1CCCC[C@@H]1C ZINC000510767525 528585653 /nfs/dbraw/zinc/58/56/53/528585653.db2.gz WHOSVBLDNDGPHJ-RWMBFGLXSA-N 1 1 215.356 3.635 20 0 BHADMO CC(C)C1CCC([N@@H+](C)CCCCF)CC1 ZINC000510776263 527640448 /nfs/dbraw/zinc/64/04/48/527640448.db2.gz HNRZIUFBABQDQY-UHFFFAOYSA-N 1 1 229.383 3.883 20 0 BHADMO COCCCC[N@@H+](C)C1CCC(C(C)C)CC1 ZINC000510778473 533251948 /nfs/dbraw/zinc/25/19/48/533251948.db2.gz NMAPICVGJBHVNR-UHFFFAOYSA-N 1 1 241.419 3.560 20 0 BHADMO Cc1ccccc1C[C@H](C)[N@@H+](C)CCCCF ZINC000510779781 229307082 /nfs/dbraw/zinc/30/70/82/229307082.db2.gz LBPOLXRRAFYVBY-AWEZNQCLSA-N 1 1 237.362 3.608 20 0 BHADMO Cc1ccccc1C[C@@H](C)[N@@H+](C)CCCCF ZINC000510779782 229307605 /nfs/dbraw/zinc/30/76/05/229307605.db2.gz LBPOLXRRAFYVBY-CQSZACIVSA-N 1 1 237.362 3.608 20 0 BHADMO CC[C@@H]1CCCC[C@H]1[N@@H+](C)CC[C@@H](C)F ZINC000510782836 529288540 /nfs/dbraw/zinc/28/85/40/529288540.db2.gz WXOWKLRULBUSIQ-JHJVBQTASA-N 1 1 215.356 3.635 20 0 BHADMO CC[C@@H]1CCCC[C@@H]1[N@@H+](C)CC[C@@H](C)F ZINC000510782838 529280573 /nfs/dbraw/zinc/28/05/73/529280573.db2.gz WXOWKLRULBUSIQ-UPJWGTAASA-N 1 1 215.356 3.635 20 0 BHADMO CC[C@@H]1CCCC[C@@H]1[N@@H+](C)CC[C@H](C)F ZINC000510782839 529280767 /nfs/dbraw/zinc/28/07/67/529280767.db2.gz WXOWKLRULBUSIQ-XQQFMLRXSA-N 1 1 215.356 3.635 20 0 BHADMO CC[C@@H]1CCCC[C@H]1[N@@H+](C)CC[C@H](C)F ZINC000510782840 529288358 /nfs/dbraw/zinc/28/83/58/529288358.db2.gz WXOWKLRULBUSIQ-YNEHKIRRSA-N 1 1 215.356 3.635 20 0 BHADMO CC[C@@H]1CCCC[C@H]1[N@@H+](C)CCCCF ZINC000510784075 529288418 /nfs/dbraw/zinc/28/84/18/529288418.db2.gz ZSCDMHLCEHIQTF-CHWSQXEVSA-N 1 1 215.356 3.637 20 0 BHADMO CC[C@@H]1CCCC[C@@H]1[N@@H+](C)CCCCF ZINC000510784076 529280258 /nfs/dbraw/zinc/28/02/58/529280258.db2.gz ZSCDMHLCEHIQTF-OLZOCXBDSA-N 1 1 215.356 3.637 20 0 BHADMO CC[C@H]1CCCC[C@H]1[N@@H+](C)CCCCF ZINC000510784077 529210262 /nfs/dbraw/zinc/21/02/62/529210262.db2.gz ZSCDMHLCEHIQTF-QWHCGFSZSA-N 1 1 215.356 3.637 20 0 BHADMO CC[C@H]1CCCC[C@@H]1[N@@H+](C)CCCCF ZINC000510784078 529205986 /nfs/dbraw/zinc/20/59/86/529205986.db2.gz ZSCDMHLCEHIQTF-STQMWFEESA-N 1 1 215.356 3.637 20 0 BHADMO Cc1ccccc1C[C@H](C)[N@H+](C)CC[C@H](C)F ZINC000510785253 229307586 /nfs/dbraw/zinc/30/75/86/229307586.db2.gz ZROKHYNKVHABFW-KBPBESRZSA-N 1 1 237.362 3.606 20 0 BHADMO Cc1ccccc1C[C@H](C)[N@H+](C)CC[C@@H](C)F ZINC000510785255 229307546 /nfs/dbraw/zinc/30/75/46/229307546.db2.gz ZROKHYNKVHABFW-KGLIPLIRSA-N 1 1 237.362 3.606 20 0 BHADMO Cc1ccccc1C[C@@H](C)[N@H+](C)CC[C@H](C)F ZINC000510785257 229306369 /nfs/dbraw/zinc/30/63/69/229306369.db2.gz ZROKHYNKVHABFW-UONOGXRCSA-N 1 1 237.362 3.606 20 0 BHADMO Cc1ccccc1C[C@@H](C)[N@H+](C)CC[C@@H](C)F ZINC000510785258 229305478 /nfs/dbraw/zinc/30/54/78/229305478.db2.gz ZROKHYNKVHABFW-ZIAGYGMSSA-N 1 1 237.362 3.606 20 0 BHADMO Cc1ccc([C@@]2(C)CC[N@@H+](CCCCF)C2)cc1 ZINC000510813788 229307238 /nfs/dbraw/zinc/30/72/38/229307238.db2.gz RFXNHTRROFGUKY-INIZCTEOSA-N 1 1 249.373 3.708 20 0 BHADMO Cc1ccc([C@]2(C)CC[N@@H+](CCCCF)C2)cc1 ZINC000510813789 229306875 /nfs/dbraw/zinc/30/68/75/229306875.db2.gz RFXNHTRROFGUKY-MRXNPFEDSA-N 1 1 249.373 3.708 20 0 BHADMO Cc1ccc([C@]2(C)CC[N@H+](CC[C@@H](C)F)C2)cc1 ZINC000510814365 229307139 /nfs/dbraw/zinc/30/71/39/229307139.db2.gz SKLRCDBKEQZKIL-GDBMZVCRSA-N 1 1 249.373 3.707 20 0 BHADMO Cc1ccc([C@]2(C)CC[N@H+](CC[C@H](C)F)C2)cc1 ZINC000510814366 229306702 /nfs/dbraw/zinc/30/67/02/229306702.db2.gz SKLRCDBKEQZKIL-GOEBONIOSA-N 1 1 249.373 3.707 20 0 BHADMO Cc1ccc([C@@]2(C)CC[N@H+](CC[C@H](C)F)C2)cc1 ZINC000510814367 229306685 /nfs/dbraw/zinc/30/66/85/229306685.db2.gz SKLRCDBKEQZKIL-HOCLYGCPSA-N 1 1 249.373 3.707 20 0 BHADMO Cc1ccc([C@@]2(C)CC[N@H+](CC[C@@H](C)F)C2)cc1 ZINC000510814368 229307777 /nfs/dbraw/zinc/30/77/77/229307777.db2.gz SKLRCDBKEQZKIL-ZBFHGGJFSA-N 1 1 249.373 3.707 20 0 BHADMO CCc1ccc[nH+]c1N[C@H]1CC[C@H]1C1CCC1 ZINC000510948081 529621509 /nfs/dbraw/zinc/62/15/09/529621509.db2.gz ZMUCYJNBWQTVGV-KBPBESRZSA-N 1 1 230.355 3.635 20 0 BHADMO CCc1ccc[nH+]c1N[C@H]1CC[C@@H]1C1CCC1 ZINC000510948082 529621920 /nfs/dbraw/zinc/62/19/20/529621920.db2.gz ZMUCYJNBWQTVGV-KGLIPLIRSA-N 1 1 230.355 3.635 20 0 BHADMO CCc1ccc[nH+]c1N[C@@H]1CC[C@H]1C1CCC1 ZINC000510948083 529621725 /nfs/dbraw/zinc/62/17/25/529621725.db2.gz ZMUCYJNBWQTVGV-UONOGXRCSA-N 1 1 230.355 3.635 20 0 BHADMO CCc1ccc[nH+]c1N[C@@H]1CC[C@@H]1C1CCC1 ZINC000510948084 529621352 /nfs/dbraw/zinc/62/13/52/529621352.db2.gz ZMUCYJNBWQTVGV-ZIAGYGMSSA-N 1 1 230.355 3.635 20 0 BHADMO CC(C)=CC[N@@H+](Cc1ccccc1F)C1CC1 ZINC000510983699 527428025 /nfs/dbraw/zinc/42/80/25/527428025.db2.gz MFMSXOIRFYXGQU-UHFFFAOYSA-N 1 1 233.330 3.756 20 0 BHADMO CCCCC[N@H+]1CCC=C(c2ccco2)C1 ZINC000511061238 528184425 /nfs/dbraw/zinc/18/44/25/528184425.db2.gz XORXZHAGACBYDQ-UHFFFAOYSA-N 1 1 219.328 3.559 20 0 BHADMO CC(C)(C)CC[N@H+]1CCC=C(c2ccco2)C1 ZINC000511061242 527663204 /nfs/dbraw/zinc/66/32/04/527663204.db2.gz XPZNTMQXJDUPSP-UHFFFAOYSA-N 1 1 233.355 3.805 20 0 BHADMO CSc1ccccc1C[N@@H+](C)C1CCCC1 ZINC000511101748 533038152 /nfs/dbraw/zinc/03/81/52/533038152.db2.gz OPNDWVXDCMROMA-UHFFFAOYSA-N 1 1 235.396 3.783 20 0 BHADMO CSc1ccccc1C[N@@H+](C)CC(C)(C)C ZINC000511102379 533039289 /nfs/dbraw/zinc/03/92/89/533039289.db2.gz SIRJFAXTOCPRGT-UHFFFAOYSA-N 1 1 237.412 3.886 20 0 BHADMO Clc1ccccc1C[C@@H]1CCC[N@H+]1CC1CC1 ZINC000511105373 534652312 /nfs/dbraw/zinc/65/23/12/534652312.db2.gz IZTLMYIVJFFCID-AWEZNQCLSA-N 1 1 249.785 3.757 20 0 BHADMO CSc1ccccc1C[N@H+]1C[C@H](C)C[C@@H]1C ZINC000511105458 533041612 /nfs/dbraw/zinc/04/16/12/533041612.db2.gz AOLXUMKHQBGHKX-NEPJUHHUSA-N 1 1 235.396 3.639 20 0 BHADMO CSc1ccccc1C[N@H+]1C[C@@H](C)C[C@H]1C ZINC000511105459 533042195 /nfs/dbraw/zinc/04/21/95/533042195.db2.gz AOLXUMKHQBGHKX-NWDGAFQWSA-N 1 1 235.396 3.639 20 0 BHADMO CSc1ccccc1C[N@H+]1C[C@@H](C)C[C@@H]1C ZINC000511105460 533042233 /nfs/dbraw/zinc/04/22/33/533042233.db2.gz AOLXUMKHQBGHKX-RYUDHWBXSA-N 1 1 235.396 3.639 20 0 BHADMO CSc1ccccc1C[N@H+]1C[C@H](C)C[C@H]1C ZINC000511105461 533041768 /nfs/dbraw/zinc/04/17/68/533041768.db2.gz AOLXUMKHQBGHKX-VXGBXAGGSA-N 1 1 235.396 3.639 20 0 BHADMO Clc1ccccc1C[C@H]1CCC[N@H+]1CC1CC1 ZINC000511105530 534651518 /nfs/dbraw/zinc/65/15/18/534651518.db2.gz IZTLMYIVJFFCID-CQSZACIVSA-N 1 1 249.785 3.757 20 0 BHADMO CCCC[N@@H+](C)Cc1ccccc1SC ZINC000511129295 528359267 /nfs/dbraw/zinc/35/92/67/528359267.db2.gz GUGXXTCFBXATGS-UHFFFAOYSA-N 1 1 223.385 3.640 20 0 BHADMO CSc1ccccc1C[N@H+]1C[C@@H]2CCC[C@@H]2C1 ZINC000511136144 533041151 /nfs/dbraw/zinc/04/11/51/533041151.db2.gz SDEKCOKWFYRNLR-BETUJISGSA-N 1 1 247.407 3.640 20 0 BHADMO CSc1ccccc1C[N@@H+](C)[C@H](C)C(C)C ZINC000511155143 533039981 /nfs/dbraw/zinc/03/99/81/533039981.db2.gz LNQPWQSEUSMORP-GFCCVEGCSA-N 1 1 237.412 3.885 20 0 BHADMO CSc1ccccc1C[N@@H+](C)[C@@H](C)C(C)C ZINC000511155146 533040635 /nfs/dbraw/zinc/04/06/35/533040635.db2.gz LNQPWQSEUSMORP-LBPRGKRZSA-N 1 1 237.412 3.885 20 0 BHADMO CC[C@@H]1CC[N@@H+](Cc2ccccc2SC)C1 ZINC000511159559 529327043 /nfs/dbraw/zinc/32/70/43/529327043.db2.gz HLWNGWRRWIEYAT-GFCCVEGCSA-N 1 1 235.396 3.640 20 0 BHADMO CC[C@H]1CC[N@@H+](Cc2ccccc2SC)C1 ZINC000511159560 529238694 /nfs/dbraw/zinc/23/86/94/529238694.db2.gz HLWNGWRRWIEYAT-LBPRGKRZSA-N 1 1 235.396 3.640 20 0 BHADMO CC[C@H]1CCC[N@H+]1C/C=C\c1ccccc1OC ZINC000511477673 529220665 /nfs/dbraw/zinc/22/06/65/529220665.db2.gz CCHJKLQSXZRMDA-AJHXJQRKSA-N 1 1 245.366 3.583 20 0 BHADMO CC[C@H]1CCC[N@H+]1C/C=C/c1ccccc1OC ZINC000511477674 529220722 /nfs/dbraw/zinc/22/07/22/529220722.db2.gz CCHJKLQSXZRMDA-PPYMECGQSA-N 1 1 245.366 3.583 20 0 BHADMO CC[C@@H]1CCC[N@H+]1C/C=C/c1ccccc1OC ZINC000511477675 529301579 /nfs/dbraw/zinc/30/15/79/529301579.db2.gz CCHJKLQSXZRMDA-RZIFZGNASA-N 1 1 245.366 3.583 20 0 BHADMO CC[C@@H]1CCC[N@H+]1C/C=C\c1ccccc1OC ZINC000511477676 529301527 /nfs/dbraw/zinc/30/15/27/529301527.db2.gz CCHJKLQSXZRMDA-WUKHSURWSA-N 1 1 245.366 3.583 20 0 BHADMO CC[C@@H]1CCC[N@H+]1Cc1ccc(F)c(C)c1 ZINC000511481220 529301912 /nfs/dbraw/zinc/30/19/12/529301912.db2.gz XFDVPMHQZXCVCE-CYBMUJFWSA-N 1 1 221.319 3.509 20 0 BHADMO CC[C@H]1CCC[N@H+]1Cc1ccc(F)c(C)c1 ZINC000511481227 529220710 /nfs/dbraw/zinc/22/07/10/529220710.db2.gz XFDVPMHQZXCVCE-ZDUSSCGKSA-N 1 1 221.319 3.509 20 0 BHADMO CC[C@@H]1CCC[N@H+]1C[C@@H]1C[C@@H]1c1ccccc1 ZINC000511482148 529301601 /nfs/dbraw/zinc/30/16/01/529301601.db2.gz OFOCSJPHIPCFKR-ARFHVFGLSA-N 1 1 229.367 3.665 20 0 BHADMO CC[C@@H]1CCC[N@H+]1C[C@H]1C[C@@H]1c1ccccc1 ZINC000511482149 529301576 /nfs/dbraw/zinc/30/15/76/529301576.db2.gz OFOCSJPHIPCFKR-BZUAXINKSA-N 1 1 229.367 3.665 20 0 BHADMO CC[C@@H]1CCC[N@H+]1C[C@H]1C[C@H]1c1ccccc1 ZINC000511482150 529301637 /nfs/dbraw/zinc/30/16/37/529301637.db2.gz OFOCSJPHIPCFKR-OAGGEKHMSA-N 1 1 229.367 3.665 20 0 BHADMO C/C(=C\c1ccccc1)C[N@H+](C)Cc1ccoc1 ZINC000511483676 527532823 /nfs/dbraw/zinc/53/28/23/527532823.db2.gz USVOICXVOTWDEN-GXDHUFHOSA-N 1 1 241.334 3.815 20 0 BHADMO C/C(=C/c1ccccc1)C[N@H+](C)Cc1ccoc1 ZINC000511483677 527505641 /nfs/dbraw/zinc/50/56/41/527505641.db2.gz USVOICXVOTWDEN-UVTDQMKNSA-N 1 1 241.334 3.815 20 0 BHADMO CC[C@H]1CCC[N@H+]1Cc1ccc(F)cc1C ZINC000511490325 529220753 /nfs/dbraw/zinc/22/07/53/529220753.db2.gz BRTBXGHILWNIPH-AWEZNQCLSA-N 1 1 221.319 3.509 20 0 BHADMO CC[C@@H]1CCC[N@H+]1Cc1ccc(F)cc1C ZINC000511490326 529302008 /nfs/dbraw/zinc/30/20/08/529302008.db2.gz BRTBXGHILWNIPH-CQSZACIVSA-N 1 1 221.319 3.509 20 0 BHADMO Cc1ccoc1C[N@H+]1CCC[C@H]1C1CCCC1 ZINC000511491974 229319080 /nfs/dbraw/zinc/31/90/80/229319080.db2.gz CJMNUXWBOIXRFX-AWEZNQCLSA-N 1 1 233.355 3.743 20 0 BHADMO Cc1ccoc1C[N@H+]1CCC[C@@H]1C1CCCC1 ZINC000511491975 229319941 /nfs/dbraw/zinc/31/99/41/229319941.db2.gz CJMNUXWBOIXRFX-CQSZACIVSA-N 1 1 233.355 3.743 20 0 BHADMO CC[C@H]1CCC[N@H+]1C/C(C)=C/c1ccccc1 ZINC000511492965 529220667 /nfs/dbraw/zinc/22/06/67/529220667.db2.gz KTJSTXWVVUTVRY-GRNBYLDVSA-N 1 1 229.367 3.964 20 0 BHADMO CC[C@H]1CCC[N@H+]1C/C(C)=C\c1ccccc1 ZINC000511492967 529220168 /nfs/dbraw/zinc/22/01/68/529220168.db2.gz KTJSTXWVVUTVRY-HECSCLNYSA-N 1 1 229.367 3.964 20 0 BHADMO CC[C@@H]1CCC[N@H+]1C/C(C)=C\c1ccccc1 ZINC000511492968 529301264 /nfs/dbraw/zinc/30/12/64/529301264.db2.gz KTJSTXWVVUTVRY-OBEJXRGXSA-N 1 1 229.367 3.964 20 0 BHADMO CC[C@@H]1CCC[N@H+]1C/C(C)=C/c1ccccc1 ZINC000511492970 529301450 /nfs/dbraw/zinc/30/14/50/529301450.db2.gz KTJSTXWVVUTVRY-WCRPCQDQSA-N 1 1 229.367 3.964 20 0 BHADMO C[N@@H+](CCc1ccccc1F)C[C@H]1CC=CCC1 ZINC000511496129 529934601 /nfs/dbraw/zinc/93/46/01/529934601.db2.gz PGSQYPDWKXBBJJ-AWEZNQCLSA-N 1 1 247.357 3.656 20 0 BHADMO C[N@@H+](CCc1ccccc1F)C[C@@H]1CC=CCC1 ZINC000511496130 529934814 /nfs/dbraw/zinc/93/48/14/529934814.db2.gz PGSQYPDWKXBBJJ-CQSZACIVSA-N 1 1 247.357 3.656 20 0 BHADMO CC[C@@H](C[N@@H+](C)Cc1ccoc1)c1ccccc1 ZINC000511502147 529471976 /nfs/dbraw/zinc/47/19/76/529471976.db2.gz AZBGIULYQKPYCT-HNNXBMFYSA-N 1 1 243.350 3.905 20 0 BHADMO CC[C@H](C[N@@H+](C)Cc1ccoc1)c1ccccc1 ZINC000511502148 529332700 /nfs/dbraw/zinc/33/27/00/529332700.db2.gz AZBGIULYQKPYCT-OAHLLOKOSA-N 1 1 243.350 3.905 20 0 BHADMO CC[C@H]1CCC[N@H+]1C/C=C\c1ccc(F)cc1 ZINC000511505649 529220389 /nfs/dbraw/zinc/22/03/89/529220389.db2.gz NZPJFUXLMFJROH-QTLSWZBMSA-N 1 1 233.330 3.713 20 0 BHADMO CC[C@@H]1CCC[N@H+]1C/C=C/c1ccc(F)cc1 ZINC000511505650 529301329 /nfs/dbraw/zinc/30/13/29/529301329.db2.gz NZPJFUXLMFJROH-SJDLMVEWSA-N 1 1 233.330 3.713 20 0 BHADMO CC[C@H]1CCC[N@H+]1C/C=C/c1ccc(F)cc1 ZINC000511505651 529220713 /nfs/dbraw/zinc/22/07/13/529220713.db2.gz NZPJFUXLMFJROH-UJAVWCLSSA-N 1 1 233.330 3.713 20 0 BHADMO CC[C@@H]1CCC[N@H+]1C/C=C\c1ccc(F)cc1 ZINC000511505652 529301640 /nfs/dbraw/zinc/30/16/40/529301640.db2.gz NZPJFUXLMFJROH-UYWPIULCSA-N 1 1 233.330 3.713 20 0 BHADMO c1cc(C[N@H+]2CCC[C@H]2C2CCCC2)cs1 ZINC000511508429 229319326 /nfs/dbraw/zinc/31/93/26/229319326.db2.gz XIXDUCDXTCCIFK-AWEZNQCLSA-N 1 1 235.396 3.903 20 0 BHADMO c1cc(C[N@H+]2CCC[C@@H]2C2CCCC2)cs1 ZINC000511508430 229319549 /nfs/dbraw/zinc/31/95/49/229319549.db2.gz XIXDUCDXTCCIFK-CQSZACIVSA-N 1 1 235.396 3.903 20 0 BHADMO CC[C@@H]1CCC[N@H+]1Cc1cc(C)ccc1F ZINC000511510433 529302104 /nfs/dbraw/zinc/30/21/04/529302104.db2.gz VAVGKLBTLONYHJ-CYBMUJFWSA-N 1 1 221.319 3.509 20 0 BHADMO CC[C@H]1CCC[N@H+]1Cc1cc(C)ccc1F ZINC000511510434 529220293 /nfs/dbraw/zinc/22/02/93/529220293.db2.gz VAVGKLBTLONYHJ-ZDUSSCGKSA-N 1 1 221.319 3.509 20 0 BHADMO CC[C@@H]1CCC[N@H+]1Cc1ccc(C)c(F)c1 ZINC000511521216 529301836 /nfs/dbraw/zinc/30/18/36/529301836.db2.gz HGXTXGHBZHKYSZ-CYBMUJFWSA-N 1 1 221.319 3.509 20 0 BHADMO CC[C@H]1CCC[N@H+]1Cc1ccc(C)c(F)c1 ZINC000511521218 529220491 /nfs/dbraw/zinc/22/04/91/529220491.db2.gz HGXTXGHBZHKYSZ-ZDUSSCGKSA-N 1 1 221.319 3.509 20 0 BHADMO CC[C@@H]1CCC[N@H+]1Cc1cc2ccccc2o1 ZINC000511526062 529301751 /nfs/dbraw/zinc/30/17/51/529301751.db2.gz YPWCOBBOJSWGTK-CYBMUJFWSA-N 1 1 229.323 3.807 20 0 BHADMO CC[C@H]1CCC[N@H+]1Cc1cc2ccccc2o1 ZINC000511526063 529220539 /nfs/dbraw/zinc/22/05/39/529220539.db2.gz YPWCOBBOJSWGTK-ZDUSSCGKSA-N 1 1 229.323 3.807 20 0 BHADMO C[N@@H+](CCc1ccccc1F)Cc1ccccc1 ZINC000511537911 529934611 /nfs/dbraw/zinc/93/46/11/529934611.db2.gz AVOKZJDDZHFWJM-UHFFFAOYSA-N 1 1 243.325 3.500 20 0 BHADMO CCCC[N@H+]1CC[C@@H]1c1ccc(Cl)cc1 ZINC000511540771 528486954 /nfs/dbraw/zinc/48/69/54/528486954.db2.gz IRNCZJCNDZFDRL-CYBMUJFWSA-N 1 1 223.747 3.887 20 0 BHADMO CCCC[N@H+]1CC[C@H]1c1ccc(Cl)cc1 ZINC000511540772 528485739 /nfs/dbraw/zinc/48/57/39/528485739.db2.gz IRNCZJCNDZFDRL-ZDUSSCGKSA-N 1 1 223.747 3.887 20 0 BHADMO Clc1ccc([C@@H]2CC[N@H+]2CCC2CC2)cc1 ZINC000511547746 229320448 /nfs/dbraw/zinc/32/04/48/229320448.db2.gz VOUPTJNGXRMUHK-AWEZNQCLSA-N 1 1 235.758 3.887 20 0 BHADMO Clc1ccc([C@H]2CC[N@H+]2CCC2CC2)cc1 ZINC000511547747 229320214 /nfs/dbraw/zinc/32/02/14/229320214.db2.gz VOUPTJNGXRMUHK-CQSZACIVSA-N 1 1 235.758 3.887 20 0 BHADMO C[N@@H+](CCc1ccc2ccccc2c1)CC1CC1 ZINC000511573379 529933554 /nfs/dbraw/zinc/93/35/54/529933554.db2.gz KYBZGMBVEJLNMG-UHFFFAOYSA-N 1 1 239.362 3.724 20 0 BHADMO CCC[N@@H+](C)CCc1ccc2ccccc2c1 ZINC000511574752 527826267 /nfs/dbraw/zinc/82/62/67/527826267.db2.gz NKMZGBNNGWYAKS-UHFFFAOYSA-N 1 1 227.351 3.724 20 0 BHADMO CC(C)C[N@@H+](C)CCc1ccc2ccccc2c1 ZINC000511592909 527914897 /nfs/dbraw/zinc/91/48/97/527914897.db2.gz NBTJTLGPVZYZTJ-UHFFFAOYSA-N 1 1 241.378 3.970 20 0 BHADMO Clc1ccc([C@@H]2CC[N@H+]2CC2CCC2)cc1 ZINC000511599502 229322716 /nfs/dbraw/zinc/32/27/16/229322716.db2.gz ZMGFELMXTGHTCG-AWEZNQCLSA-N 1 1 235.758 3.887 20 0 BHADMO Clc1ccc([C@H]2CC[N@H+]2CC2CCC2)cc1 ZINC000511599504 229322764 /nfs/dbraw/zinc/32/27/64/229322764.db2.gz ZMGFELMXTGHTCG-CQSZACIVSA-N 1 1 235.758 3.887 20 0 BHADMO C[C@H]1CC[N@@H+](CCc2ccc3ccccc3c2)C1 ZINC000511632869 229323980 /nfs/dbraw/zinc/32/39/80/229323980.db2.gz CYKLDGOVSZOVOJ-AWEZNQCLSA-N 1 1 239.362 3.724 20 0 BHADMO C[C@@H]1CC[N@@H+](CCc2ccc3ccccc3c2)C1 ZINC000511632871 534034902 /nfs/dbraw/zinc/03/49/02/534034902.db2.gz CYKLDGOVSZOVOJ-CQSZACIVSA-N 1 1 239.362 3.724 20 0 BHADMO Cc1ccc(C[N@H+]2CC3C[C@@H]4CC2C[C@H](C3)C4)o1 ZINC000511650969 533914072 /nfs/dbraw/zinc/91/40/72/533914072.db2.gz WKAMUJHHAVZLKJ-DGKWVBSXSA-N 1 1 245.366 3.599 20 0 BHADMO Cc1ccoc1C[N@H+]1CC2C[C@@H]3CC1C[C@H](C2)C3 ZINC000511658316 229323075 /nfs/dbraw/zinc/32/30/75/229323075.db2.gz XGRMMMWDUGQXST-DGKWVBSXSA-N 1 1 245.366 3.599 20 0 BHADMO CC[N@@H+](CCc1ccc2ccccc2c1)C1CC1 ZINC000511659455 528586528 /nfs/dbraw/zinc/58/65/28/528586528.db2.gz SSZLPWCPQBATBI-UHFFFAOYSA-N 1 1 239.362 3.867 20 0 BHADMO c1cc(C[N@H+]2CC3C[C@@H]4CC2C[C@H](C3)C4)cs1 ZINC000511661078 229323194 /nfs/dbraw/zinc/32/31/94/229323194.db2.gz AXEWFTYHRCPPAG-DGKWVBSXSA-N 1 1 247.407 3.759 20 0 BHADMO c1csc(C[N@H+]2CC3C[C@@H]4CC2C[C@H](C3)C4)c1 ZINC000511664299 534520141 /nfs/dbraw/zinc/52/01/41/534520141.db2.gz OLOONMVEOLSORM-VTXSZYRJSA-N 1 1 247.407 3.759 20 0 BHADMO C[N@@H+](CCC(F)(F)F)CC1CCCCCC1 ZINC000511755661 529874343 /nfs/dbraw/zinc/87/43/43/529874343.db2.gz MBJYDQATASZUKF-UHFFFAOYSA-N 1 1 237.309 3.841 20 0 BHADMO CC1CCC(C[N@@H+](C)CCC(F)(F)F)CC1 ZINC000511766865 528176625 /nfs/dbraw/zinc/17/66/25/528176625.db2.gz AAZIHFNQWHZWIA-UHFFFAOYSA-N 1 1 237.309 3.697 20 0 BHADMO C[N@H+](C/C=C/c1ccccc1)CCC(F)(F)F ZINC000511776803 529820072 /nfs/dbraw/zinc/82/00/72/529820072.db2.gz ADGFASOPIRJIBK-VMPITWQZSA-N 1 1 243.272 3.584 20 0 BHADMO C[N@H+](C/C=C\c1ccccc1)CCC(F)(F)F ZINC000511776808 529820507 /nfs/dbraw/zinc/82/05/07/529820507.db2.gz ADGFASOPIRJIBK-YVMONPNESA-N 1 1 243.272 3.584 20 0 BHADMO c1ccc([C@@H]2C[N@H+](CC3CC3)[C@H]3CCC[C@H]23)cc1 ZINC000511844030 229326189 /nfs/dbraw/zinc/32/61/89/229326189.db2.gz LANSLYBBHHKPND-IKGGRYGDSA-N 1 1 241.378 3.665 20 0 BHADMO c1ccc([C@@H]2C[N@H+](CC3CC3)[C@@H]3CCC[C@H]23)cc1 ZINC000511844031 229326124 /nfs/dbraw/zinc/32/61/24/229326124.db2.gz LANSLYBBHHKPND-IXDOHACOSA-N 1 1 241.378 3.665 20 0 BHADMO c1ccc([C@@H]2C[N@H+](CC3CC3)[C@H]3CCC[C@@H]23)cc1 ZINC000511844033 386284900 /nfs/dbraw/zinc/28/49/00/386284900.db2.gz LANSLYBBHHKPND-ULQDDVLXSA-N 1 1 241.378 3.665 20 0 BHADMO c1ccc([C@@H]2C[N@H+](CC3CC3)[C@@H]3CCC[C@@H]23)cc1 ZINC000511844034 386284951 /nfs/dbraw/zinc/28/49/51/386284951.db2.gz LANSLYBBHHKPND-YESZJQIVSA-N 1 1 241.378 3.665 20 0 BHADMO CCC[N@H+]1C[C@H](c2ccccc2)[C@@H]2CCC[C@H]21 ZINC000511845335 528326820 /nfs/dbraw/zinc/32/68/20/528326820.db2.gz PQSDADFTCZBHGB-ARFHVFGLSA-N 1 1 229.367 3.665 20 0 BHADMO CCC[N@H+]1C[C@H](c2ccccc2)[C@H]2CCC[C@H]21 ZINC000511845337 528326138 /nfs/dbraw/zinc/32/61/38/528326138.db2.gz PQSDADFTCZBHGB-BZUAXINKSA-N 1 1 229.367 3.665 20 0 BHADMO CCC[N@H+]1C[C@H](c2ccccc2)[C@H]2CCC[C@@H]21 ZINC000511845339 528326880 /nfs/dbraw/zinc/32/68/80/528326880.db2.gz PQSDADFTCZBHGB-OAGGEKHMSA-N 1 1 229.367 3.665 20 0 BHADMO CCC[N@H+]1C[C@H](c2ccccc2)[C@@H]2CCC[C@@H]21 ZINC000511845340 528326512 /nfs/dbraw/zinc/32/65/12/528326512.db2.gz PQSDADFTCZBHGB-XHSDSOJGSA-N 1 1 229.367 3.665 20 0 BHADMO C1=CC[C@H](C[N@H+]2CCC[C@@H]3CCC[C@@H]32)CC1 ZINC000511853566 526418211 /nfs/dbraw/zinc/41/82/11/526418211.db2.gz CLBMNYPGRLYMJZ-KKUMJFAQSA-N 1 1 219.372 3.607 20 0 BHADMO C1=CC[C@H](C[N@H+]2CCC[C@H]3CCC[C@H]32)CC1 ZINC000511853568 526417459 /nfs/dbraw/zinc/41/74/59/526417459.db2.gz CLBMNYPGRLYMJZ-RRFJBIMHSA-N 1 1 219.372 3.607 20 0 BHADMO C1=CC[C@H](C[N@H+]2CCC[C@@H]3CCC[C@H]32)CC1 ZINC000511853570 526417283 /nfs/dbraw/zinc/41/72/83/526417283.db2.gz CLBMNYPGRLYMJZ-SOUVJXGZSA-N 1 1 219.372 3.607 20 0 BHADMO C1=CC[C@H](C[N@H+]2CCC[C@H]3CCC[C@@H]32)CC1 ZINC000511853571 526417498 /nfs/dbraw/zinc/41/74/98/526417498.db2.gz CLBMNYPGRLYMJZ-ZNMIVQPWSA-N 1 1 219.372 3.607 20 0 BHADMO Cc1ccccc1C[N@H+]1CCC[C@H]2CCC[C@H]21 ZINC000511854199 229326522 /nfs/dbraw/zinc/32/65/22/229326522.db2.gz GLVYXUIBFQPNJC-GDBMZVCRSA-N 1 1 229.367 3.760 20 0 BHADMO Cc1ccccc1C[N@H+]1CCC[C@@H]2CCC[C@H]21 ZINC000511854200 229326562 /nfs/dbraw/zinc/32/65/62/229326562.db2.gz GLVYXUIBFQPNJC-GOEBONIOSA-N 1 1 229.367 3.760 20 0 BHADMO Cc1ccccc1C[N@H+]1CCC[C@@H]2CCC[C@@H]21 ZINC000511854201 229326377 /nfs/dbraw/zinc/32/63/77/229326377.db2.gz GLVYXUIBFQPNJC-HOCLYGCPSA-N 1 1 229.367 3.760 20 0 BHADMO Cc1ccccc1C[N@H+]1CCC[C@H]2CCC[C@@H]21 ZINC000511854202 229326908 /nfs/dbraw/zinc/32/69/08/229326908.db2.gz GLVYXUIBFQPNJC-ZBFHGGJFSA-N 1 1 229.367 3.760 20 0 BHADMO FCCC[N@H+]1C[C@H](c2ccccc2)[C@@H]2CCC[C@H]21 ZINC000511854767 534432018 /nfs/dbraw/zinc/43/20/18/534432018.db2.gz JNWCCRQHZXFADE-ARFHVFGLSA-N 1 1 247.357 3.614 20 0 BHADMO FCCC[N@H+]1C[C@H](c2ccccc2)[C@H]2CCC[C@H]21 ZINC000511854768 534431719 /nfs/dbraw/zinc/43/17/19/534431719.db2.gz JNWCCRQHZXFADE-BZUAXINKSA-N 1 1 247.357 3.614 20 0 BHADMO FCCC[N@H+]1C[C@H](c2ccccc2)[C@H]2CCC[C@@H]21 ZINC000511854769 534431241 /nfs/dbraw/zinc/43/12/41/534431241.db2.gz JNWCCRQHZXFADE-OAGGEKHMSA-N 1 1 247.357 3.614 20 0 BHADMO FCCC[N@H+]1C[C@H](c2ccccc2)[C@@H]2CCC[C@@H]21 ZINC000511854770 534432128 /nfs/dbraw/zinc/43/21/28/534432128.db2.gz JNWCCRQHZXFADE-XHSDSOJGSA-N 1 1 247.357 3.614 20 0 BHADMO C(=C\c1ccccc1)\C[N@H+]1CCC[C@@H]2CCC[C@H]21 ZINC000511856979 527471358 /nfs/dbraw/zinc/47/13/58/527471358.db2.gz AJXXDDUDTRZVRS-APDXYKNESA-N 1 1 241.378 3.964 20 0 BHADMO C(=C/c1ccccc1)\C[N@H+]1CCC[C@@H]2CCC[C@H]21 ZINC000511856980 527468207 /nfs/dbraw/zinc/46/82/07/527468207.db2.gz AJXXDDUDTRZVRS-OQRFJMDLSA-N 1 1 241.378 3.964 20 0 BHADMO C(=C\c1ccccc1)\C[N@H+]1CCC[C@@H]2CCC[C@@H]21 ZINC000511856981 527470919 /nfs/dbraw/zinc/47/09/19/527470919.db2.gz AJXXDDUDTRZVRS-YWJKWWDISA-N 1 1 241.378 3.964 20 0 BHADMO C(=C/c1ccccc1)\C[N@H+]1CCC[C@@H]2CCC[C@@H]21 ZINC000511856982 527467094 /nfs/dbraw/zinc/46/70/94/527467094.db2.gz AJXXDDUDTRZVRS-ZTXDWSKGSA-N 1 1 241.378 3.964 20 0 BHADMO Cc1ccc(C[N@H+]2CCC[C@@H]3CCC[C@H]32)s1 ZINC000511859413 533926302 /nfs/dbraw/zinc/92/63/02/533926302.db2.gz NDDBUMZANMJJTA-GXTWGEPZSA-N 1 1 235.396 3.821 20 0 BHADMO Cc1ccc(C[N@H+]2CCC[C@@H]3CCC[C@@H]32)s1 ZINC000511859414 533928068 /nfs/dbraw/zinc/92/80/68/533928068.db2.gz NDDBUMZANMJJTA-JSGCOSHPSA-N 1 1 235.396 3.821 20 0 BHADMO Cc1ccc(C[N@H+]2CCC[C@H]3CCC[C@@H]32)s1 ZINC000511859415 533930830 /nfs/dbraw/zinc/93/08/30/533930830.db2.gz NDDBUMZANMJJTA-OCCSQVGLSA-N 1 1 235.396 3.821 20 0 BHADMO Cc1ccc(C[N@H+]2CCC[C@H]3CCC[C@H]32)s1 ZINC000511859416 229325893 /nfs/dbraw/zinc/32/58/93/229325893.db2.gz NDDBUMZANMJJTA-TZMCWYRMSA-N 1 1 235.396 3.821 20 0 BHADMO Fc1cccc(C[N@H+]2CCC[C@@H]3CCC[C@H]32)c1 ZINC000511872100 534517515 /nfs/dbraw/zinc/51/75/15/534517515.db2.gz GYUWRLQXWXEIIG-DZGCQCFKSA-N 1 1 233.330 3.590 20 0 BHADMO Fc1cccc(C[N@H+]2CCC[C@H]3CCC[C@@H]32)c1 ZINC000511872102 534518053 /nfs/dbraw/zinc/51/80/53/534518053.db2.gz GYUWRLQXWXEIIG-HIFRSBDPSA-N 1 1 233.330 3.590 20 0 BHADMO Fc1cccc(C[N@H+]2CCC[C@H]3CCC[C@H]32)c1 ZINC000511872103 534517886 /nfs/dbraw/zinc/51/78/86/534517886.db2.gz GYUWRLQXWXEIIG-UKRRQHHQSA-N 1 1 233.330 3.590 20 0 BHADMO Fc1cccc(C[N@H+]2CCC[C@@H]3CCC[C@@H]32)c1 ZINC000511872105 534517462 /nfs/dbraw/zinc/51/74/62/534517462.db2.gz GYUWRLQXWXEIIG-ZFWWWQNUSA-N 1 1 233.330 3.590 20 0 BHADMO Fc1ccc(C[N@H+]2CCC[C@@H]3CCC[C@H]32)cc1 ZINC000511874593 229328413 /nfs/dbraw/zinc/32/84/13/229328413.db2.gz NDOSHSYFCQKJLZ-DZGCQCFKSA-N 1 1 233.330 3.590 20 0 BHADMO Fc1ccc(C[N@H+]2CCC[C@H]3CCC[C@@H]32)cc1 ZINC000511874594 229327912 /nfs/dbraw/zinc/32/79/12/229327912.db2.gz NDOSHSYFCQKJLZ-HIFRSBDPSA-N 1 1 233.330 3.590 20 0 BHADMO Fc1ccc(C[N@H+]2CCC[C@H]3CCC[C@H]32)cc1 ZINC000511874595 229328468 /nfs/dbraw/zinc/32/84/68/229328468.db2.gz NDOSHSYFCQKJLZ-UKRRQHHQSA-N 1 1 233.330 3.590 20 0 BHADMO Fc1ccc(C[N@H+]2CCC[C@@H]3CCC[C@@H]32)cc1 ZINC000511874596 229327716 /nfs/dbraw/zinc/32/77/16/229327716.db2.gz NDOSHSYFCQKJLZ-ZFWWWQNUSA-N 1 1 233.330 3.590 20 0 BHADMO Cc1ccsc1C[N@H+]1CCC[C@H]2CCC[C@H]21 ZINC000511878679 534471476 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526417470 /nfs/dbraw/zinc/41/74/70/526417470.db2.gz YSMORZVEDWQIJD-JKSUJKDBSA-N 1 1 231.383 3.917 20 0 BHADMO CSCC[N@H+]1C[C@@H](C)CC[C@@H]1c1ccccc1 ZINC000512153165 229335082 /nfs/dbraw/zinc/33/50/82/229335082.db2.gz QWQSXYCXJXJNGI-DZGCQCFKSA-N 1 1 249.423 3.823 20 0 BHADMO CSCC[N@H+]1C[C@H](C)CC[C@H]1c1ccccc1 ZINC000512153166 229335254 /nfs/dbraw/zinc/33/52/54/229335254.db2.gz QWQSXYCXJXJNGI-HIFRSBDPSA-N 1 1 249.423 3.823 20 0 BHADMO CSCC[N@H+]1C[C@H](C)CC[C@@H]1c1ccccc1 ZINC000512153167 229334767 /nfs/dbraw/zinc/33/47/67/229334767.db2.gz QWQSXYCXJXJNGI-UKRRQHHQSA-N 1 1 249.423 3.823 20 0 BHADMO CSCC[N@H+]1C[C@@H](C)CC[C@H]1c1ccccc1 ZINC000512153168 229334985 /nfs/dbraw/zinc/33/49/85/229334985.db2.gz QWQSXYCXJXJNGI-ZFWWWQNUSA-N 1 1 249.423 3.823 20 0 BHADMO COc1ccc(CC[N@H+]2CCCCC[C@@H]2C)cc1 ZINC000512171413 229335175 /nfs/dbraw/zinc/33/51/75/229335175.db2.gz PXKAWBDGUIKKPK-AWEZNQCLSA-N 1 1 247.382 3.502 20 0 BHADMO COc1ccc(CC[N@H+]2CCCCC[C@H]2C)cc1 ZINC000512171414 229334546 /nfs/dbraw/zinc/33/45/46/229334546.db2.gz PXKAWBDGUIKKPK-CQSZACIVSA-N 1 1 247.382 3.502 20 0 BHADMO C[C@@H]1CCCCC[N@H+]1Cc1nc2ccccc2o1 ZINC000512175272 229334748 /nfs/dbraw/zinc/33/47/48/229334748.db2.gz NUYMFAHCWHKIDK-GFCCVEGCSA-N 1 1 244.338 3.592 20 0 BHADMO C[C@H]1CCCCC[N@H+]1Cc1nc2ccccc2o1 ZINC000512175273 229334889 /nfs/dbraw/zinc/33/48/89/229334889.db2.gz NUYMFAHCWHKIDK-LBPRGKRZSA-N 1 1 244.338 3.592 20 0 BHADMO C[C@H]1CC[C@H](c2ccccc2)[N@@H+](CCCF)C1 ZINC000512187367 533767253 /nfs/dbraw/zinc/76/72/53/533767253.db2.gz QBODGLGDWQGKKM-DZGCQCFKSA-N 1 1 235.346 3.819 20 0 BHADMO C[C@@H]1CC[C@@H](c2ccccc2)[N@@H+](CCCF)C1 ZINC000512187368 229336047 /nfs/dbraw/zinc/33/60/47/229336047.db2.gz QBODGLGDWQGKKM-HIFRSBDPSA-N 1 1 235.346 3.819 20 0 BHADMO C[C@@H]1CC[C@H](c2ccccc2)[N@@H+](CCCF)C1 ZINC000512187369 534261229 /nfs/dbraw/zinc/26/12/29/534261229.db2.gz QBODGLGDWQGKKM-UKRRQHHQSA-N 1 1 235.346 3.819 20 0 BHADMO C[C@H]1CC[C@@H](c2ccccc2)[N@@H+](CCCF)C1 ZINC000512187370 533718968 /nfs/dbraw/zinc/71/89/68/533718968.db2.gz QBODGLGDWQGKKM-ZFWWWQNUSA-N 1 1 235.346 3.819 20 0 BHADMO C1=CC[C@]2(CC1)CCC[N@H+](CC1CCCC1)C2 ZINC000512195380 526418310 /nfs/dbraw/zinc/41/83/10/526418310.db2.gz ZFPLYXINPAZCGK-INIZCTEOSA-N 1 1 233.399 3.999 20 0 BHADMO C1=CC[C@@]2(CC1)CCC[N@H+](CC1CCCC1)C2 ZINC000512195381 526417804 /nfs/dbraw/zinc/41/78/04/526417804.db2.gz ZFPLYXINPAZCGK-MRXNPFEDSA-N 1 1 233.399 3.999 20 0 BHADMO CC[N@@H+](Cc1ccccc1N(C)C)[C@@H](C)C(C)C ZINC000512195809 528840308 /nfs/dbraw/zinc/84/03/08/528840308.db2.gz MKFLTZDDWVPCCJ-AWEZNQCLSA-N 1 1 248.414 3.619 20 0 BHADMO CC[N@@H+](Cc1ccccc1N(C)C)[C@H](C)C(C)C ZINC000512195811 528840033 /nfs/dbraw/zinc/84/00/33/528840033.db2.gz MKFLTZDDWVPCCJ-CQSZACIVSA-N 1 1 248.414 3.619 20 0 BHADMO Cc1ccc(C[N@@H+]2CCCCC[C@@H]2C)cc1 ZINC000512208664 533920567 /nfs/dbraw/zinc/92/05/67/533920567.db2.gz GDYFAIRXESSLFJ-AWEZNQCLSA-N 1 1 217.356 3.760 20 0 BHADMO Cc1ccc(C[N@@H+]2CCCCC[C@H]2C)cc1 ZINC000512208665 533920604 /nfs/dbraw/zinc/92/06/04/533920604.db2.gz GDYFAIRXESSLFJ-CQSZACIVSA-N 1 1 217.356 3.760 20 0 BHADMO CC[N@@H+](Cc1ccc(Cl)o1)[C@@H](C)C(C)C ZINC000512220544 528783190 /nfs/dbraw/zinc/78/31/90/528783190.db2.gz SSWXNAUYNBBZLY-JTQLQIEISA-N 1 1 229.751 3.799 20 0 BHADMO CC[N@@H+](Cc1ccc(Cl)o1)[C@H](C)C(C)C ZINC000512220545 528783695 /nfs/dbraw/zinc/78/36/95/528783695.db2.gz SSWXNAUYNBBZLY-SNVBAGLBSA-N 1 1 229.751 3.799 20 0 BHADMO CC[N@@H+](Cc1cccc(F)c1F)[C@H](C)C(C)C ZINC000512226382 528812581 /nfs/dbraw/zinc/81/25/81/528812581.db2.gz IHKNHDFEUFNDQT-LLVKDONJSA-N 1 1 241.325 3.831 20 0 BHADMO CC[N@@H+](Cc1ccc(C)s1)[C@H](C)C(C)C ZINC000512226882 528777547 /nfs/dbraw/zinc/77/75/47/528777547.db2.gz KCLNYKGQLCQCRX-GFCCVEGCSA-N 1 1 225.401 3.923 20 0 BHADMO CC[N@@H+](Cc1ccc(C)s1)[C@@H](C)C(C)C ZINC000512226883 528777199 /nfs/dbraw/zinc/77/71/99/528777199.db2.gz KCLNYKGQLCQCRX-LBPRGKRZSA-N 1 1 225.401 3.923 20 0 BHADMO CCc1ccc(C[N@H+](CC)[C@H](C)C(C)C)o1 ZINC000512227723 529637215 /nfs/dbraw/zinc/63/72/15/529637215.db2.gz MSNHWUFEXQVAIV-GFCCVEGCSA-N 1 1 223.360 3.708 20 0 BHADMO CCc1ccc(C[N@H+](CC)[C@@H](C)C(C)C)o1 ZINC000512227726 529637498 /nfs/dbraw/zinc/63/74/98/529637498.db2.gz MSNHWUFEXQVAIV-LBPRGKRZSA-N 1 1 223.360 3.708 20 0 BHADMO CC[N@@H+](C[C@H]1CC=CCC1)[C@@H](C)C(C)C ZINC000512228509 528743120 /nfs/dbraw/zinc/74/31/20/528743120.db2.gz OJSVMEKCFKMABI-KBPBESRZSA-N 1 1 209.377 3.709 20 0 BHADMO CC[N@@H+](C[C@H]1CC=CCC1)[C@H](C)C(C)C ZINC000512228510 528743547 /nfs/dbraw/zinc/74/35/47/528743547.db2.gz OJSVMEKCFKMABI-KGLIPLIRSA-N 1 1 209.377 3.709 20 0 BHADMO CC[N@@H+](C[C@@H]1CC=CCC1)[C@@H](C)C(C)C ZINC000512228512 528670889 /nfs/dbraw/zinc/67/08/89/528670889.db2.gz OJSVMEKCFKMABI-UONOGXRCSA-N 1 1 209.377 3.709 20 0 BHADMO CC[N@@H+](C[C@@H]1CC=CCC1)[C@H](C)C(C)C ZINC000512228514 528670668 /nfs/dbraw/zinc/67/06/68/528670668.db2.gz OJSVMEKCFKMABI-ZIAGYGMSSA-N 1 1 209.377 3.709 20 0 BHADMO CC[N@@H+](Cc1sccc1C)[C@H](C)C(C)C ZINC000512236263 528920106 /nfs/dbraw/zinc/92/01/06/528920106.db2.gz GDLQMPOUHZGAQR-GFCCVEGCSA-N 1 1 225.401 3.923 20 0 BHADMO CC[N@@H+](Cc1sccc1C)[C@@H](C)C(C)C ZINC000512236264 528920293 /nfs/dbraw/zinc/92/02/93/528920293.db2.gz GDLQMPOUHZGAQR-LBPRGKRZSA-N 1 1 225.401 3.923 20 0 BHADMO CC[N@@H+](Cc1cccc(F)c1)[C@H](C)C(C)C ZINC000512236570 528812860 /nfs/dbraw/zinc/81/28/60/528812860.db2.gz IPBDMQWRKQBFAE-GFCCVEGCSA-N 1 1 223.335 3.692 20 0 BHADMO CC[N@@H+](Cc1ccc(F)cc1)[C@H](C)C(C)C ZINC000512237286 528786215 /nfs/dbraw/zinc/78/62/15/528786215.db2.gz OUZFYOLLJLNMLC-GFCCVEGCSA-N 1 1 223.335 3.692 20 0 BHADMO CC[N@@H+](Cc1ccc(OC)cc1)[C@H](C)C(C)C ZINC000512237631 528793212 /nfs/dbraw/zinc/79/32/12/528793212.db2.gz UMIOAWYXQPVHEN-CYBMUJFWSA-N 1 1 235.371 3.562 20 0 BHADMO CC[N@@H+](Cc1ccc(OC)cc1)[C@@H](C)C(C)C ZINC000512237632 528792947 /nfs/dbraw/zinc/79/29/47/528792947.db2.gz UMIOAWYXQPVHEN-ZDUSSCGKSA-N 1 1 235.371 3.562 20 0 BHADMO CC[N@@H+](Cc1ccccc1F)[C@H](C)C(C)C ZINC000512237733 528839099 /nfs/dbraw/zinc/83/90/99/528839099.db2.gz VKFYDRXVFQOMCL-GFCCVEGCSA-N 1 1 223.335 3.692 20 0 BHADMO CC[N@@H+](Cc1ccccc1)[C@@H](C)C(C)C ZINC000512240186 528831273 /nfs/dbraw/zinc/83/12/73/528831273.db2.gz CPBIUMNBHKLUJE-ZDUSSCGKSA-N 1 1 205.345 3.553 20 0 BHADMO CC[N@@H+](Cc1ccc(F)c(F)c1)[C@H](C)C(C)C ZINC000512240514 528786764 /nfs/dbraw/zinc/78/67/64/528786764.db2.gz DOWQKCJFFFANPL-LLVKDONJSA-N 1 1 241.325 3.831 20 0 BHADMO CC[N@@H+](Cc1ccc(F)c(F)c1)[C@@H](C)C(C)C ZINC000512240515 528787163 /nfs/dbraw/zinc/78/71/63/528787163.db2.gz DOWQKCJFFFANPL-NSHDSACASA-N 1 1 241.325 3.831 20 0 BHADMO CCC[N@@H+]([C@H](C)c1ccccc1)C1CC1 ZINC000512245182 528159590 /nfs/dbraw/zinc/15/95/90/528159590.db2.gz QDVOSDGTWOWCBA-GFCCVEGCSA-N 1 1 203.329 3.622 20 0 BHADMO CCC[N@@H+]([C@@H](C)c1ccccc1)C1CC1 ZINC000512245183 528157802 /nfs/dbraw/zinc/15/78/02/528157802.db2.gz QDVOSDGTWOWCBA-LBPRGKRZSA-N 1 1 203.329 3.622 20 0 BHADMO CC[N@@H+](Cc1ccccc1OC)[C@H](C)C(C)C ZINC000512247134 528841392 /nfs/dbraw/zinc/84/13/92/528841392.db2.gz WPNKPBPLMDDINV-CYBMUJFWSA-N 1 1 235.371 3.562 20 0 BHADMO CC[N@@H+](Cc1ccccc1OC)[C@@H](C)C(C)C ZINC000512247135 528841451 /nfs/dbraw/zinc/84/14/51/528841451.db2.gz WPNKPBPLMDDINV-ZDUSSCGKSA-N 1 1 235.371 3.562 20 0 BHADMO CCC(C)(C)[N@@H+](C)Cc1cc(C)ccc1C ZINC000512250074 528537804 /nfs/dbraw/zinc/53/78/04/528537804.db2.gz RWFISFCGSGOULS-UHFFFAOYSA-N 1 1 219.372 3.924 20 0 BHADMO CC/C=C\CC[N@H+]1CCOc2ccc(C)cc2C1 ZINC000512261658 528789828 /nfs/dbraw/zinc/78/98/28/528789828.db2.gz QVKYOZKPTBIJBS-PLNGDYQASA-N 1 1 245.366 3.546 20 0 BHADMO CC/C=C/CC[N@H+]1CCOc2ccc(C)cc2C1 ZINC000512261659 528772342 /nfs/dbraw/zinc/77/23/42/528772342.db2.gz QVKYOZKPTBIJBS-SNAWJCMRSA-N 1 1 245.366 3.546 20 0 BHADMO CCSCC[N@@H+]([C@H](C)c1ccccc1)C1CC1 ZINC000512262132 529179131 /nfs/dbraw/zinc/17/91/31/529179131.db2.gz RWBOILRIDHEBKY-CYBMUJFWSA-N 1 1 249.423 3.965 20 0 BHADMO CCSCC[N@@H+]([C@@H](C)c1ccccc1)C1CC1 ZINC000512262133 529179039 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533566339 /nfs/dbraw/zinc/56/63/39/533566339.db2.gz RYVLISDUEYBWDD-UKRRQHHQSA-N 1 1 249.423 3.823 20 0 BHADMO CSCCC[N@H+]1C[C@@H](C)C[C@H]1c1ccccc1 ZINC000513242485 533565839 /nfs/dbraw/zinc/56/58/39/533565839.db2.gz RYVLISDUEYBWDD-ZFWWWQNUSA-N 1 1 249.423 3.823 20 0 BHADMO CC(C)C[N@H+]1C[C@@H](C)C[C@@H]1c1ccccc1 ZINC000513246993 487682981 /nfs/dbraw/zinc/68/29/81/487682981.db2.gz HUEHJGLZDZHGHJ-DZGCQCFKSA-N 1 1 217.356 3.726 20 0 BHADMO CC(C)C[N@H+]1C[C@H](C)C[C@H]1c1ccccc1 ZINC000513246994 487682618 /nfs/dbraw/zinc/68/26/18/487682618.db2.gz HUEHJGLZDZHGHJ-HIFRSBDPSA-N 1 1 217.356 3.726 20 0 BHADMO CC(C)C[N@H+]1C[C@H](C)C[C@@H]1c1ccccc1 ZINC000513246995 487683260 /nfs/dbraw/zinc/68/32/60/487683260.db2.gz HUEHJGLZDZHGHJ-UKRRQHHQSA-N 1 1 217.356 3.726 20 0 BHADMO CC(C)C[N@H+]1C[C@@H](C)C[C@H]1c1ccccc1 ZINC000513246996 487682816 /nfs/dbraw/zinc/68/28/16/487682816.db2.gz HUEHJGLZDZHGHJ-ZFWWWQNUSA-N 1 1 217.356 3.726 20 0 BHADMO C[C@H](F)CC[N@H+]1C[C@H](C)C[C@H]1c1ccccc1 ZINC000513252605 488049498 /nfs/dbraw/zinc/04/94/98/488049498.db2.gz MFOWAPMXHGTOBJ-IPYPFGDCSA-N 1 1 235.346 3.818 20 0 BHADMO C[C@H](F)CC[N@H+]1C[C@@H](C)C[C@@H]1c1ccccc1 ZINC000513252606 487683739 /nfs/dbraw/zinc/68/37/39/487683739.db2.gz MFOWAPMXHGTOBJ-KCQAQPDRSA-N 1 1 235.346 3.818 20 0 BHADMO C[C@H](F)CC[N@H+]1C[C@H](C)C[C@@H]1c1ccccc1 ZINC000513252607 487683936 /nfs/dbraw/zinc/68/39/36/487683936.db2.gz MFOWAPMXHGTOBJ-VNHYZAJKSA-N 1 1 235.346 3.818 20 0 BHADMO C[C@H](F)CC[N@H+]1C[C@@H](C)C[C@H]1c1ccccc1 ZINC000513252608 487684355 /nfs/dbraw/zinc/68/43/55/487684355.db2.gz MFOWAPMXHGTOBJ-YDHLFZDLSA-N 1 1 235.346 3.818 20 0 BHADMO C[C@H]1C[C@H](c2ccccc2)[N@@H+](CCCCF)C1 ZINC000513272044 487686207 /nfs/dbraw/zinc/68/62/07/487686207.db2.gz PMBXIXXVPIVOHE-DZGCQCFKSA-N 1 1 235.346 3.819 20 0 BHADMO C[C@@H]1C[C@@H](c2ccccc2)[N@@H+](CCCCF)C1 ZINC000513272045 487685845 /nfs/dbraw/zinc/68/58/45/487685845.db2.gz PMBXIXXVPIVOHE-HIFRSBDPSA-N 1 1 235.346 3.819 20 0 BHADMO C[C@@H]1C[C@H](c2ccccc2)[N@@H+](CCCCF)C1 ZINC000513272046 487685965 /nfs/dbraw/zinc/68/59/65/487685965.db2.gz PMBXIXXVPIVOHE-UKRRQHHQSA-N 1 1 235.346 3.819 20 0 BHADMO C[C@H]1C[C@@H](c2ccccc2)[N@@H+](CCCCF)C1 ZINC000513272047 487686106 /nfs/dbraw/zinc/68/61/06/487686106.db2.gz PMBXIXXVPIVOHE-ZFWWWQNUSA-N 1 1 235.346 3.819 20 0 BHADMO CCCC[N@@H+](C)Cc1ccc(OC)c(Cl)c1 ZINC000513319429 388423241 /nfs/dbraw/zinc/42/32/41/388423241.db2.gz RZZKVRMFWWHSHK-UHFFFAOYSA-N 1 1 241.762 3.581 20 0 BHADMO CO[C@@H](C)C[N@@H+](C)[C@@H](C)c1ccc(C(C)C)cc1 ZINC000513326119 388423604 /nfs/dbraw/zinc/42/36/04/388423604.db2.gz YMNDKPVTKKKNHZ-KBPBESRZSA-N 1 1 249.398 3.838 20 0 BHADMO CO[C@H](C)C[N@@H+](C)[C@@H](C)c1ccc(C(C)C)cc1 ZINC000513326120 388423601 /nfs/dbraw/zinc/42/36/01/388423601.db2.gz YMNDKPVTKKKNHZ-KGLIPLIRSA-N 1 1 249.398 3.838 20 0 BHADMO CO[C@@H](C)C[N@@H+](C)[C@H](C)c1ccc(C(C)C)cc1 ZINC000513326121 388423468 /nfs/dbraw/zinc/42/34/68/388423468.db2.gz YMNDKPVTKKKNHZ-UONOGXRCSA-N 1 1 249.398 3.838 20 0 BHADMO CO[C@H](C)C[N@@H+](C)[C@H](C)c1ccc(C(C)C)cc1 ZINC000513326122 388423618 /nfs/dbraw/zinc/42/36/18/388423618.db2.gz YMNDKPVTKKKNHZ-ZIAGYGMSSA-N 1 1 249.398 3.838 20 0 BHADMO CC(C)=CC[N@H+](C)[C@H](C)c1ccc(F)c(F)c1 ZINC000513333397 527427516 /nfs/dbraw/zinc/42/75/16/527427516.db2.gz KKFZEERKCRWAMU-LLVKDONJSA-N 1 1 239.309 3.924 20 0 BHADMO CC(C)=CC[N@H+](C)[C@@H](C)c1ccc(F)c(F)c1 ZINC000513333398 388423540 /nfs/dbraw/zinc/42/35/40/388423540.db2.gz KKFZEERKCRWAMU-NSHDSACASA-N 1 1 239.309 3.924 20 0 BHADMO CCC[N@H+]1CCC[C@H]1Cc1ccccc1Cl ZINC000513387050 388426607 /nfs/dbraw/zinc/42/66/07/388426607.db2.gz UULXXSJTSHQBJF-ZDUSSCGKSA-N 1 1 237.774 3.757 20 0 BHADMO CCc1ccc([C@H]2CCC[N@@H+](CCCF)C2)cc1 ZINC000513417791 388428181 /nfs/dbraw/zinc/42/81/81/388428181.db2.gz ZTLCKPMSBLGPOQ-INIZCTEOSA-N 1 1 249.373 3.788 20 0 BHADMO CCc1ccc([C@@H]2CCC[N@@H+](CCCF)C2)cc1 ZINC000513417792 388427818 /nfs/dbraw/zinc/42/78/18/388427818.db2.gz ZTLCKPMSBLGPOQ-MRXNPFEDSA-N 1 1 249.373 3.788 20 0 BHADMO Cc1ccc(C[N@@H+](C)C[C@@H]2CC=CCC2)s1 ZINC000513421489 388427433 /nfs/dbraw/zinc/42/74/33/388427433.db2.gz WPNSKXDTRJJVMG-CYBMUJFWSA-N 1 1 235.396 3.845 20 0 BHADMO Cc1ccc(C[N@@H+](C)C[C@H]2CC=CCC2)s1 ZINC000513421495 388427734 /nfs/dbraw/zinc/42/77/34/388427734.db2.gz WPNSKXDTRJJVMG-ZDUSSCGKSA-N 1 1 235.396 3.845 20 0 BHADMO Cc1ccc(C[N@@H+](CC2CC2)C2CC2)cc1C ZINC000513437391 388429089 /nfs/dbraw/zinc/42/90/89/388429089.db2.gz CUUMUNGLZZSNEE-UHFFFAOYSA-N 1 1 229.367 3.678 20 0 BHADMO CC[C@H](C)[C@H](C)[N@@H+](Cc1occc1C)C1CC1 ZINC000513453978 529238056 /nfs/dbraw/zinc/23/80/56/529238056.db2.gz BSQPTKOGKFDNOB-AAEUAGOBSA-N 1 1 235.371 3.987 20 0 BHADMO CC[C@@H](C)[C@@H](C)[N@@H+](Cc1occc1C)C1CC1 ZINC000513453979 529391525 /nfs/dbraw/zinc/39/15/25/529391525.db2.gz BSQPTKOGKFDNOB-DGCLKSJQSA-N 1 1 235.371 3.987 20 0 BHADMO CC[C@H](C)[C@@H](C)[N@@H+](Cc1occc1C)C1CC1 ZINC000513453981 529203051 /nfs/dbraw/zinc/20/30/51/529203051.db2.gz BSQPTKOGKFDNOB-WCQYABFASA-N 1 1 235.371 3.987 20 0 BHADMO CC[C@@H](C)[C@H](C)[N@@H+](Cc1occc1C)C1CC1 ZINC000513453983 529411663 /nfs/dbraw/zinc/41/16/63/529411663.db2.gz BSQPTKOGKFDNOB-YPMHNXCESA-N 1 1 235.371 3.987 20 0 BHADMO CC[C@@H](C)[C@@H](C)[N@@H+](Cc1cccc(O)c1)C1CC1 ZINC000513454344 388428518 /nfs/dbraw/zinc/42/85/18/388428518.db2.gz FBJIFBRTFNLDSK-CHWSQXEVSA-N 1 1 247.382 3.791 20 0 BHADMO CC[C@@H](C)[C@H](C)[N@@H+](Cc1cccc(O)c1)C1CC1 ZINC000513454345 388429070 /nfs/dbraw/zinc/42/90/70/388429070.db2.gz FBJIFBRTFNLDSK-OLZOCXBDSA-N 1 1 247.382 3.791 20 0 BHADMO CC[C@H](C)[C@@H](C)[N@@H+](Cc1cccc(O)c1)C1CC1 ZINC000513454346 388428823 /nfs/dbraw/zinc/42/88/23/388428823.db2.gz FBJIFBRTFNLDSK-QWHCGFSZSA-N 1 1 247.382 3.791 20 0 BHADMO CC[C@H](C)[C@H](C)[N@@H+](Cc1cccc(O)c1)C1CC1 ZINC000513454347 388429093 /nfs/dbraw/zinc/42/90/93/388429093.db2.gz FBJIFBRTFNLDSK-STQMWFEESA-N 1 1 247.382 3.791 20 0 BHADMO CC(C)CN(C)c1cc[nH+]c2ccc(Cl)cc21 ZINC000513603613 388433709 /nfs/dbraw/zinc/43/37/09/388433709.db2.gz QSPIQODVRAMJFS-UHFFFAOYSA-N 1 1 248.757 3.980 20 0 BHADMO CCCN(C)c1cc[nH+]c2ccc(Cl)cc21 ZINC000513620838 388435287 /nfs/dbraw/zinc/43/52/87/388435287.db2.gz UJHMZFPURBBMLX-UHFFFAOYSA-N 1 1 234.730 3.734 20 0 BHADMO Clc1ccc2[nH+]ccc(NCC3CCC3)c2c1 ZINC000513621112 388435466 /nfs/dbraw/zinc/43/54/66/388435466.db2.gz VLXYYFHUEJMDKZ-UHFFFAOYSA-N 1 1 246.741 3.522 20 0 BHADMO C[C@@H]1c2ccccc2CC[N@@H+]1Cc1cccs1 ZINC000513671808 388439528 /nfs/dbraw/zinc/43/95/28/388439528.db2.gz GAYISIUKWWONOH-GFCCVEGCSA-N 1 1 243.375 3.867 20 0 BHADMO C[C@H]1c2ccccc2CC[N@@H+]1Cc1cccs1 ZINC000513671809 388439601 /nfs/dbraw/zinc/43/96/01/388439601.db2.gz GAYISIUKWWONOH-LBPRGKRZSA-N 1 1 243.375 3.867 20 0 BHADMO C[N@@H+](Cc1ccc(Cl)cc1F)C1CCCC1 ZINC000513691170 388440198 /nfs/dbraw/zinc/44/01/98/388440198.db2.gz RXRGQXQFSXBWNE-UHFFFAOYSA-N 1 1 241.737 3.854 20 0 BHADMO CC[N@@H+]([C@@H](C)c1ccc(Cl)cc1)C1CC1 ZINC000513717632 388442776 /nfs/dbraw/zinc/44/27/76/388442776.db2.gz PXYGTDMBLYXQKP-JTQLQIEISA-N 1 1 223.747 3.885 20 0 BHADMO CC[N@@H+]([C@H](C)c1ccc(Cl)cc1)C1CC1 ZINC000513717633 388442802 /nfs/dbraw/zinc/44/28/02/388442802.db2.gz PXYGTDMBLYXQKP-SNVBAGLBSA-N 1 1 223.747 3.885 20 0 BHADMO c1csc(C[N@H+]2CCCc3ccccc3C2)c1 ZINC000513729902 388444169 /nfs/dbraw/zinc/44/41/69/388444169.db2.gz SMNADXFMEIWXLW-UHFFFAOYSA-N 1 1 243.375 3.697 20 0 BHADMO CC(C)(C)[C@H]1CCC[N@H+]1Cc1ccc(Cl)o1 ZINC000513756476 388447885 /nfs/dbraw/zinc/44/78/85/388447885.db2.gz YEDDKDKSMSFBHN-LLVKDONJSA-N 1 1 241.762 3.944 20 0 BHADMO CC(C)(C)[C@@H]1CCC[N@H+]1Cc1ccc(Cl)o1 ZINC000513756480 388447613 /nfs/dbraw/zinc/44/76/13/388447613.db2.gz YEDDKDKSMSFBHN-NSHDSACASA-N 1 1 241.762 3.944 20 0 BHADMO C[N@@H+](CCSc1ccccc1)CCC1CC1 ZINC000513804056 388450512 /nfs/dbraw/zinc/45/05/12/388450512.db2.gz QUKYHFDNYMQPKM-UHFFFAOYSA-N 1 1 235.396 3.511 20 0 BHADMO C[C@@H]1C[C@@H](C)[N@@H+](CCSc2ccccc2)C1 ZINC000513804466 388450743 /nfs/dbraw/zinc/45/07/43/388450743.db2.gz ZGHJGAMURYKLHY-CHWSQXEVSA-N 1 1 235.396 3.509 20 0 BHADMO C[C@@H]1C[C@H](C)[N@@H+](CCSc2ccccc2)C1 ZINC000513804467 388450434 /nfs/dbraw/zinc/45/04/34/388450434.db2.gz ZGHJGAMURYKLHY-OLZOCXBDSA-N 1 1 235.396 3.509 20 0 BHADMO C[C@@H]1C[C@H](C)C[N@@H+]1CCSc1ccccc1 ZINC000513804468 533806396 /nfs/dbraw/zinc/80/63/96/533806396.db2.gz ZGHJGAMURYKLHY-QWHCGFSZSA-N 1 1 235.396 3.509 20 0 BHADMO C[C@H]1C[C@H](C)[N@@H+](CCSc2ccccc2)C1 ZINC000513804469 388450736 /nfs/dbraw/zinc/45/07/36/388450736.db2.gz ZGHJGAMURYKLHY-STQMWFEESA-N 1 1 235.396 3.509 20 0 BHADMO CCCC[N@H+]1CC[C@H](c2ccccc2C)C1 ZINC000513817100 388451395 /nfs/dbraw/zinc/45/13/95/388451395.db2.gz AVGOGCFFMRJVRI-AWEZNQCLSA-N 1 1 217.356 3.584 20 0 BHADMO CCCC[N@H+]1CC[C@@H](c2ccccc2C)C1 ZINC000513817101 388451684 /nfs/dbraw/zinc/45/16/84/388451684.db2.gz AVGOGCFFMRJVRI-CQSZACIVSA-N 1 1 217.356 3.584 20 0 BHADMO Cc1ccccc1[C@H]1CC[N@@H+](CC2CCCC2)C1 ZINC000513822042 388452324 /nfs/dbraw/zinc/45/23/24/388452324.db2.gz VMYVRMKZCIFNAV-INIZCTEOSA-N 1 1 243.394 3.975 20 0 BHADMO Cc1ccccc1[C@@H]1CC[N@@H+](CC2CCCC2)C1 ZINC000513822043 388452287 /nfs/dbraw/zinc/45/22/87/388452287.db2.gz VMYVRMKZCIFNAV-MRXNPFEDSA-N 1 1 243.394 3.975 20 0 BHADMO CC(C)C[N@@H+](C[C@@H]1CCCC(F)(F)C1)C1CC1 ZINC000513879693 388458211 /nfs/dbraw/zinc/45/82/11/388458211.db2.gz ISWVNBUAPQAFBN-GFCCVEGCSA-N 1 1 245.357 3.932 20 0 BHADMO CC(C)C[N@@H+](C[C@H]1CCCC(F)(F)C1)C1CC1 ZINC000513879694 388457998 /nfs/dbraw/zinc/45/79/98/388457998.db2.gz ISWVNBUAPQAFBN-LBPRGKRZSA-N 1 1 245.357 3.932 20 0 BHADMO CC(C)[N@@H+](C[C@@H]1CCCC(F)(F)C1)C1CC1 ZINC000513879718 388458099 /nfs/dbraw/zinc/45/80/99/388458099.db2.gz JGUHTMAPIGEREL-LLVKDONJSA-N 1 1 231.330 3.685 20 0 BHADMO CC(C)[N@@H+](C[C@H]1CCCC(F)(F)C1)C1CC1 ZINC000513879719 388458309 /nfs/dbraw/zinc/45/83/09/388458309.db2.gz JGUHTMAPIGEREL-NSHDSACASA-N 1 1 231.330 3.685 20 0 BHADMO CC(C)C[C@H](C)[N@@H+](C)Cc1cccc(N(C)C)c1 ZINC000513880454 388458065 /nfs/dbraw/zinc/45/80/65/388458065.db2.gz XYEHNJUGHQMMPI-AWEZNQCLSA-N 1 1 248.414 3.619 20 0 BHADMO CC(C)C[C@@H](C)[N@@H+](C)Cc1cccc(N(C)C)c1 ZINC000513880455 388457949 /nfs/dbraw/zinc/45/79/49/388457949.db2.gz XYEHNJUGHQMMPI-CQSZACIVSA-N 1 1 248.414 3.619 20 0 BHADMO CC(C)SCC[N@H+]1CCC[C@H]1C1CCCC1 ZINC000513886200 388459479 /nfs/dbraw/zinc/45/94/79/388459479.db2.gz GDEAGLHDTSCNAX-AWEZNQCLSA-N 1 1 241.444 3.783 20 0 BHADMO CC(C)SCC[N@H+]1CCC[C@@H]1C1CCCC1 ZINC000513886201 388459810 /nfs/dbraw/zinc/45/98/10/388459810.db2.gz GDEAGLHDTSCNAX-CQSZACIVSA-N 1 1 241.444 3.783 20 0 BHADMO CC(C)SCC[N@@H+](C)[C@@H]1CCC[C@@H](C)C1 ZINC000513888900 388460776 /nfs/dbraw/zinc/46/07/76/388460776.db2.gz JHCSMGFUNQPHMO-CHWSQXEVSA-N 1 1 229.433 3.639 20 0 BHADMO CC(C)SCC[N@@H+](C)[C@H]1CCC[C@@H](C)C1 ZINC000513888901 388460659 /nfs/dbraw/zinc/46/06/59/388460659.db2.gz JHCSMGFUNQPHMO-OLZOCXBDSA-N 1 1 229.433 3.639 20 0 BHADMO CC(C)SCC[N@@H+](C)[C@@H]1CCC[C@H](C)C1 ZINC000513888902 388460861 /nfs/dbraw/zinc/46/08/61/388460861.db2.gz JHCSMGFUNQPHMO-QWHCGFSZSA-N 1 1 229.433 3.639 20 0 BHADMO CC(C)SCC[N@@H+](C)[C@H]1CCC[C@H](C)C1 ZINC000513888903 388460610 /nfs/dbraw/zinc/46/06/10/388460610.db2.gz JHCSMGFUNQPHMO-STQMWFEESA-N 1 1 229.433 3.639 20 0 BHADMO CC(C)SCC[N@@H+](C)CC1CCCCC1 ZINC000513889678 388460684 /nfs/dbraw/zinc/46/06/84/388460684.db2.gz XVLHLGONSAXXGX-UHFFFAOYSA-N 1 1 229.433 3.640 20 0 BHADMO CC[N@@H+](C[C@@H]1CCCC(F)(F)C1)C(C)C ZINC000513892309 388461153 /nfs/dbraw/zinc/46/11/53/388461153.db2.gz WNYZBAKVDKSYBQ-LLVKDONJSA-N 1 1 219.319 3.542 20 0 BHADMO CC[N@@H+](C[C@H]1CCCC(F)(F)C1)C(C)C ZINC000513892310 388461594 /nfs/dbraw/zinc/46/15/94/388461594.db2.gz WNYZBAKVDKSYBQ-NSHDSACASA-N 1 1 219.319 3.542 20 0 BHADMO C[C@@H]1CCC[N@@H+](C[C@@H]2CCCC(F)(F)C2)CC1 ZINC000513893820 388461651 /nfs/dbraw/zinc/46/16/51/388461651.db2.gz BAZSOPHSPNFRPY-CHWSQXEVSA-N 1 1 245.357 3.934 20 0 BHADMO C[C@@H]1CCC[N@@H+](C[C@H]2CCCC(F)(F)C2)CC1 ZINC000513893821 388461341 /nfs/dbraw/zinc/46/13/41/388461341.db2.gz BAZSOPHSPNFRPY-OLZOCXBDSA-N 1 1 245.357 3.934 20 0 BHADMO C[C@H]1CCC[N@@H+](C[C@@H]2CCCC(F)(F)C2)CC1 ZINC000513893822 388461718 /nfs/dbraw/zinc/46/17/18/388461718.db2.gz BAZSOPHSPNFRPY-QWHCGFSZSA-N 1 1 245.357 3.934 20 0 BHADMO C[C@H]1CCC[N@@H+](C[C@H]2CCCC(F)(F)C2)CC1 ZINC000513893823 388461241 /nfs/dbraw/zinc/46/12/41/388461241.db2.gz BAZSOPHSPNFRPY-STQMWFEESA-N 1 1 245.357 3.934 20 0 BHADMO CC(C)[C@@H](C)[N@@H+](C)C[C@H]1CCCC(F)(F)C1 ZINC000513894441 388462040 /nfs/dbraw/zinc/46/20/40/388462040.db2.gz NKDZUYDRUHQPQO-NEPJUHHUSA-N 1 1 233.346 3.788 20 0 BHADMO CC(C)[C@H](C)[N@@H+](C)C[C@@H]1CCCC(F)(F)C1 ZINC000513894442 388462560 /nfs/dbraw/zinc/46/25/60/388462560.db2.gz NKDZUYDRUHQPQO-NWDGAFQWSA-N 1 1 233.346 3.788 20 0 BHADMO CC(C)[C@H](C)[N@@H+](C)C[C@H]1CCCC(F)(F)C1 ZINC000513894443 388462540 /nfs/dbraw/zinc/46/25/40/388462540.db2.gz NKDZUYDRUHQPQO-RYUDHWBXSA-N 1 1 233.346 3.788 20 0 BHADMO CC(C)[C@@H](C)[N@@H+](C)C[C@@H]1CCCC(F)(F)C1 ZINC000513894444 388462092 /nfs/dbraw/zinc/46/20/92/388462092.db2.gz NKDZUYDRUHQPQO-VXGBXAGGSA-N 1 1 233.346 3.788 20 0 BHADMO CCC[N@@H+](CC)Cc1c(Cl)cccc1OC ZINC000513896199 388462404 /nfs/dbraw/zinc/46/24/04/388462404.db2.gz TZYHQHHIBGZDMQ-UHFFFAOYSA-N 1 1 241.762 3.581 20 0 BHADMO C[N@@H+](CC1CCCC1)C[C@@H]1CCCC(F)(F)C1 ZINC000513896450 388461978 /nfs/dbraw/zinc/46/19/78/388461978.db2.gz YHDOLWRVOAYGPR-CYBMUJFWSA-N 1 1 245.357 3.934 20 0 BHADMO C[N@@H+](CC1CCCC1)C[C@H]1CCCC(F)(F)C1 ZINC000513896451 529864073 /nfs/dbraw/zinc/86/40/73/529864073.db2.gz YHDOLWRVOAYGPR-ZDUSSCGKSA-N 1 1 245.357 3.934 20 0 BHADMO CC(C)[C@H]1CCC[N@H+]1C[C@@H]1CCCC(F)(F)C1 ZINC000513896682 388463459 /nfs/dbraw/zinc/46/34/59/388463459.db2.gz CPEJSCLWMLAVNJ-CHWSQXEVSA-N 1 1 245.357 3.932 20 0 BHADMO CC(C)[C@@H]1CCC[N@H+]1C[C@@H]1CCCC(F)(F)C1 ZINC000513896683 388463139 /nfs/dbraw/zinc/46/31/39/388463139.db2.gz CPEJSCLWMLAVNJ-OLZOCXBDSA-N 1 1 245.357 3.932 20 0 BHADMO CC(C)[C@H]1CCC[N@H+]1C[C@H]1CCCC(F)(F)C1 ZINC000513896684 388462848 /nfs/dbraw/zinc/46/28/48/388462848.db2.gz CPEJSCLWMLAVNJ-QWHCGFSZSA-N 1 1 245.357 3.932 20 0 BHADMO CC(C)[C@@H]1CCC[N@H+]1C[C@H]1CCCC(F)(F)C1 ZINC000513896685 388463041 /nfs/dbraw/zinc/46/30/41/388463041.db2.gz CPEJSCLWMLAVNJ-STQMWFEESA-N 1 1 245.357 3.932 20 0 BHADMO CCC[N@@H+](CC)C[C@@H]1CCCC(F)(F)C1 ZINC000513897640 388463073 /nfs/dbraw/zinc/46/30/73/388463073.db2.gz UPCSJGUOATZACU-LLVKDONJSA-N 1 1 219.319 3.544 20 0 BHADMO CCC[N@@H+](CC)C[C@H]1CCCC(F)(F)C1 ZINC000513897641 388462820 /nfs/dbraw/zinc/46/28/20/388462820.db2.gz UPCSJGUOATZACU-NSHDSACASA-N 1 1 219.319 3.544 20 0 BHADMO CC(C)C[C@H]1CCC[N@H+]1CCSC(C)C ZINC000513898822 388463050 /nfs/dbraw/zinc/46/30/50/388463050.db2.gz QZIZMYHTRMICTD-CYBMUJFWSA-N 1 1 229.433 3.639 20 0 BHADMO CC(C)C[C@@H]1CCC[N@H+]1CCSC(C)C ZINC000513898823 388463010 /nfs/dbraw/zinc/46/30/10/388463010.db2.gz QZIZMYHTRMICTD-ZDUSSCGKSA-N 1 1 229.433 3.639 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)C[C@H]1CCCC(F)(F)C1 ZINC000513900471 388463980 /nfs/dbraw/zinc/46/39/80/388463980.db2.gz YFOVOEXEXJIVQT-NEPJUHHUSA-N 1 1 233.346 3.932 20 0 BHADMO CCC[C@H](C)[N@@H+](C)C[C@@H]1CCCC(F)(F)C1 ZINC000513900472 388463920 /nfs/dbraw/zinc/46/39/20/388463920.db2.gz YFOVOEXEXJIVQT-NWDGAFQWSA-N 1 1 233.346 3.932 20 0 BHADMO CCC[C@H](C)[N@@H+](C)C[C@H]1CCCC(F)(F)C1 ZINC000513900473 388463995 /nfs/dbraw/zinc/46/39/95/388463995.db2.gz YFOVOEXEXJIVQT-RYUDHWBXSA-N 1 1 233.346 3.932 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)C[C@@H]1CCCC(F)(F)C1 ZINC000513900474 388464064 /nfs/dbraw/zinc/46/40/64/388464064.db2.gz YFOVOEXEXJIVQT-VXGBXAGGSA-N 1 1 233.346 3.932 20 0 BHADMO C[N@@H+](C[C@@H]1CCCC(F)(F)C1)CC(C)(C)C ZINC000513904671 388464673 /nfs/dbraw/zinc/46/46/73/388464673.db2.gz ZWLWGAITLDHWQS-LLVKDONJSA-N 1 1 233.346 3.790 20 0 BHADMO C[N@@H+](C[C@H]1CCCC(F)(F)C1)CC(C)(C)C ZINC000513904672 388464454 /nfs/dbraw/zinc/46/44/54/388464454.db2.gz ZWLWGAITLDHWQS-NSHDSACASA-N 1 1 233.346 3.790 20 0 BHADMO CCCCOCC[N@@H+](C)CCC1CCCCC1 ZINC000513956020 388476746 /nfs/dbraw/zinc/47/67/46/388476746.db2.gz QUPIFSVRXCPXNS-UHFFFAOYSA-N 1 1 241.419 3.705 20 0 BHADMO CCCC[N@@H+](CC)Cc1c(F)cccc1F ZINC000513959211 388477501 /nfs/dbraw/zinc/47/75/01/388477501.db2.gz IBASRVZKXLIOCR-UHFFFAOYSA-N 1 1 227.298 3.587 20 0 BHADMO CCCC[N@@H+](C)Cc1cc(C)c(OC)c(C)c1 ZINC000513959451 388477824 /nfs/dbraw/zinc/47/78/24/388477824.db2.gz MFLMWTIBCDIVSX-UHFFFAOYSA-N 1 1 235.371 3.544 20 0 BHADMO CCCC[N@@H+](C)C[C@@H]1CCCC(F)(F)C1 ZINC000513959911 388477288 /nfs/dbraw/zinc/47/72/88/388477288.db2.gz WEWARKMJOKUKPI-LLVKDONJSA-N 1 1 219.319 3.544 20 0 BHADMO CCCC[N@@H+](C)C[C@H]1CCCC(F)(F)C1 ZINC000513959912 388477821 /nfs/dbraw/zinc/47/78/21/388477821.db2.gz WEWARKMJOKUKPI-NSHDSACASA-N 1 1 219.319 3.544 20 0 BHADMO CCC[N@@H+](CC1CC1)C[C@@H]1CCCC(F)(F)C1 ZINC000513962093 388477555 /nfs/dbraw/zinc/47/75/55/388477555.db2.gz QTXIVEZEMJVZEG-CYBMUJFWSA-N 1 1 245.357 3.934 20 0 BHADMO CCC[N@@H+](CC1CC1)C[C@H]1CCCC(F)(F)C1 ZINC000513962094 388477429 /nfs/dbraw/zinc/47/74/29/388477429.db2.gz QTXIVEZEMJVZEG-ZDUSSCGKSA-N 1 1 245.357 3.934 20 0 BHADMO CCCC[N@@H+](CC)C[C@@H]1CCCC(F)(F)C1 ZINC000513962469 388477840 /nfs/dbraw/zinc/47/78/40/388477840.db2.gz YIWJCGMBFRJMFN-GFCCVEGCSA-N 1 1 233.346 3.934 20 0 BHADMO CCCC[N@@H+](CC)C[C@H]1CCCC(F)(F)C1 ZINC000513962470 388477749 /nfs/dbraw/zinc/47/77/49/388477749.db2.gz YIWJCGMBFRJMFN-LBPRGKRZSA-N 1 1 233.346 3.934 20 0 BHADMO CC(C)SCC[N@@H+](C)C1CCCCCC1 ZINC000513965086 388477605 /nfs/dbraw/zinc/47/76/05/388477605.db2.gz TXGROPWDBVLYAL-UHFFFAOYSA-N 1 1 229.433 3.783 20 0 BHADMO C[C@@H]1C[C@H](C)C[N@H+](C[C@@H]2CCCC(F)(F)C2)C1 ZINC000513965226 388478809 /nfs/dbraw/zinc/47/88/09/388478809.db2.gz VYKQQDKGPDBYFM-FRRDWIJNSA-N 1 1 245.357 3.790 20 0 BHADMO C[C@@H]1C[C@H](C)C[N@H+](C[C@H]2CCCC(F)(F)C2)C1 ZINC000513965229 388478588 /nfs/dbraw/zinc/47/85/88/388478588.db2.gz VYKQQDKGPDBYFM-XQQFMLRXSA-N 1 1 245.357 3.790 20 0 BHADMO C[C@@H]1CCC[N@@H+](C[C@H]2CCCC(F)(F)C2)C1 ZINC000513965260 388478714 /nfs/dbraw/zinc/47/87/14/388478714.db2.gz WLHKFBZKVCOCJB-NEPJUHHUSA-N 1 1 231.330 3.544 20 0 BHADMO C[C@H]1CCC[N@@H+](C[C@@H]2CCCC(F)(F)C2)C1 ZINC000513965261 388478960 /nfs/dbraw/zinc/47/89/60/388478960.db2.gz WLHKFBZKVCOCJB-NWDGAFQWSA-N 1 1 231.330 3.544 20 0 BHADMO C[C@H]1CCC[N@@H+](C[C@H]2CCCC(F)(F)C2)C1 ZINC000513965262 388478949 /nfs/dbraw/zinc/47/89/49/388478949.db2.gz WLHKFBZKVCOCJB-RYUDHWBXSA-N 1 1 231.330 3.544 20 0 BHADMO C[C@@H]1CCC[N@@H+](C[C@@H]2CCCC(F)(F)C2)C1 ZINC000513965263 388478963 /nfs/dbraw/zinc/47/89/63/388478963.db2.gz WLHKFBZKVCOCJB-VXGBXAGGSA-N 1 1 231.330 3.544 20 0 BHADMO C[C@@H]1CCCC[N@H+]1C[C@H]1CCCC(F)(F)C1 ZINC000513966084 388478789 /nfs/dbraw/zinc/47/87/89/388478789.db2.gz LFWCMYCNGJKGQW-NEPJUHHUSA-N 1 1 231.330 3.686 20 0 BHADMO C[C@H]1CCCC[N@H+]1C[C@@H]1CCCC(F)(F)C1 ZINC000513966085 388478855 /nfs/dbraw/zinc/47/88/55/388478855.db2.gz LFWCMYCNGJKGQW-NWDGAFQWSA-N 1 1 231.330 3.686 20 0 BHADMO C[C@H]1CCCC[N@H+]1C[C@H]1CCCC(F)(F)C1 ZINC000513966086 388478824 /nfs/dbraw/zinc/47/88/24/388478824.db2.gz LFWCMYCNGJKGQW-RYUDHWBXSA-N 1 1 231.330 3.686 20 0 BHADMO C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCC(F)(F)C1 ZINC000513966087 388478783 /nfs/dbraw/zinc/47/87/83/388478783.db2.gz LFWCMYCNGJKGQW-VXGBXAGGSA-N 1 1 231.330 3.686 20 0 BHADMO CC[N@@H+](CC(C)C)C[C@@H]1CCCC(F)(F)C1 ZINC000513967477 388478852 /nfs/dbraw/zinc/47/88/52/388478852.db2.gz LBICIDPCIQDCNX-GFCCVEGCSA-N 1 1 233.346 3.790 20 0 BHADMO CC[N@@H+](CC(C)C)C[C@H]1CCCC(F)(F)C1 ZINC000513967478 388478252 /nfs/dbraw/zinc/47/82/52/388478252.db2.gz LBICIDPCIQDCNX-LBPRGKRZSA-N 1 1 233.346 3.790 20 0 BHADMO C[N@@H+](C[C@@H]1CCCC(F)(F)C1)C1CCCC1 ZINC000513971178 388479750 /nfs/dbraw/zinc/47/97/50/388479750.db2.gz FOGUVCBDSGVUCM-LLVKDONJSA-N 1 1 231.330 3.686 20 0 BHADMO C[N@@H+](C[C@H]1CCCC(F)(F)C1)C1CCCC1 ZINC000513971179 529962871 /nfs/dbraw/zinc/96/28/71/529962871.db2.gz FOGUVCBDSGVUCM-NSHDSACASA-N 1 1 231.330 3.686 20 0 BHADMO CC[N@@H+](CCSC(C)C)C1CCCCC1 ZINC000513971316 528583655 /nfs/dbraw/zinc/58/36/55/528583655.db2.gz HWDONXNYQGVPNO-UHFFFAOYSA-N 1 1 229.433 3.783 20 0 BHADMO CC[C@@H]1CCC[N@@H+](C[C@@H]2CCCC(F)(F)C2)C1 ZINC000513972379 388479865 /nfs/dbraw/zinc/47/98/65/388479865.db2.gz BKASQZWHKVTKMW-CHWSQXEVSA-N 1 1 245.357 3.934 20 0 BHADMO CC[C@@H]1CCC[N@@H+](C[C@H]2CCCC(F)(F)C2)C1 ZINC000513972380 388479695 /nfs/dbraw/zinc/47/96/95/388479695.db2.gz BKASQZWHKVTKMW-OLZOCXBDSA-N 1 1 245.357 3.934 20 0 BHADMO CC[C@H]1CCC[N@@H+](C[C@@H]2CCCC(F)(F)C2)C1 ZINC000513972381 388479546 /nfs/dbraw/zinc/47/95/46/388479546.db2.gz BKASQZWHKVTKMW-QWHCGFSZSA-N 1 1 245.357 3.934 20 0 BHADMO CC[C@H]1CCC[N@@H+](C[C@H]2CCCC(F)(F)C2)C1 ZINC000513972382 388479390 /nfs/dbraw/zinc/47/93/90/388479390.db2.gz BKASQZWHKVTKMW-STQMWFEESA-N 1 1 245.357 3.934 20 0 BHADMO CC[N@@H+](CCC(F)(F)F)Cc1ccccc1C ZINC000514001217 388483710 /nfs/dbraw/zinc/48/37/10/388483710.db2.gz HKLPAUGEDIQRHH-UHFFFAOYSA-N 1 1 245.288 3.769 20 0 BHADMO CCCCC[N@@H+](C[C@@H]1CCCO1)[C@H](C)CCC ZINC000514002113 388483820 /nfs/dbraw/zinc/48/38/20/388483820.db2.gz SDMGKTJIZASKOJ-CABCVRRESA-N 1 1 241.419 3.846 20 0 BHADMO CCCCC[N@@H+](C[C@@H]1CCCO1)[C@@H](C)CCC ZINC000514002114 388483911 /nfs/dbraw/zinc/48/39/11/388483911.db2.gz SDMGKTJIZASKOJ-GJZGRUSLSA-N 1 1 241.419 3.846 20 0 BHADMO CCCCC[N@@H+](C[C@H]1CCCO1)[C@H](C)CCC ZINC000514002115 388483869 /nfs/dbraw/zinc/48/38/69/388483869.db2.gz SDMGKTJIZASKOJ-HUUCEWRRSA-N 1 1 241.419 3.846 20 0 BHADMO CCCCC[N@@H+](C[C@H]1CCCO1)[C@@H](C)CCC ZINC000514002116 388483405 /nfs/dbraw/zinc/48/34/05/388483405.db2.gz SDMGKTJIZASKOJ-LSDHHAIUSA-N 1 1 241.419 3.846 20 0 BHADMO Cc1cc(C)cc(C[N@@H+](C)CCC(F)(F)F)c1 ZINC000514007808 388483809 /nfs/dbraw/zinc/48/38/09/388483809.db2.gz SNMSXYGJUCXPKP-UHFFFAOYSA-N 1 1 245.288 3.688 20 0 BHADMO CCCCC[N@@H+](C[C@@H]1CCOC1)[C@H](C)CCC ZINC000514008439 388484948 /nfs/dbraw/zinc/48/49/48/388484948.db2.gz JJRTXXNKBIJHPO-CABCVRRESA-N 1 1 241.419 3.704 20 0 BHADMO CCCCC[N@@H+](C[C@@H]1CCOC1)[C@@H](C)CCC ZINC000514008440 388485035 /nfs/dbraw/zinc/48/50/35/388485035.db2.gz JJRTXXNKBIJHPO-GJZGRUSLSA-N 1 1 241.419 3.704 20 0 BHADMO CCCCC[N@@H+](C[C@H]1CCOC1)[C@H](C)CCC ZINC000514008441 388484493 /nfs/dbraw/zinc/48/44/93/388484493.db2.gz JJRTXXNKBIJHPO-HUUCEWRRSA-N 1 1 241.419 3.704 20 0 BHADMO CCCCC[N@@H+](C[C@H]1CCOC1)[C@@H](C)CCC ZINC000514008442 388484964 /nfs/dbraw/zinc/48/49/64/388484964.db2.gz JJRTXXNKBIJHPO-LSDHHAIUSA-N 1 1 241.419 3.704 20 0 BHADMO CCC[N@@H+](CCCc1ccccc1)CC(F)F ZINC000514008484 388485264 /nfs/dbraw/zinc/48/52/64/388485264.db2.gz KFTUWTGRYIMBHH-UHFFFAOYSA-N 1 1 241.325 3.596 20 0 BHADMO CCC[N@H+](CCCc1ccccc1)CC(F)F ZINC000514008484 388485262 /nfs/dbraw/zinc/48/52/62/388485262.db2.gz KFTUWTGRYIMBHH-UHFFFAOYSA-N 1 1 241.325 3.596 20 0 BHADMO CCC(C)(C)[N@@H+](C)C[C@@H]1CCCC(F)(F)C1 ZINC000514074544 388492419 /nfs/dbraw/zinc/49/24/19/388492419.db2.gz PZKVCAIQCCXVBM-LLVKDONJSA-N 1 1 233.346 3.932 20 0 BHADMO CCC(C)(C)[N@@H+](C)C[C@H]1CCCC(F)(F)C1 ZINC000514074545 388492580 /nfs/dbraw/zinc/49/25/80/388492580.db2.gz PZKVCAIQCCXVBM-NSHDSACASA-N 1 1 233.346 3.932 20 0 BHADMO C[C@@H]1CC[C@H](C)[N@@H+]1C[C@@H]1CCCC(F)(F)C1 ZINC000514076113 388493057 /nfs/dbraw/zinc/49/30/57/388493057.db2.gz RPQKPLSTBNGVLY-GRYCIOLGSA-N 1 1 231.330 3.685 20 0 BHADMO C[C@@H]1CC[C@H](C)[N@@H+]1C[C@H]1CCCC(F)(F)C1 ZINC000514076115 388493015 /nfs/dbraw/zinc/49/30/15/388493015.db2.gz RPQKPLSTBNGVLY-TUAOUCFPSA-N 1 1 231.330 3.685 20 0 BHADMO CC[C@]1(C)CC[N@@H+](C[C@@H]2CCCC(F)(F)C2)C1 ZINC000514077245 388493532 /nfs/dbraw/zinc/49/35/32/388493532.db2.gz NWPUMEKYPWIAAM-CHWSQXEVSA-N 1 1 245.357 3.934 20 0 BHADMO CC[C@@]1(C)CC[N@@H+](C[C@@H]2CCCC(F)(F)C2)C1 ZINC000514077246 388492981 /nfs/dbraw/zinc/49/29/81/388492981.db2.gz NWPUMEKYPWIAAM-OLZOCXBDSA-N 1 1 245.357 3.934 20 0 BHADMO CC[C@]1(C)CC[N@@H+](C[C@H]2CCCC(F)(F)C2)C1 ZINC000514077247 388493489 /nfs/dbraw/zinc/49/34/89/388493489.db2.gz NWPUMEKYPWIAAM-QWHCGFSZSA-N 1 1 245.357 3.934 20 0 BHADMO CC[C@@]1(C)CC[N@@H+](C[C@H]2CCCC(F)(F)C2)C1 ZINC000514077248 388493629 /nfs/dbraw/zinc/49/36/29/388493629.db2.gz NWPUMEKYPWIAAM-STQMWFEESA-N 1 1 245.357 3.934 20 0 BHADMO C[N@@H+](CCC1CC1)C[C@@H]1CCCC(F)(F)C1 ZINC000514077614 388493556 /nfs/dbraw/zinc/49/35/56/388493556.db2.gz VVXLMPADLQXPOI-GFCCVEGCSA-N 1 1 231.330 3.544 20 0 BHADMO C[N@@H+](CCC1CC1)C[C@H]1CCCC(F)(F)C1 ZINC000514077615 388493353 /nfs/dbraw/zinc/49/33/53/388493353.db2.gz VVXLMPADLQXPOI-LBPRGKRZSA-N 1 1 231.330 3.544 20 0 BHADMO CC[C@@H](C)[N@@H+](C)C[C@@H]1CCCC(F)(F)C1 ZINC000514080170 388493485 /nfs/dbraw/zinc/49/34/85/388493485.db2.gz OEKDOSCAQMYFPH-GHMZBOCLSA-N 1 1 219.319 3.542 20 0 BHADMO CC[C@@H](C)[N@@H+](C)C[C@H]1CCCC(F)(F)C1 ZINC000514080171 388493379 /nfs/dbraw/zinc/49/33/79/388493379.db2.gz OEKDOSCAQMYFPH-MNOVXSKESA-N 1 1 219.319 3.542 20 0 BHADMO CC[C@H](C)[N@@H+](C)C[C@H]1CCCC(F)(F)C1 ZINC000514080172 388493330 /nfs/dbraw/zinc/49/33/30/388493330.db2.gz OEKDOSCAQMYFPH-QWRGUYRKSA-N 1 1 219.319 3.542 20 0 BHADMO CC[C@H](C)[N@@H+](C)C[C@@H]1CCCC(F)(F)C1 ZINC000514080173 388493635 /nfs/dbraw/zinc/49/36/35/388493635.db2.gz OEKDOSCAQMYFPH-WDEREUQCSA-N 1 1 219.319 3.542 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1c(Cl)cccc1OC ZINC000514080938 388493427 /nfs/dbraw/zinc/49/34/27/388493427.db2.gz ZQTSPWUFSGUXRV-JTQLQIEISA-N 1 1 241.762 3.579 20 0 BHADMO CC[C@@H](C)[N@@H+](C)Cc1c(Cl)cccc1OC ZINC000514080939 388493250 /nfs/dbraw/zinc/49/32/50/388493250.db2.gz ZQTSPWUFSGUXRV-SNVBAGLBSA-N 1 1 241.762 3.579 20 0 BHADMO CC(C)SCC[N@H+]1CCCC12CCCCC2 ZINC000514090732 259398475 /nfs/dbraw/zinc/39/84/75/259398475.db2.gz RTAYCNYELFNGLO-UHFFFAOYSA-N 1 1 241.444 3.927 20 0 BHADMO FC1(F)CCC[C@H](C[N@H+]2C[C@@H]3CCC[C@@H]3C2)C1 ZINC000514090822 259398367 /nfs/dbraw/zinc/39/83/67/259398367.db2.gz SKIOJAOOKNWQQR-RWMBFGLXSA-N 1 1 243.341 3.544 20 0 BHADMO FC1(F)CCC[C@@H](C[N@H+]2C[C@@H]3CCC[C@@H]3C2)C1 ZINC000514090823 259398501 /nfs/dbraw/zinc/39/85/01/259398501.db2.gz SKIOJAOOKNWQQR-UPJWGTAASA-N 1 1 243.341 3.544 20 0 BHADMO Cn1cccc1C[N@@H+](CC1CC1)C1CCCCC1 ZINC000514094520 386596454 /nfs/dbraw/zinc/59/64/54/386596454.db2.gz NOJCJGQAJWVVQG-UHFFFAOYSA-N 1 1 246.398 3.570 20 0 BHADMO C[C@H](C[N@@H+](C)Cc1cccs1)c1ccccc1 ZINC000514095077 262753425 /nfs/dbraw/zinc/75/34/25/262753425.db2.gz PXLJNXDPHYNKKP-CYBMUJFWSA-N 1 1 245.391 3.984 20 0 BHADMO C[C@@H](C[N@@H+](C)Cc1cccs1)c1ccccc1 ZINC000514095080 386603808 /nfs/dbraw/zinc/60/38/08/386603808.db2.gz PXLJNXDPHYNKKP-ZDUSSCGKSA-N 1 1 245.391 3.984 20 0 BHADMO Cc1ccc(C[N@H+](C)C[C@@H](C)c2ccccc2)o1 ZINC000514096457 386680463 /nfs/dbraw/zinc/68/04/63/386680463.db2.gz WAQXWMKBURKISN-CYBMUJFWSA-N 1 1 243.350 3.824 20 0 BHADMO Cc1ccc(C[N@H+](C)C[C@H](C)c2ccccc2)o1 ZINC000514096464 386682610 /nfs/dbraw/zinc/68/26/10/386682610.db2.gz WAQXWMKBURKISN-ZDUSSCGKSA-N 1 1 243.350 3.824 20 0 BHADMO CCC[N@@H+](C)C1CCC(C(C)(C)C)CC1 ZINC000514098990 386116290 /nfs/dbraw/zinc/11/62/90/386116290.db2.gz KYHSYSXLSMNKHC-UHFFFAOYSA-N 1 1 211.393 3.933 20 0 BHADMO COc1ccc(C[N@H+]2CCC[C@H]2C(C)(C)C)cc1 ZINC000514099871 386846188 /nfs/dbraw/zinc/84/61/88/386846188.db2.gz RRFMUTDXGOJUCH-HNNXBMFYSA-N 1 1 247.382 3.706 20 0 BHADMO COc1ccc(C[N@H+]2CCC[C@@H]2C(C)(C)C)cc1 ZINC000514099873 386847754 /nfs/dbraw/zinc/84/77/54/386847754.db2.gz RRFMUTDXGOJUCH-OAHLLOKOSA-N 1 1 247.382 3.706 20 0 BHADMO COc1ccccc1C[N@H+]1CCC[C@H]1C(C)(C)C ZINC000514100580 386883677 /nfs/dbraw/zinc/88/36/77/386883677.db2.gz WTAYEXRFYGCDSE-HNNXBMFYSA-N 1 1 247.382 3.706 20 0 BHADMO COc1ccccc1C[N@H+]1CCC[C@@H]1C(C)(C)C ZINC000514100581 386885213 /nfs/dbraw/zinc/88/52/13/386885213.db2.gz WTAYEXRFYGCDSE-OAHLLOKOSA-N 1 1 247.382 3.706 20 0 BHADMO COCCC[N@@H+](C)C1CCC(C(C)(C)C)CC1 ZINC000514104448 386910085 /nfs/dbraw/zinc/91/00/85/386910085.db2.gz JWUOIFDGRPSLSK-UHFFFAOYSA-N 1 1 241.419 3.560 20 0 BHADMO CC(C)[C@@H]1CC[N@@H+](C[C@@H]2CCCC(F)(F)C2)C1 ZINC000514110739 323313995 /nfs/dbraw/zinc/31/39/95/323313995.db2.gz IDKDGNWZMWGALW-CHWSQXEVSA-N 1 1 245.357 3.790 20 0 BHADMO CC(C)[C@H]1CC[N@@H+](C[C@@H]2CCCC(F)(F)C2)C1 ZINC000514110740 323313827 /nfs/dbraw/zinc/31/38/27/323313827.db2.gz IDKDGNWZMWGALW-OLZOCXBDSA-N 1 1 245.357 3.790 20 0 BHADMO CC(C)[C@@H]1CC[N@@H+](C[C@H]2CCCC(F)(F)C2)C1 ZINC000514110741 323314000 /nfs/dbraw/zinc/31/40/00/323314000.db2.gz IDKDGNWZMWGALW-QWHCGFSZSA-N 1 1 245.357 3.790 20 0 BHADMO CC(C)[C@H]1CC[N@@H+](C[C@H]2CCCC(F)(F)C2)C1 ZINC000514110742 323313926 /nfs/dbraw/zinc/31/39/26/323313926.db2.gz IDKDGNWZMWGALW-STQMWFEESA-N 1 1 245.357 3.790 20 0 BHADMO CC[C@@H]1CC[N@@H+](C[C@H]2CCCC(F)(F)C2)C1 ZINC000514111022 323314016 /nfs/dbraw/zinc/31/40/16/323314016.db2.gz LQMTXMWCYIPMRB-NEPJUHHUSA-N 1 1 231.330 3.544 20 0 BHADMO CC[C@H]1CC[N@@H+](C[C@@H]2CCCC(F)(F)C2)C1 ZINC000514111023 323314029 /nfs/dbraw/zinc/31/40/29/323314029.db2.gz LQMTXMWCYIPMRB-NWDGAFQWSA-N 1 1 231.330 3.544 20 0 BHADMO CC[C@H]1CC[N@@H+](C[C@H]2CCCC(F)(F)C2)C1 ZINC000514111024 323313928 /nfs/dbraw/zinc/31/39/28/323313928.db2.gz LQMTXMWCYIPMRB-RYUDHWBXSA-N 1 1 231.330 3.544 20 0 BHADMO CC[C@@H]1CC[N@@H+](C[C@@H]2CCCC(F)(F)C2)C1 ZINC000514111025 323313689 /nfs/dbraw/zinc/31/36/89/323313689.db2.gz LQMTXMWCYIPMRB-VXGBXAGGSA-N 1 1 231.330 3.544 20 0 BHADMO C[C@@H]([N@@H+](C)C[C@H]1CCCC(F)(F)C1)C1(C)CC1 ZINC000514114973 323314624 /nfs/dbraw/zinc/31/46/24/323314624.db2.gz MSOCACLLSNUGAV-NEPJUHHUSA-N 1 1 245.357 3.932 20 0 BHADMO C[C@H]([N@@H+](C)C[C@@H]1CCCC(F)(F)C1)C1(C)CC1 ZINC000514114974 323314882 /nfs/dbraw/zinc/31/48/82/323314882.db2.gz MSOCACLLSNUGAV-NWDGAFQWSA-N 1 1 245.357 3.932 20 0 BHADMO C[C@H]([N@@H+](C)C[C@H]1CCCC(F)(F)C1)C1(C)CC1 ZINC000514114975 323314539 /nfs/dbraw/zinc/31/45/39/323314539.db2.gz MSOCACLLSNUGAV-RYUDHWBXSA-N 1 1 245.357 3.932 20 0 BHADMO C[C@@H]([N@@H+](C)C[C@@H]1CCCC(F)(F)C1)C1(C)CC1 ZINC000514114976 323314657 /nfs/dbraw/zinc/31/46/57/323314657.db2.gz MSOCACLLSNUGAV-VXGBXAGGSA-N 1 1 245.357 3.932 20 0 BHADMO CC[C@@H](C)C[N@@H+](C)C[C@H]1CCCC(F)(F)C1 ZINC000514116190 323313987 /nfs/dbraw/zinc/31/39/87/323313987.db2.gz YSYBBJJCUPAKQB-NEPJUHHUSA-N 1 1 233.346 3.790 20 0 BHADMO CC[C@H](C)C[N@@H+](C)C[C@@H]1CCCC(F)(F)C1 ZINC000514116191 323314034 /nfs/dbraw/zinc/31/40/34/323314034.db2.gz YSYBBJJCUPAKQB-NWDGAFQWSA-N 1 1 233.346 3.790 20 0 BHADMO CC[C@H](C)C[N@@H+](C)C[C@H]1CCCC(F)(F)C1 ZINC000514116192 323313980 /nfs/dbraw/zinc/31/39/80/323313980.db2.gz YSYBBJJCUPAKQB-RYUDHWBXSA-N 1 1 233.346 3.790 20 0 BHADMO CC[C@@H](C)C[N@@H+](C)C[C@@H]1CCCC(F)(F)C1 ZINC000514116193 323313956 /nfs/dbraw/zinc/31/39/56/323313956.db2.gz YSYBBJJCUPAKQB-VXGBXAGGSA-N 1 1 233.346 3.790 20 0 BHADMO CCC1(CC)CC[N@@H+](CCSC(C)C)C1 ZINC000514116328 323313620 /nfs/dbraw/zinc/31/36/20/323313620.db2.gz ZQSWVBURPFWWEP-UHFFFAOYSA-N 1 1 229.433 3.640 20 0 BHADMO CC[N@@H+](CCO[C@H]1CCCC[C@H]1C)CC(C)C ZINC000514120845 386943142 /nfs/dbraw/zinc/94/31/42/386943142.db2.gz OPOOYIHPJJHXRU-CABCVRRESA-N 1 1 241.419 3.560 20 0 BHADMO CC[N@@H+](CCO[C@H]1CCCC[C@@H]1C)CC(C)C ZINC000514120846 386942530 /nfs/dbraw/zinc/94/25/30/386942530.db2.gz OPOOYIHPJJHXRU-GJZGRUSLSA-N 1 1 241.419 3.560 20 0 BHADMO CC[N@@H+](CCO[C@@H]1CCCC[C@H]1C)CC(C)C ZINC000514120847 386943817 /nfs/dbraw/zinc/94/38/17/386943817.db2.gz OPOOYIHPJJHXRU-HUUCEWRRSA-N 1 1 241.419 3.560 20 0 BHADMO CC[N@@H+](CCO[C@@H]1CCCC[C@@H]1C)CC(C)C ZINC000514120848 386942958 /nfs/dbraw/zinc/94/29/58/386942958.db2.gz OPOOYIHPJJHXRU-LSDHHAIUSA-N 1 1 241.419 3.560 20 0 BHADMO FC1(F)CCC[C@H](C[N@H+]2CC[C@H](C3CC3)C2)C1 ZINC000514127584 386947440 /nfs/dbraw/zinc/94/74/40/386947440.db2.gz WUPLNJBQWVRQNG-AAEUAGOBSA-N 1 1 243.341 3.544 20 0 BHADMO FC1(F)CCC[C@@H](C[N@H+]2CC[C@@H](C3CC3)C2)C1 ZINC000514127585 386947467 /nfs/dbraw/zinc/94/74/67/386947467.db2.gz WUPLNJBQWVRQNG-DGCLKSJQSA-N 1 1 243.341 3.544 20 0 BHADMO FC1(F)CCC[C@H](C[N@H+]2CC[C@@H](C3CC3)C2)C1 ZINC000514127586 256680077 /nfs/dbraw/zinc/68/00/77/256680077.db2.gz WUPLNJBQWVRQNG-WCQYABFASA-N 1 1 243.341 3.544 20 0 BHADMO FC1(F)CCC[C@@H](C[N@H+]2CC[C@H](C3CC3)C2)C1 ZINC000514127587 256680075 /nfs/dbraw/zinc/68/00/75/256680075.db2.gz WUPLNJBQWVRQNG-YPMHNXCESA-N 1 1 243.341 3.544 20 0 BHADMO C[C@@H]1CC[N@@H+](C[C@H]2CCCC(F)(F)C2)C[C@@H]1C ZINC000514131546 256680111 /nfs/dbraw/zinc/68/01/11/256680111.db2.gz ZWHALFBNCBTAFI-AGIUHOORSA-N 1 1 245.357 3.790 20 0 BHADMO C[C@@H]1CC[N@@H+](C[C@@H]2CCCC(F)(F)C2)C[C@@H]1C ZINC000514131547 386950809 /nfs/dbraw/zinc/95/08/09/386950809.db2.gz ZWHALFBNCBTAFI-FRRDWIJNSA-N 1 1 245.357 3.790 20 0 BHADMO C[C@@H]1CC[N@@H+](C[C@@H]2CCCC(F)(F)C2)C[C@H]1C ZINC000514131548 386951639 /nfs/dbraw/zinc/95/16/39/386951639.db2.gz ZWHALFBNCBTAFI-JHJVBQTASA-N 1 1 245.357 3.790 20 0 BHADMO C[C@@H]1CC[N@@H+](C[C@H]2CCCC(F)(F)C2)C[C@H]1C ZINC000514131549 386950870 /nfs/dbraw/zinc/95/08/70/386950870.db2.gz ZWHALFBNCBTAFI-UPJWGTAASA-N 1 1 245.357 3.790 20 0 BHADMO C[C@H](C1CCC1)[N@@H+](C)C[C@H]1CCCC(F)(F)C1 ZINC000514137431 386949380 /nfs/dbraw/zinc/94/93/80/386949380.db2.gz FYRVCAGPMGRNTA-NEPJUHHUSA-N 1 1 245.357 3.932 20 0 BHADMO C[C@@H](C1CCC1)[N@@H+](C)C[C@@H]1CCCC(F)(F)C1 ZINC000514137432 256680093 /nfs/dbraw/zinc/68/00/93/256680093.db2.gz FYRVCAGPMGRNTA-NWDGAFQWSA-N 1 1 245.357 3.932 20 0 BHADMO C[C@@H](C1CCC1)[N@@H+](C)C[C@H]1CCCC(F)(F)C1 ZINC000514137433 386949185 /nfs/dbraw/zinc/94/91/85/386949185.db2.gz FYRVCAGPMGRNTA-RYUDHWBXSA-N 1 1 245.357 3.932 20 0 BHADMO C[C@H](C1CCC1)[N@@H+](C)C[C@@H]1CCCC(F)(F)C1 ZINC000514137434 386949733 /nfs/dbraw/zinc/94/97/33/386949733.db2.gz FYRVCAGPMGRNTA-VXGBXAGGSA-N 1 1 245.357 3.932 20 0 BHADMO CC(C)SCC[N@H+]1CCCc2ccccc2C1 ZINC000514138351 386948968 /nfs/dbraw/zinc/94/89/68/386948968.db2.gz NRHJJTIMXIYLNQ-UHFFFAOYSA-N 1 1 249.423 3.576 20 0 BHADMO Cc1ccccc1C[C@@H]1CCC[N@@H+]1CC(C)C ZINC000514174904 324108958 /nfs/dbraw/zinc/10/89/58/324108958.db2.gz SDRSDKQSHHANMO-INIZCTEOSA-N 1 1 231.383 3.658 20 0 BHADMO Cc1ccccc1C[C@H]1CCC[N@@H+]1CC(C)C ZINC000514174905 324109357 /nfs/dbraw/zinc/10/93/57/324109357.db2.gz SDRSDKQSHHANMO-MRXNPFEDSA-N 1 1 231.383 3.658 20 0 BHADMO CCCC[N@H+]1CCC[C@H]1Cc1ccccc1C ZINC000514184247 324108926 /nfs/dbraw/zinc/10/89/26/324108926.db2.gz RYTOJILFFAAFDV-INIZCTEOSA-N 1 1 231.383 3.802 20 0 BHADMO CCCC[N@H+]1CCC[C@@H]1Cc1ccccc1C ZINC000514184248 324108269 /nfs/dbraw/zinc/10/82/69/324108269.db2.gz RYTOJILFFAAFDV-MRXNPFEDSA-N 1 1 231.383 3.802 20 0 BHADMO CC[C@@H]1[C@H](C)CC[N@H+]1C[C@H]1CCCC(F)(F)C1 ZINC000514205878 387272214 /nfs/dbraw/zinc/27/22/14/387272214.db2.gz HSMTVFKDIRMMQK-FRRDWIJNSA-N 1 1 245.357 3.932 20 0 BHADMO CC[C@@H]1[C@H](C)CC[N@H+]1C[C@@H]1CCCC(F)(F)C1 ZINC000514205879 387272264 /nfs/dbraw/zinc/27/22/64/387272264.db2.gz HSMTVFKDIRMMQK-JHJVBQTASA-N 1 1 245.357 3.932 20 0 BHADMO CC[C@@H]1[C@@H](C)CC[N@H+]1C[C@H]1CCCC(F)(F)C1 ZINC000514205880 387271711 /nfs/dbraw/zinc/27/17/11/387271711.db2.gz HSMTVFKDIRMMQK-RWMBFGLXSA-N 1 1 245.357 3.932 20 0 BHADMO CC[C@@H]1[C@@H](C)CC[N@H+]1C[C@@H]1CCCC(F)(F)C1 ZINC000514205881 387272293 /nfs/dbraw/zinc/27/22/93/387272293.db2.gz HSMTVFKDIRMMQK-YNEHKIRRSA-N 1 1 245.357 3.932 20 0 BHADMO CC[N@@H+](CC1CC1)C[C@@H]1CCCC(F)(F)C1 ZINC000514213051 387272147 /nfs/dbraw/zinc/27/21/47/387272147.db2.gz CNEWJWLWCYYHGB-GFCCVEGCSA-N 1 1 231.330 3.544 20 0 BHADMO CC[N@@H+](CC1CC1)C[C@H]1CCCC(F)(F)C1 ZINC000514213052 387271838 /nfs/dbraw/zinc/27/18/38/387271838.db2.gz CNEWJWLWCYYHGB-LBPRGKRZSA-N 1 1 231.330 3.544 20 0 BHADMO C[C@@H]1CCCC[N@@H+](C[C@@H]2CCCC(F)(F)C2)C1 ZINC000514220808 324109467 /nfs/dbraw/zinc/10/94/67/324109467.db2.gz BUJFWOKQYFWYSK-CHWSQXEVSA-N 1 1 245.357 3.934 20 0 BHADMO C[C@@H]1CCCC[N@@H+](C[C@H]2CCCC(F)(F)C2)C1 ZINC000514220809 324109277 /nfs/dbraw/zinc/10/92/77/324109277.db2.gz BUJFWOKQYFWYSK-OLZOCXBDSA-N 1 1 245.357 3.934 20 0 BHADMO C[C@H]1CCCC[N@@H+](C[C@@H]2CCCC(F)(F)C2)C1 ZINC000514220810 324109404 /nfs/dbraw/zinc/10/94/04/324109404.db2.gz BUJFWOKQYFWYSK-QWHCGFSZSA-N 1 1 245.357 3.934 20 0 BHADMO C[C@H]1CCCC[N@@H+](C[C@H]2CCCC(F)(F)C2)C1 ZINC000514220811 324109227 /nfs/dbraw/zinc/10/92/27/324109227.db2.gz BUJFWOKQYFWYSK-STQMWFEESA-N 1 1 245.357 3.934 20 0 BHADMO CC(C)SCC[N@H+]1C[C@H](C)[C@H]2CCCC[C@H]21 ZINC000514244634 387271564 /nfs/dbraw/zinc/27/15/64/387271564.db2.gz LJROJJZTVILGFD-BFHYXJOUSA-N 1 1 241.444 3.639 20 0 BHADMO CC(C)SCC[N@H+]1C[C@H](C)[C@@H]2CCCC[C@@H]21 ZINC000514244635 387271610 /nfs/dbraw/zinc/27/16/10/387271610.db2.gz LJROJJZTVILGFD-IHRRRGAJSA-N 1 1 241.444 3.639 20 0 BHADMO CC(C)SCC[N@H+]1C[C@H](C)[C@@H]2CCCC[C@H]21 ZINC000514244636 387271917 /nfs/dbraw/zinc/27/19/17/387271917.db2.gz LJROJJZTVILGFD-MELADBBJSA-N 1 1 241.444 3.639 20 0 BHADMO CC(C)SCC[N@H+]1C[C@H](C)[C@H]2CCCC[C@@H]21 ZINC000514244637 387271791 /nfs/dbraw/zinc/27/17/91/387271791.db2.gz LJROJJZTVILGFD-MJBXVCDLSA-N 1 1 241.444 3.639 20 0 BHADMO C[C@@H]1C[C@H](C)C[N@H+](C/C=C\c2ccccc2)C1 ZINC000514517727 386441334 /nfs/dbraw/zinc/44/13/34/386441334.db2.gz ZCIKVXANNUXWRW-VUEDLFODSA-N 1 1 229.367 3.678 20 0 BHADMO C[N@@H+](CCC1CCCCCC1)Cc1ccccn1 ZINC000514619308 323326375 /nfs/dbraw/zinc/32/63/75/323326375.db2.gz USKYVBHHIITAAN-UHFFFAOYSA-N 1 1 246.398 3.874 20 0 BHADMO C[C@@H]([N@@H+](C)CCc1ccccc1F)C(C)(C)C ZINC000514642163 387025376 /nfs/dbraw/zinc/02/53/76/387025376.db2.gz SYIIRLVFVZVSSP-GFCCVEGCSA-N 1 1 237.362 3.735 20 0 BHADMO C[C@H]([N@@H+](C)CCc1ccccc1F)C(C)(C)C ZINC000514642164 387024402 /nfs/dbraw/zinc/02/44/02/387024402.db2.gz SYIIRLVFVZVSSP-LBPRGKRZSA-N 1 1 237.362 3.735 20 0 BHADMO CC(C)=CC[N@H+](C)Cc1ccc(Cl)cc1 ZINC000514736067 387282004 /nfs/dbraw/zinc/28/20/04/387282004.db2.gz BHBFPUAEXYGDCR-UHFFFAOYSA-N 1 1 223.747 3.738 20 0 BHADMO CC[C@@H](c1ccccc1)[N@H+]1Cc2cccnc2C1 ZINC000514741192 387285038 /nfs/dbraw/zinc/28/50/38/387285038.db2.gz AKNWBLJWSNAUSO-INIZCTEOSA-N 1 1 238.334 3.549 20 0 BHADMO CC[C@@H](c1ccccc1)[N@@H+]1Cc2cccnc2C1 ZINC000514741192 387285035 /nfs/dbraw/zinc/28/50/35/387285035.db2.gz AKNWBLJWSNAUSO-INIZCTEOSA-N 1 1 238.334 3.549 20 0 BHADMO CC[C@H](c1ccccc1)[N@H+]1Cc2cccnc2C1 ZINC000514741196 387283761 /nfs/dbraw/zinc/28/37/61/387283761.db2.gz AKNWBLJWSNAUSO-MRXNPFEDSA-N 1 1 238.334 3.549 20 0 BHADMO CC[C@H](c1ccccc1)[N@@H+]1Cc2cccnc2C1 ZINC000514741196 387283756 /nfs/dbraw/zinc/28/37/56/387283756.db2.gz AKNWBLJWSNAUSO-MRXNPFEDSA-N 1 1 238.334 3.549 20 0 BHADMO CC(C)C[N@@H+](C)[C@H]1CCCc2ccccc21 ZINC000514745079 387284847 /nfs/dbraw/zinc/28/48/47/387284847.db2.gz TVGXXMGOPRHNQJ-HNNXBMFYSA-N 1 1 217.356 3.652 20 0 BHADMO CC(C)C[N@@H+](C)[C@@H]1CCCc2ccccc21 ZINC000514745080 387283712 /nfs/dbraw/zinc/28/37/12/387283712.db2.gz TVGXXMGOPRHNQJ-OAHLLOKOSA-N 1 1 217.356 3.652 20 0 BHADMO CC(C)C[N@@H+](C)Cc1c(F)cccc1Cl ZINC000514745202 387284647 /nfs/dbraw/zinc/28/46/47/387284647.db2.gz ZZGVXTLKXDXOLV-UHFFFAOYSA-N 1 1 229.726 3.567 20 0 BHADMO Cc1ccc(C)c(C[N@H+](C)CC2(C)CC2)c1 ZINC000514769671 324111878 /nfs/dbraw/zinc/11/18/78/324111878.db2.gz UEBXIVJQJQUHJR-UHFFFAOYSA-N 1 1 217.356 3.535 20 0 BHADMO CCC[C@@H](C)C[N@@H+](C)C1CCC(F)(F)CC1 ZINC000514786270 262913146 /nfs/dbraw/zinc/91/31/46/262913146.db2.gz USZILBYFGGNCQQ-LLVKDONJSA-N 1 1 233.346 3.932 20 0 BHADMO CCC[C@H](C)C[N@@H+](C)C1CCC(F)(F)CC1 ZINC000514786271 262913215 /nfs/dbraw/zinc/91/32/15/262913215.db2.gz USZILBYFGGNCQQ-NSHDSACASA-N 1 1 233.346 3.932 20 0 BHADMO CCC[C@H](C)[N@@H+](C)Cc1cc(C)ccc1C ZINC000514787845 387288461 /nfs/dbraw/zinc/28/84/61/387288461.db2.gz FTWUKGBIVAUYCH-AWEZNQCLSA-N 1 1 219.372 3.924 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)Cc1cc(C)ccc1C ZINC000514787851 387288367 /nfs/dbraw/zinc/28/83/67/387288367.db2.gz FTWUKGBIVAUYCH-CQSZACIVSA-N 1 1 219.372 3.924 20 0 BHADMO CC[N@@H+](CCCCCF)Cc1cccc(F)c1 ZINC000514795047 387292126 /nfs/dbraw/zinc/29/21/26/387292126.db2.gz OGTYSZJNJAWEDZ-UHFFFAOYSA-N 1 1 241.325 3.787 20 0 BHADMO CCC(CC)[N@@H+](CC)CCCc1cnccc1C ZINC000514817936 387290603 /nfs/dbraw/zinc/29/06/03/387290603.db2.gz NXNMZTWDXXTZHG-UHFFFAOYSA-N 1 1 248.414 3.833 20 0 BHADMO C[C@@H](C[N@@H+]1[C@H](C)C[C@@H]1C)c1cc(F)cc(F)c1 ZINC000514839702 387300390 /nfs/dbraw/zinc/30/03/90/387300390.db2.gz DPOZKCZQGNHJGT-GARJFASQSA-N 1 1 239.309 3.551 20 0 BHADMO C[C@H](C[N@@H+]1[C@H](C)C[C@@H]1C)c1cc(F)cc(F)c1 ZINC000514839704 387299780 /nfs/dbraw/zinc/29/97/80/387299780.db2.gz DPOZKCZQGNHJGT-MXWKQRLJSA-N 1 1 239.309 3.551 20 0 BHADMO CCCC[N@@H+](C)Cc1cc(-c2ccccc2)on1 ZINC000514849635 387295587 /nfs/dbraw/zinc/29/55/87/387295587.db2.gz PZILILKRZPMJIZ-UHFFFAOYSA-N 1 1 244.338 3.574 20 0 BHADMO Cc1cc(C)cc(C[N@@H+](C)CCCCCF)c1 ZINC000514850791 387298378 /nfs/dbraw/zinc/29/83/78/387298378.db2.gz ISGUWBVWUTXDSF-UHFFFAOYSA-N 1 1 237.362 3.875 20 0 BHADMO CCc1ccc(CC[N@@H+](C)[C@H](C)C2CC2)cc1 ZINC000514885664 256723983 /nfs/dbraw/zinc/72/39/83/256723983.db2.gz VQWSTEBGVSQNPV-CYBMUJFWSA-N 1 1 231.383 3.522 20 0 BHADMO CCc1ccc(CC[N@@H+](C)[C@@H](C)C2CC2)cc1 ZINC000514885665 387304300 /nfs/dbraw/zinc/30/43/00/387304300.db2.gz VQWSTEBGVSQNPV-ZDUSSCGKSA-N 1 1 231.383 3.522 20 0 BHADMO CCCC[C@@H](C)[N@@H+](C)Cc1ccccc1 ZINC000514894737 387303614 /nfs/dbraw/zinc/30/36/14/387303614.db2.gz VBQUWWXIVSMDQN-CYBMUJFWSA-N 1 1 205.345 3.697 20 0 BHADMO CCCC[C@H](C)[N@@H+](C)Cc1ccccc1 ZINC000514894747 387304598 /nfs/dbraw/zinc/30/45/98/387304598.db2.gz VBQUWWXIVSMDQN-ZDUSSCGKSA-N 1 1 205.345 3.697 20 0 BHADMO CCc1ccc(C[N@@H+]2CCC[C@H](CC)CC2)nc1 ZINC000514923228 387307780 /nfs/dbraw/zinc/30/77/80/387307780.db2.gz ZZDXJIASXBGKNW-AWEZNQCLSA-N 1 1 246.398 3.656 20 0 BHADMO CCc1ccc(C[N@@H+]2CCC[C@@H](CC)CC2)nc1 ZINC000514923229 387308609 /nfs/dbraw/zinc/30/86/09/387308609.db2.gz ZZDXJIASXBGKNW-CQSZACIVSA-N 1 1 246.398 3.656 20 0 BHADMO CCC[C@H](C)[N@@H+](C)Cc1cc(C)cc(C)c1 ZINC000515041488 387333491 /nfs/dbraw/zinc/33/34/91/387333491.db2.gz DWXSBRYMKUZIIS-AWEZNQCLSA-N 1 1 219.372 3.924 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)Cc1cc(C)cc(C)c1 ZINC000515041494 387334548 /nfs/dbraw/zinc/33/45/48/387334548.db2.gz DWXSBRYMKUZIIS-CQSZACIVSA-N 1 1 219.372 3.924 20 0 BHADMO C[C@@H]1C[C@@H]1C[N@H+]1CC[C@@H]1c1ccc(Cl)cc1 ZINC000515093201 387336917 /nfs/dbraw/zinc/33/69/17/387336917.db2.gz FUIMMUURCWCYAK-MPKXVKKWSA-N 1 1 235.758 3.743 20 0 BHADMO C[C@@H]1C[C@H]1C[N@H+]1CC[C@H]1c1ccc(Cl)cc1 ZINC000515093202 387335840 /nfs/dbraw/zinc/33/58/40/387335840.db2.gz FUIMMUURCWCYAK-OSMZGAPFSA-N 1 1 235.758 3.743 20 0 BHADMO C[C@@H]1C[C@@H]1C[N@H+]1CC[C@H]1c1ccc(Cl)cc1 ZINC000515093203 387335479 /nfs/dbraw/zinc/33/54/79/387335479.db2.gz FUIMMUURCWCYAK-QKCSRTOESA-N 1 1 235.758 3.743 20 0 BHADMO C[C@@H]1C[C@H]1C[N@H+]1CC[C@@H]1c1ccc(Cl)cc1 ZINC000515093204 387335313 /nfs/dbraw/zinc/33/53/13/387335313.db2.gz FUIMMUURCWCYAK-SCDSUCTJSA-N 1 1 235.758 3.743 20 0 BHADMO CCCC[N@@H+](Cc1cccc(C)c1)C1CC1 ZINC000515123718 387338659 /nfs/dbraw/zinc/33/86/59/387338659.db2.gz KTEQOLQPKBFQBN-UHFFFAOYSA-N 1 1 217.356 3.760 20 0 BHADMO CCCC[N@@H+](C/C=C\c1ccccc1)C1CC1 ZINC000515123757 387338537 /nfs/dbraw/zinc/33/85/37/387338537.db2.gz PSFOIWGVISPLFL-YFHOEESVSA-N 1 1 229.367 3.964 20 0 BHADMO Cc1ccsc1C[N@@H+](C)CC1CCCC1 ZINC000515134762 387339157 /nfs/dbraw/zinc/33/91/57/387339157.db2.gz BJHPHGWIUAZLCI-UHFFFAOYSA-N 1 1 223.385 3.679 20 0 BHADMO C[N@@H+](CC1CCCC1)[C@H]1CCc2ccccc21 ZINC000515134882 387339296 /nfs/dbraw/zinc/33/92/96/387339296.db2.gz LSMGLZOKCPWPIH-INIZCTEOSA-N 1 1 229.367 3.796 20 0 BHADMO C[N@@H+](CC1CCCC1)[C@@H]1CCc2ccccc21 ZINC000515134884 387337577 /nfs/dbraw/zinc/33/75/77/387337577.db2.gz LSMGLZOKCPWPIH-MRXNPFEDSA-N 1 1 229.367 3.796 20 0 BHADMO CCC[N@@H+](C)Cc1c2ccccc2oc1CC ZINC000515135889 387339114 /nfs/dbraw/zinc/33/91/14/387339114.db2.gz ZBBHQIONDJMITB-UHFFFAOYSA-N 1 1 231.339 3.837 20 0 BHADMO CC[N@@H+](CCC(C)C)Cc1ccccc1C ZINC000515193954 387347599 /nfs/dbraw/zinc/34/75/99/387347599.db2.gz NLJVPSXSOBDBEG-UHFFFAOYSA-N 1 1 219.372 3.863 20 0 BHADMO C[N@@H+](CCCF)Cc1ccc(C(C)(C)C)cc1 ZINC000515194773 387348148 /nfs/dbraw/zinc/34/81/48/387348148.db2.gz FYURVZPMWJAZJN-UHFFFAOYSA-N 1 1 237.362 3.776 20 0 BHADMO CCCC[N@@H+](Cc1cocn1)C1CCCCC1 ZINC000515239802 387352939 /nfs/dbraw/zinc/35/29/39/387352939.db2.gz UFZHTQLLRQWGII-UHFFFAOYSA-N 1 1 236.359 3.609 20 0 BHADMO C[N@@H+](CCC1CC1)[C@H]1CC[C@@H](C(F)(F)F)CC1 ZINC000515250353 387352647 /nfs/dbraw/zinc/35/26/47/387352647.db2.gz UKCOKDSMEBYQHB-TXEJJXNPSA-N 1 1 249.320 3.839 20 0 BHADMO Cc1cccc(C[N@H+](C)[C@@H]2CC[C@H](C)C2)c1 ZINC000515289613 387356316 /nfs/dbraw/zinc/35/63/16/387356316.db2.gz VMWCUZRYJKKWMK-DZGCQCFKSA-N 1 1 217.356 3.615 20 0 BHADMO Cc1cccc(C[N@H+](C)[C@H]2CC[C@@H](C)C2)c1 ZINC000515289614 387356740 /nfs/dbraw/zinc/35/67/40/387356740.db2.gz VMWCUZRYJKKWMK-HIFRSBDPSA-N 1 1 217.356 3.615 20 0 BHADMO Cc1cccc(C[N@H+](C)[C@@H]2CC[C@@H](C)C2)c1 ZINC000515289615 387355749 /nfs/dbraw/zinc/35/57/49/387355749.db2.gz VMWCUZRYJKKWMK-UKRRQHHQSA-N 1 1 217.356 3.615 20 0 BHADMO Cc1cccc(C[N@H+](C)[C@H]2CC[C@H](C)C2)c1 ZINC000515289616 387356898 /nfs/dbraw/zinc/35/68/98/387356898.db2.gz VMWCUZRYJKKWMK-ZFWWWQNUSA-N 1 1 217.356 3.615 20 0 BHADMO CCC[C@H]1CCCC[N@H+]1CCc1ccncc1C ZINC000515349254 387368487 /nfs/dbraw/zinc/36/84/87/387368487.db2.gz CRODVCXWBTVXLW-INIZCTEOSA-N 1 1 246.398 3.587 20 0 BHADMO CCC[C@@H]1CCCC[N@H+]1CCc1ccncc1C ZINC000515349255 387367594 /nfs/dbraw/zinc/36/75/94/387367594.db2.gz CRODVCXWBTVXLW-MRXNPFEDSA-N 1 1 246.398 3.587 20 0 BHADMO C[N@@H+](Cc1csc(C(C)(C)C)n1)C(C)(C)C ZINC000515380856 387373880 /nfs/dbraw/zinc/37/38/80/387373880.db2.gz LWRYBDLOQVKDBM-UHFFFAOYSA-N 1 1 240.416 3.671 20 0 BHADMO CC[N@@H+](Cc1ccccc1OCC(C)C)C(C)C ZINC000515389343 387376310 /nfs/dbraw/zinc/37/63/10/387376310.db2.gz BIXGDSYFUAGJGT-UHFFFAOYSA-N 1 1 249.398 3.952 20 0 BHADMO CC(C)C[C@@H](C)[N@H+]1CCc2ccc(F)cc2C1 ZINC000515443807 411275344 /nfs/dbraw/zinc/27/53/44/411275344.db2.gz PVMASPKGQFJMNQ-GFCCVEGCSA-N 1 1 235.346 3.618 20 0 BHADMO CC(C)C[C@H](C)[N@H+]1CCc2ccc(F)cc2C1 ZINC000515443808 411275222 /nfs/dbraw/zinc/27/52/22/411275222.db2.gz PVMASPKGQFJMNQ-LBPRGKRZSA-N 1 1 235.346 3.618 20 0 BHADMO CC[C@H](C)[N@@H+](CC)Cc1c(F)cccc1F ZINC000515475002 387383844 /nfs/dbraw/zinc/38/38/44/387383844.db2.gz CZVVKGPCVRKFLV-JTQLQIEISA-N 1 1 227.298 3.585 20 0 BHADMO CC[C@@H](C)[N@@H+](CC)Cc1c(F)cccc1F ZINC000515475003 387383164 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225.763 3.818 20 0 BHADMO CC(C)C[N@@H+](CC1CCCCC1)C1CC1 ZINC000515548042 387395417 /nfs/dbraw/zinc/39/54/17/387395417.db2.gz DTHFIJWKQMFLDP-UHFFFAOYSA-N 1 1 209.377 3.687 20 0 BHADMO CC(C)=CC[N@@H+]1CC[C@H](C)[C@@H]2CCCC[C@@H]21 ZINC000515548309 387395919 /nfs/dbraw/zinc/39/59/19/387395919.db2.gz QAQXBHMIABRSCR-KKUMJFAQSA-N 1 1 221.388 3.853 20 0 BHADMO CC(C)=CC[N@@H+]1CC[C@H](C)[C@H]2CCCC[C@H]21 ZINC000515548310 387395371 /nfs/dbraw/zinc/39/53/71/387395371.db2.gz QAQXBHMIABRSCR-RRFJBIMHSA-N 1 1 221.388 3.853 20 0 BHADMO CC(C)=CC[N@@H+]1CC[C@H](C)[C@@H]2CCCC[C@H]21 ZINC000515548311 387395156 /nfs/dbraw/zinc/39/51/56/387395156.db2.gz QAQXBHMIABRSCR-SOUVJXGZSA-N 1 1 221.388 3.853 20 0 BHADMO CC(C)=CC[N@@H+]1CC[C@H](C)[C@H]2CCCC[C@@H]21 ZINC000515548312 387395508 /nfs/dbraw/zinc/39/55/08/387395508.db2.gz QAQXBHMIABRSCR-ZNMIVQPWSA-N 1 1 221.388 3.853 20 0 BHADMO CC[N@H+](Cc1c(F)cccc1Cl)CC(C)C ZINC000515548677 387395979 /nfs/dbraw/zinc/39/59/79/387395979.db2.gz VCYJFWALXKKYPW-UHFFFAOYSA-N 1 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CC[C@@H]1CCCCC[N@H+]1CC1(SC)CC1 ZINC000515710517 387417290 /nfs/dbraw/zinc/41/72/90/387417290.db2.gz PBIVARYBGNOKCB-GFCCVEGCSA-N 1 1 227.417 3.537 20 0 BHADMO CC[C@H]1CCCCC[N@H+]1CC1(SC)CC1 ZINC000515710518 387418048 /nfs/dbraw/zinc/41/80/48/387418048.db2.gz PBIVARYBGNOKCB-LBPRGKRZSA-N 1 1 227.417 3.537 20 0 BHADMO Fc1ccccc1C[N@H+]1CCC[C@H]1C1CCCC1 ZINC000515743694 387419333 /nfs/dbraw/zinc/41/93/33/387419333.db2.gz YVPNHKFWLNDXEO-INIZCTEOSA-N 1 1 247.357 3.980 20 0 BHADMO Fc1ccccc1C[N@H+]1CCC[C@@H]1C1CCCC1 ZINC000515743695 387419996 /nfs/dbraw/zinc/41/99/96/387419996.db2.gz YVPNHKFWLNDXEO-MRXNPFEDSA-N 1 1 247.357 3.980 20 0 BHADMO Cc1ccc([C@H](C)[N@H+](C)CC(C)C)c(C)c1 ZINC000515770437 387423303 /nfs/dbraw/zinc/42/33/03/387423303.db2.gz XKMAHADJLQTQNG-AWEZNQCLSA-N 1 1 219.372 3.952 20 0 BHADMO Cc1ccc([C@@H](C)[N@H+](C)CC(C)C)c(C)c1 ZINC000515770438 387423287 /nfs/dbraw/zinc/42/32/87/387423287.db2.gz XKMAHADJLQTQNG-CQSZACIVSA-N 1 1 219.372 3.952 20 0 BHADMO Cc1ccccc1[C@@H](C)[N@H+](C)CC(C)C ZINC000515770543 387423295 /nfs/dbraw/zinc/42/32/95/387423295.db2.gz IHFAEZHARCCEKQ-CYBMUJFWSA-N 1 1 205.345 3.644 20 0 BHADMO Cc1ccccc1[C@H](C)[N@H+](C)CC(C)C ZINC000515770544 387423788 /nfs/dbraw/zinc/42/37/88/387423788.db2.gz IHFAEZHARCCEKQ-ZDUSSCGKSA-N 1 1 205.345 3.644 20 0 BHADMO CCC[N@@H+](C)[C@H](C)c1ccc(C)cc1C ZINC000515771171 387422672 /nfs/dbraw/zinc/42/26/72/387422672.db2.gz KXSQRDFEZVMWHM-CYBMUJFWSA-N 1 1 205.345 3.706 20 0 BHADMO CCC[N@@H+](C)[C@@H](C)c1ccc(C)cc1C ZINC000515771172 387423451 /nfs/dbraw/zinc/42/34/51/387423451.db2.gz KXSQRDFEZVMWHM-ZDUSSCGKSA-N 1 1 205.345 3.706 20 0 BHADMO CC(C)CCOCC[N@@H+](C)CC1CCCCC1 ZINC000515781055 398212548 /nfs/dbraw/zinc/21/25/48/398212548.db2.gz CHHSJMIDWOBCMD-UHFFFAOYSA-N 1 1 241.419 3.561 20 0 BHADMO CCCCOCC[N@@H+](CCC)Cc1ccccc1 ZINC000515781610 398212537 /nfs/dbraw/zinc/21/25/37/398212537.db2.gz KSYVWCMVFKIDBM-UHFFFAOYSA-N 1 1 249.398 3.715 20 0 BHADMO CCC[N@H+](Cc1ccc(F)cc1F)CC(C)C 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C[N@@H+](Cc1ccc(F)c(Cl)c1)CC1(C)CC1 ZINC000516946404 388527645 /nfs/dbraw/zinc/52/76/45/388527645.db2.gz TYUYHSZITNALBT-UHFFFAOYSA-N 1 1 241.737 3.711 20 0 BHADMO Cc1cnccc1CC[N@H+](C(C)C)C1CCCC1 ZINC000516966876 388528613 /nfs/dbraw/zinc/52/86/13/388528613.db2.gz DWCDMWNCJHMMBL-UHFFFAOYSA-N 1 1 246.398 3.586 20 0 BHADMO Cc1ccnc([C@H]2CC[N@H+](CCCC(C)C)C2)c1 ZINC000516978078 388529821 /nfs/dbraw/zinc/52/98/21/388529821.db2.gz AHGUZXMGFUXSPB-HNNXBMFYSA-N 1 1 246.398 3.616 20 0 BHADMO Cc1ccnc([C@@H]2CC[N@H+](CCCC(C)C)C2)c1 ZINC000516978079 388529865 /nfs/dbraw/zinc/52/98/65/388529865.db2.gz AHGUZXMGFUXSPB-OAHLLOKOSA-N 1 1 246.398 3.616 20 0 BHADMO CC[C@@H]1CC[C@H](C)[N@H+]1Cc1ccsc1 ZINC000516997323 388530980 /nfs/dbraw/zinc/53/09/80/388530980.db2.gz DVZMOUCXPCLYMH-CMPLNLGQSA-N 1 1 209.358 3.511 20 0 BHADMO CC[C@H]1CC[C@H](C)[N@H+]1Cc1ccsc1 ZINC000516997326 388530963 /nfs/dbraw/zinc/53/09/63/388530963.db2.gz DVZMOUCXPCLYMH-JQWIXIFHSA-N 1 1 209.358 3.511 20 0 BHADMO CC[C@H]1CC[C@@H](C)[N@H+]1Cc1ccsc1 ZINC000516997327 388530896 /nfs/dbraw/zinc/53/08/96/388530896.db2.gz DVZMOUCXPCLYMH-PWSUYJOCSA-N 1 1 209.358 3.511 20 0 BHADMO CC[C@@H]1CC[C@@H](C)[N@H+]1Cc1ccsc1 ZINC000516997329 388530878 /nfs/dbraw/zinc/53/08/78/388530878.db2.gz DVZMOUCXPCLYMH-ZYHUDNBSSA-N 1 1 209.358 3.511 20 0 BHADMO CSc1ccc(C[N@H+]2CCCC[C@@H]2C)s1 ZINC000517001722 388530860 /nfs/dbraw/zinc/53/08/60/388530860.db2.gz QOAMZEHHUFPVED-JTQLQIEISA-N 1 1 241.425 3.844 20 0 BHADMO CSc1ccc(C[N@H+]2CCCC[C@H]2C)s1 ZINC000517001723 388530970 /nfs/dbraw/zinc/53/09/70/388530970.db2.gz QOAMZEHHUFPVED-SNVBAGLBSA-N 1 1 241.425 3.844 20 0 BHADMO C[N@@H+](CC1(F)CC1)[C@H]1CCC[C@@H]1c1ccccc1 ZINC000517015906 388532174 /nfs/dbraw/zinc/53/21/74/388532174.db2.gz SDDCQISANNNQQF-CABCVRRESA-N 1 1 247.357 3.757 20 0 BHADMO C[N@@H+](CC1(F)CC1)[C@H]1CCC[C@H]1c1ccccc1 ZINC000517015907 388531889 /nfs/dbraw/zinc/53/18/89/388531889.db2.gz SDDCQISANNNQQF-GJZGRUSLSA-N 1 1 247.357 3.757 20 0 BHADMO C[N@@H+](CC1(F)CC1)[C@@H]1CCC[C@@H]1c1ccccc1 ZINC000517015908 388532738 /nfs/dbraw/zinc/53/27/38/388532738.db2.gz SDDCQISANNNQQF-HUUCEWRRSA-N 1 1 247.357 3.757 20 0 BHADMO C[N@@H+](CC1(F)CC1)[C@@H]1CCC[C@H]1c1ccccc1 ZINC000517015909 388532723 /nfs/dbraw/zinc/53/27/23/388532723.db2.gz SDDCQISANNNQQF-LSDHHAIUSA-N 1 1 247.357 3.757 20 0 BHADMO CCC[N@@H+](C(C)C)[C@H](C)Cc1ccsc1 ZINC000517041401 388535635 /nfs/dbraw/zinc/53/56/35/388535635.db2.gz QGMSJQQXBOQWJZ-GFCCVEGCSA-N 1 1 225.401 3.800 20 0 BHADMO CCC[N@@H+](C(C)C)[C@@H](C)Cc1ccsc1 ZINC000517041402 388535714 /nfs/dbraw/zinc/53/57/14/388535714.db2.gz QGMSJQQXBOQWJZ-LBPRGKRZSA-N 1 1 225.401 3.800 20 0 BHADMO CCCC[C@@H](C)[N@@H+](CCCC)C[C@@H]1CCOC1 ZINC000517044040 388536046 /nfs/dbraw/zinc/53/60/46/388536046.db2.gz HNAALPSRQCEYOV-CABCVRRESA-N 1 1 241.419 3.704 20 0 BHADMO CCCC[C@H](C)[N@@H+](CCCC)C[C@@H]1CCOC1 ZINC000517044041 388536397 /nfs/dbraw/zinc/53/63/97/388536397.db2.gz HNAALPSRQCEYOV-GJZGRUSLSA-N 1 1 241.419 3.704 20 0 BHADMO CCCC[C@@H](C)[N@@H+](CCCC)C[C@H]1CCOC1 ZINC000517044042 388535560 /nfs/dbraw/zinc/53/55/60/388535560.db2.gz HNAALPSRQCEYOV-HUUCEWRRSA-N 1 1 241.419 3.704 20 0 BHADMO CCCC[C@H](C)[N@@H+](CCCC)C[C@H]1CCOC1 ZINC000517044043 388536027 /nfs/dbraw/zinc/53/60/27/388536027.db2.gz HNAALPSRQCEYOV-LSDHHAIUSA-N 1 1 241.419 3.704 20 0 BHADMO c1nc(C2CC2)sc1C[N@H+]1CCCC12CCC2 ZINC000517070133 388537708 /nfs/dbraw/zinc/53/77/08/388537708.db2.gz NROPQYBYRIPJHR-UHFFFAOYSA-N 1 1 248.395 3.539 20 0 BHADMO CC[N@@H+](CCc1ccccc1Cl)C(C)C ZINC000517093730 388538672 /nfs/dbraw/zinc/53/86/72/388538672.db2.gz ZRBIEGXMHQGJPM-UHFFFAOYSA-N 1 1 225.763 3.613 20 0 BHADMO CCCCOCC[N@@H+]([C@@H](C)[C@@H](C)CC)C1CC1 ZINC000517122689 388538878 /nfs/dbraw/zinc/53/88/78/388538878.db2.gz YYMNXQWETDDWSM-KBPBESRZSA-N 1 1 241.419 3.702 20 0 BHADMO CCCCOCC[N@@H+]([C@@H](C)[C@H](C)CC)C1CC1 ZINC000517122691 388538094 /nfs/dbraw/zinc/53/80/94/388538094.db2.gz YYMNXQWETDDWSM-KGLIPLIRSA-N 1 1 241.419 3.702 20 0 BHADMO CCCCOCC[N@@H+]([C@H](C)[C@@H](C)CC)C1CC1 ZINC000517122692 388538270 /nfs/dbraw/zinc/53/82/70/388538270.db2.gz YYMNXQWETDDWSM-UONOGXRCSA-N 1 1 241.419 3.702 20 0 BHADMO CCCCOCC[N@@H+]([C@H](C)[C@H](C)CC)C1CC1 ZINC000517122693 256815657 /nfs/dbraw/zinc/81/56/57/256815657.db2.gz YYMNXQWETDDWSM-ZIAGYGMSSA-N 1 1 241.419 3.702 20 0 BHADMO CCC(CC)[N@@H+](Cc1cnc(C)s1)C1CC1 ZINC000517124333 388538083 /nfs/dbraw/zinc/53/80/83/388538083.db2.gz CHFSJISXLBOHBA-UHFFFAOYSA-N 1 1 238.400 3.605 20 0 BHADMO C[N@@H+](C/C=C/c1ccc(F)c(F)c1)C(C)(C)C ZINC000517148504 388539206 /nfs/dbraw/zinc/53/92/06/388539206.db2.gz HDEGBLQBQORNIX-AATRIKPKSA-N 1 1 239.309 3.708 20 0 BHADMO C[N@@H+](C/C=C\c1ccc(F)c(F)c1)C(C)(C)C ZINC000517148512 388539658 /nfs/dbraw/zinc/53/96/58/388539658.db2.gz HDEGBLQBQORNIX-WAYWQWQTSA-N 1 1 239.309 3.708 20 0 BHADMO Cc1ccnc([C@H]2CC[N@@H+](CCC(C)(C)C)C2)c1 ZINC000517172651 388540822 /nfs/dbraw/zinc/54/08/22/388540822.db2.gz ZQXCNIDJDCCSIM-AWEZNQCLSA-N 1 1 246.398 3.616 20 0 BHADMO Cc1ccnc([C@@H]2CC[N@@H+](CCC(C)(C)C)C2)c1 ZINC000517172652 388541149 /nfs/dbraw/zinc/54/11/49/388541149.db2.gz ZQXCNIDJDCCSIM-CQSZACIVSA-N 1 1 246.398 3.616 20 0 BHADMO Cc1nc2ccc(C[N@H+](C)C(C)(C)C)cc2s1 ZINC000517236588 388544994 /nfs/dbraw/zinc/54/49/94/388544994.db2.gz CWOPBZQYIMJZTL-UHFFFAOYSA-N 1 1 248.395 3.835 20 0 BHADMO Cc1nc(C(C)C)ccc1C[N@H+]1C[C@H](C)C[C@H]1C ZINC000517248952 388545680 /nfs/dbraw/zinc/54/56/80/388545680.db2.gz IRQRXDVQTKBJDG-CHWSQXEVSA-N 1 1 246.398 3.744 20 0 BHADMO Cc1nc(C(C)C)ccc1C[N@H+]1C[C@H](C)C[C@@H]1C ZINC000517248953 388546018 /nfs/dbraw/zinc/54/60/18/388546018.db2.gz IRQRXDVQTKBJDG-OLZOCXBDSA-N 1 1 246.398 3.744 20 0 BHADMO Cc1nc(C(C)C)ccc1C[N@H+]1C[C@@H](C)C[C@H]1C ZINC000517248954 388545860 /nfs/dbraw/zinc/54/58/60/388545860.db2.gz IRQRXDVQTKBJDG-QWHCGFSZSA-N 1 1 246.398 3.744 20 0 BHADMO Cc1nc(C(C)C)ccc1C[N@H+]1C[C@@H](C)C[C@@H]1C ZINC000517248955 388545971 /nfs/dbraw/zinc/54/59/71/388545971.db2.gz IRQRXDVQTKBJDG-STQMWFEESA-N 1 1 246.398 3.744 20 0 BHADMO CCC(CC)C[N@@H+](CC)[C@H]1CCOC(C)(C)C1 ZINC000517268069 256821808 /nfs/dbraw/zinc/82/18/08/256821808.db2.gz WCLOTPRJELWPGQ-AWEZNQCLSA-N 1 1 241.419 3.702 20 0 BHADMO CCC(CC)C[N@@H+](CC)[C@@H]1CCOC(C)(C)C1 ZINC000517268070 388545743 /nfs/dbraw/zinc/54/57/43/388545743.db2.gz WCLOTPRJELWPGQ-CQSZACIVSA-N 1 1 241.419 3.702 20 0 BHADMO C[C@H](C[N@@H+](C)CC1(C)CC1)c1ccccc1 ZINC000517271698 388546182 /nfs/dbraw/zinc/54/61/82/388546182.db2.gz KPAYVJOBZGFGKB-CYBMUJFWSA-N 1 1 217.356 3.522 20 0 BHADMO C[C@@H](C[N@@H+](C)CC1(C)CC1)c1ccccc1 ZINC000517271706 388546207 /nfs/dbraw/zinc/54/62/07/388546207.db2.gz KPAYVJOBZGFGKB-ZDUSSCGKSA-N 1 1 217.356 3.522 20 0 BHADMO CCCC[N@H+]1CCC[C@@H](Cc2ccccc2)C1 ZINC000517323934 388546593 /nfs/dbraw/zinc/54/65/93/388546593.db2.gz DKGRZYNLLQMDGH-INIZCTEOSA-N 1 1 231.383 3.741 20 0 BHADMO CCCC[N@H+]1CCC[C@H](Cc2ccccc2)C1 ZINC000517323935 388546542 /nfs/dbraw/zinc/54/65/42/388546542.db2.gz DKGRZYNLLQMDGH-MRXNPFEDSA-N 1 1 231.383 3.741 20 0 BHADMO C[N@@H+](CC1(C)CC1)[C@H]1CCCc2ccccc21 ZINC000517473861 388550901 /nfs/dbraw/zinc/55/09/01/388550901.db2.gz AGVGYYQFSARULV-HNNXBMFYSA-N 1 1 229.367 3.796 20 0 BHADMO C[N@@H+](CC1(C)CC1)[C@@H]1CCCc2ccccc21 ZINC000517473862 388551214 /nfs/dbraw/zinc/55/12/14/388551214.db2.gz AGVGYYQFSARULV-OAHLLOKOSA-N 1 1 229.367 3.796 20 0 BHADMO CC(C)[C@H]([NH2+]c1ccc2c(c1)CCN2)C1CC1 ZINC000517553776 388553543 /nfs/dbraw/zinc/55/35/43/388553543.db2.gz VSZAGAUVCXXUPL-HNNXBMFYSA-N 1 1 230.355 3.501 20 0 BHADMO CC(C)[C@@H]([NH2+]c1ccc2c(c1)CCN2)C1CC1 ZINC000517553777 388553758 /nfs/dbraw/zinc/55/37/58/388553758.db2.gz VSZAGAUVCXXUPL-OAHLLOKOSA-N 1 1 230.355 3.501 20 0 BHADMO Cc1ccccc1[C@@H](C)[N@H+]1CC[C@@H](OC(C)C)C1 ZINC000517562370 256828183 /nfs/dbraw/zinc/82/81/83/256828183.db2.gz NMLWCCFAAGTHQJ-HUUCEWRRSA-N 1 1 247.382 3.555 20 0 BHADMO Cc1ccccc1[C@H](C)[N@H+]1CC[C@@H](OC(C)C)C1 ZINC000517562371 388552979 /nfs/dbraw/zinc/55/29/79/388552979.db2.gz NMLWCCFAAGTHQJ-LSDHHAIUSA-N 1 1 247.382 3.555 20 0 BHADMO CCC(C)(C)CC[N@H+]1CC[C@H](c2ccncc2)C1 ZINC000517584493 388554790 /nfs/dbraw/zinc/55/47/90/388554790.db2.gz VOGCBVXVGNXINE-HNNXBMFYSA-N 1 1 246.398 3.697 20 0 BHADMO CCC(C)(C)CC[N@H+]1CC[C@@H](c2ccncc2)C1 ZINC000517584494 388554271 /nfs/dbraw/zinc/55/42/71/388554271.db2.gz VOGCBVXVGNXINE-OAHLLOKOSA-N 1 1 246.398 3.697 20 0 BHADMO CCCC[N@@H+](CCOC)Cc1cc(C)ccc1C ZINC000517597417 388556062 /nfs/dbraw/zinc/55/60/62/388556062.db2.gz OXBADXXJGVPACU-UHFFFAOYSA-N 1 1 249.398 3.552 20 0 BHADMO CCC(CC)[N@@H+](Cc1ccncc1C)C1CC1 ZINC000517679977 398087655 /nfs/dbraw/zinc/08/76/55/398087655.db2.gz IWFYGWCLIYUBCP-UHFFFAOYSA-N 1 1 232.371 3.543 20 0 BHADMO C[N@@H+](CC/C=C\c1ccccc1)C(C)(C)C ZINC000517738458 383872571 /nfs/dbraw/zinc/87/25/71/383872571.db2.gz SEXYFMUJLDQWLD-WQLSENKSSA-N 1 1 217.356 3.820 20 0 BHADMO C[N@@H+](CC/C=C/c1ccccc1)C(C)(C)C ZINC000517738459 383871898 /nfs/dbraw/zinc/87/18/98/383871898.db2.gz SEXYFMUJLDQWLD-XYOKQWHBSA-N 1 1 217.356 3.820 20 0 BHADMO CCc1ccc(C[N@@H+](C)CCCCCF)cc1 ZINC000517762697 259336718 /nfs/dbraw/zinc/33/67/18/259336718.db2.gz CSNRKFCKZZKIFJ-UHFFFAOYSA-N 1 1 237.362 3.821 20 0 BHADMO C[C@@H]1C[C@H](C)[N@@H+]1CCSC1CCCCC1 ZINC000517964637 384595710 /nfs/dbraw/zinc/59/57/10/384595710.db2.gz HEAGLTFIZFBZJT-TXEJJXNPSA-N 1 1 227.417 3.535 20 0 BHADMO CCC[C@H](C[NH2+]CC(C)(F)F)c1ccccc1 ZINC000517970393 384599806 /nfs/dbraw/zinc/59/98/06/384599806.db2.gz YZNVZGUGYNHDML-CYBMUJFWSA-N 1 1 241.325 3.815 20 0 BHADMO CCC[C@@H](C[NH2+]CC(C)(F)F)c1ccccc1 ZINC000517970394 384600795 /nfs/dbraw/zinc/60/07/95/384600795.db2.gz YZNVZGUGYNHDML-ZDUSSCGKSA-N 1 1 241.325 3.815 20 0 BHADMO CC(C)CC[C@@H]1CCC[N@H+]1Cc1cccc(N)c1 ZINC000518199491 384793390 /nfs/dbraw/zinc/79/33/90/384793390.db2.gz ABBJBEUAHUYKTN-INIZCTEOSA-N 1 1 246.398 3.669 20 0 BHADMO CC(C)CC[C@H]1CCC[N@H+]1Cc1cccc(N)c1 ZINC000518199500 384794576 /nfs/dbraw/zinc/79/45/76/384794576.db2.gz ABBJBEUAHUYKTN-MRXNPFEDSA-N 1 1 246.398 3.669 20 0 BHADMO CCCC[N@@H+](C)[C@@H](CC)c1cccc(OC)c1 ZINC000518433715 383862209 /nfs/dbraw/zinc/86/22/09/383862209.db2.gz AKBMTUXQUSKSDE-HNNXBMFYSA-N 1 1 235.371 3.878 20 0 BHADMO CCCC[N@@H+](C)[C@H](CC)c1cccc(OC)c1 ZINC000518433717 383860786 /nfs/dbraw/zinc/86/07/86/383860786.db2.gz AKBMTUXQUSKSDE-OAHLLOKOSA-N 1 1 235.371 3.878 20 0 BHADMO COc1ccccc1C[C@H](C)[N@@H+](C)CC=C(C)C ZINC000518607952 384073887 /nfs/dbraw/zinc/07/38/87/384073887.db2.gz VNNAVSSGPKSDKN-AWEZNQCLSA-N 1 1 247.382 3.524 20 0 BHADMO COc1ccccc1C[C@@H](C)[N@@H+](C)CC=C(C)C ZINC000518607953 384073756 /nfs/dbraw/zinc/07/37/56/384073756.db2.gz VNNAVSSGPKSDKN-CQSZACIVSA-N 1 1 247.382 3.524 20 0 BHADMO Cc1nsc(C)c1C[N@H+](C(C)C)C1CCC1 ZINC000518790651 259392232 /nfs/dbraw/zinc/39/22/32/259392232.db2.gz JSWGNPKJHAESGL-UHFFFAOYSA-N 1 1 238.400 3.523 20 0 BHADMO Cc1cccc(C[N@@H+]2CCC[C@@H]2C(C)C)c1 ZINC000518829378 323183439 /nfs/dbraw/zinc/18/34/39/323183439.db2.gz VLUCGAUOBIJEIX-OAHLLOKOSA-N 1 1 217.356 3.615 20 0 BHADMO CC(C)[C@@H](C)[N@@H+](C)Cc1cccc(Cl)c1 ZINC000518830407 323183682 /nfs/dbraw/zinc/18/36/82/323183682.db2.gz FRESTSYCMIOVKF-LLVKDONJSA-N 1 1 225.763 3.816 20 0 BHADMO CC(C)[C@H](C)[N@@H+](C)Cc1cccc(Cl)c1 ZINC000518830408 323183687 /nfs/dbraw/zinc/18/36/87/323183687.db2.gz FRESTSYCMIOVKF-NSHDSACASA-N 1 1 225.763 3.816 20 0 BHADMO Cc1ccccc1C[N@@H+]1CCC[C@@H]1C(C)C ZINC000518830427 323183705 /nfs/dbraw/zinc/18/37/05/323183705.db2.gz HOXYXDWPIOVJSZ-OAHLLOKOSA-N 1 1 217.356 3.615 20 0 BHADMO Cc1ccc(C)c(C[N@H+](C)[C@@H](C)C(C)C)c1 ZINC000518833758 354591046 /nfs/dbraw/zinc/59/10/46/354591046.db2.gz RHLBGCDWWJNVAM-AWEZNQCLSA-N 1 1 219.372 3.780 20 0 BHADMO Cc1ccc(C)c(C[N@H+](C)[C@H](C)C(C)C)c1 ZINC000518833759 354591135 /nfs/dbraw/zinc/59/11/35/354591135.db2.gz RHLBGCDWWJNVAM-CQSZACIVSA-N 1 1 219.372 3.780 20 0 BHADMO CCc1cccc(OCC[N@@H+](C)[C@@H](C)C(C)C)c1 ZINC000518836361 398282210 /nfs/dbraw/zinc/28/22/10/398282210.db2.gz VHHNNDXCKKEVMM-AWEZNQCLSA-N 1 1 249.398 3.604 20 0 BHADMO CCc1cccc(OCC[N@@H+](C)[C@H](C)C(C)C)c1 ZINC000518836362 398282189 /nfs/dbraw/zinc/28/21/89/398282189.db2.gz VHHNNDXCKKEVMM-CQSZACIVSA-N 1 1 249.398 3.604 20 0 BHADMO Cc1ccc(C[N@@H+]2CCC[C@@H]2C(C)C)cc1 ZINC000518837761 256636471 /nfs/dbraw/zinc/63/64/71/256636471.db2.gz QUKTWKHALCOKQJ-OAHLLOKOSA-N 1 1 217.356 3.615 20 0 BHADMO CC[C@@H]1CC[C@H](C)[N@H+]1CCc1ccccc1F ZINC000518838153 323184642 /nfs/dbraw/zinc/18/46/42/323184642.db2.gz NCEGWHBKNPQXLH-GXTWGEPZSA-N 1 1 235.346 3.631 20 0 BHADMO CC[C@H]1CC[C@H](C)[N@H+]1CCc1ccccc1F ZINC000518838154 323184668 /nfs/dbraw/zinc/18/46/68/323184668.db2.gz NCEGWHBKNPQXLH-JSGCOSHPSA-N 1 1 235.346 3.631 20 0 BHADMO CC[C@H]1CC[C@@H](C)[N@H+]1CCc1ccccc1F ZINC000518838155 323184638 /nfs/dbraw/zinc/18/46/38/323184638.db2.gz NCEGWHBKNPQXLH-OCCSQVGLSA-N 1 1 235.346 3.631 20 0 BHADMO CC[C@@H]1CC[C@@H](C)[N@H+]1CCc1ccccc1F ZINC000518838156 323184661 /nfs/dbraw/zinc/18/46/61/323184661.db2.gz NCEGWHBKNPQXLH-TZMCWYRMSA-N 1 1 235.346 3.631 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)CC1Cc2ccccc2C1 ZINC000518848613 386834591 /nfs/dbraw/zinc/83/45/91/386834591.db2.gz QFGIPKHCLGYGIS-CYBMUJFWSA-N 1 1 231.383 3.522 20 0 BHADMO CCC[C@H](C)[N@@H+](C)CC1Cc2ccccc2C1 ZINC000518848614 386833487 /nfs/dbraw/zinc/83/34/87/386833487.db2.gz QFGIPKHCLGYGIS-ZDUSSCGKSA-N 1 1 231.383 3.522 20 0 BHADMO CC[C@H]1CCC[N@H+]([C@H](C)c2ccccc2)C1 ZINC000518860463 256637493 /nfs/dbraw/zinc/63/74/93/256637493.db2.gz KUYAQCREIMFKQK-KGLIPLIRSA-N 1 1 217.356 3.870 20 0 BHADMO CC[C@@H]1CCC[N@H+]([C@H](C)c2ccccc2)C1 ZINC000518860464 386839362 /nfs/dbraw/zinc/83/93/62/386839362.db2.gz KUYAQCREIMFKQK-ZIAGYGMSSA-N 1 1 217.356 3.870 20 0 BHADMO CC[N@@H+](Cc1c(C)cc(C)cc1C)C(C)C ZINC000518912498 386929259 /nfs/dbraw/zinc/92/92/59/386929259.db2.gz QTLUZCKTVIHZCI-UHFFFAOYSA-N 1 1 219.372 3.842 20 0 BHADMO C[C@@H]1CCC[C@H]([N@@H+](C)CCOc2ccccc2)C1 ZINC000519002320 386983336 /nfs/dbraw/zinc/98/33/36/386983336.db2.gz DQSMUZFWRIGXRI-CABCVRRESA-N 1 1 247.382 3.576 20 0 BHADMO C[C@H]1CCC[C@H]([N@@H+](C)CCOc2ccccc2)C1 ZINC000519002321 386982933 /nfs/dbraw/zinc/98/29/33/386982933.db2.gz DQSMUZFWRIGXRI-GJZGRUSLSA-N 1 1 247.382 3.576 20 0 BHADMO C[C@@H]1CCC[C@@H]([N@@H+](C)CCOc2ccccc2)C1 ZINC000519002322 386983127 /nfs/dbraw/zinc/98/31/27/386983127.db2.gz DQSMUZFWRIGXRI-HUUCEWRRSA-N 1 1 247.382 3.576 20 0 BHADMO C[C@H]1CCC[C@@H]([N@@H+](C)CCOc2ccccc2)C1 ZINC000519002323 386983369 /nfs/dbraw/zinc/98/33/69/386983369.db2.gz DQSMUZFWRIGXRI-LSDHHAIUSA-N 1 1 247.382 3.576 20 0 BHADMO COc1cccc(C[N@@H+](C)[C@@H]2CCC[C@H](C)C2)c1 ZINC000519002370 386984501 /nfs/dbraw/zinc/98/45/01/386984501.db2.gz LYBLYVYLMDZRDG-DZGCQCFKSA-N 1 1 247.382 3.706 20 0 BHADMO COc1cccc(C[N@@H+](C)[C@H]2CCC[C@@H](C)C2)c1 ZINC000519002371 256641522 /nfs/dbraw/zinc/64/15/22/256641522.db2.gz LYBLYVYLMDZRDG-HIFRSBDPSA-N 1 1 247.382 3.706 20 0 BHADMO COc1cccc(C[N@@H+](C)[C@@H]2CCC[C@@H](C)C2)c1 ZINC000519002372 386984692 /nfs/dbraw/zinc/98/46/92/386984692.db2.gz LYBLYVYLMDZRDG-UKRRQHHQSA-N 1 1 247.382 3.706 20 0 BHADMO COc1cccc(C[N@@H+](C)[C@H]2CCC[C@H](C)C2)c1 ZINC000519002373 386984875 /nfs/dbraw/zinc/98/48/75/386984875.db2.gz LYBLYVYLMDZRDG-ZFWWWQNUSA-N 1 1 247.382 3.706 20 0 BHADMO C[C@H]1CCC[C@@H]([N@@H+](C)Cc2ccccc2)C1 ZINC000519002378 386985838 /nfs/dbraw/zinc/98/58/38/386985838.db2.gz MIGGNSLDSQYFKE-DZGCQCFKSA-N 1 1 217.356 3.697 20 0 BHADMO C[C@@H]1CCC[C@H]([N@@H+](C)Cc2ccccc2)C1 ZINC000519002379 256641591 /nfs/dbraw/zinc/64/15/91/256641591.db2.gz MIGGNSLDSQYFKE-HIFRSBDPSA-N 1 1 217.356 3.697 20 0 BHADMO C[C@@H]1CCC[C@@H]([N@@H+](C)Cc2ccccc2)C1 ZINC000519002380 386985293 /nfs/dbraw/zinc/98/52/93/386985293.db2.gz MIGGNSLDSQYFKE-UKRRQHHQSA-N 1 1 217.356 3.697 20 0 BHADMO CC(C)CCOCC[N@@H+](C)[C@H]1CCC[C@@H](C)C1 ZINC000519002518 386983487 /nfs/dbraw/zinc/98/34/87/386983487.db2.gz ZHLWFPFODYPGEW-CABCVRRESA-N 1 1 241.419 3.560 20 0 BHADMO CC(C)CCOCC[N@@H+](C)[C@H]1CCC[C@H](C)C1 ZINC000519002521 386983326 /nfs/dbraw/zinc/98/33/26/386983326.db2.gz ZHLWFPFODYPGEW-GJZGRUSLSA-N 1 1 241.419 3.560 20 0 BHADMO CC(C)CCOCC[N@@H+](C)[C@@H]1CCC[C@@H](C)C1 ZINC000519002529 386982185 /nfs/dbraw/zinc/98/21/85/386982185.db2.gz ZHLWFPFODYPGEW-HUUCEWRRSA-N 1 1 241.419 3.560 20 0 BHADMO CC(C)CCOCC[N@@H+](C)[C@@H]1CCC[C@H](C)C1 ZINC000519002530 386983191 /nfs/dbraw/zinc/98/31/91/386983191.db2.gz ZHLWFPFODYPGEW-LSDHHAIUSA-N 1 1 241.419 3.560 20 0 BHADMO C[N@@H+](CCc1ccccc1)CC1CCCCC1 ZINC000519004637 386983072 /nfs/dbraw/zinc/98/30/72/386983072.db2.gz MSPMNYRPDYZFGQ-UHFFFAOYSA-N 1 1 231.383 3.741 20 0 BHADMO CCOCC[N@@H+](C)C1CCC(C(C)(C)C)CC1 ZINC000519044083 386994557 /nfs/dbraw/zinc/99/45/57/386994557.db2.gz WJXWHUNVOHMFNG-UHFFFAOYSA-N 1 1 241.419 3.560 20 0 BHADMO CC[N@@H+](Cc1ccccc1OC(C)C)C(C)C ZINC000519051737 386993654 /nfs/dbraw/zinc/99/36/54/386993654.db2.gz RVARPGOAYRWFMI-UHFFFAOYSA-N 1 1 235.371 3.704 20 0 BHADMO CC(C)O[C@H](C[N@@H+]1[C@H](C)C[C@@H]1C)c1ccccc1 ZINC000519059934 386995235 /nfs/dbraw/zinc/99/52/35/386995235.db2.gz QBVRSQMJVBDDJO-IJEWVQPXSA-N 1 1 247.382 3.635 20 0 BHADMO CC(C)O[C@@H](C[N@@H+]1[C@H](C)C[C@@H]1C)c1ccccc1 ZINC000519059935 386995664 /nfs/dbraw/zinc/99/56/64/386995664.db2.gz QBVRSQMJVBDDJO-LZWOXQAQSA-N 1 1 247.382 3.635 20 0 BHADMO CC[N@H+](Cc1ccccc1OC(C)C)CC(C)C ZINC000519064529 386999338 /nfs/dbraw/zinc/99/93/38/386999338.db2.gz CILWAMUVGPHIGN-UHFFFAOYSA-N 1 1 249.398 3.952 20 0 BHADMO CC[N@@H+](C/C=C/c1ccccc1)C1CCCC1 ZINC000519124192 387013201 /nfs/dbraw/zinc/01/32/01/387013201.db2.gz ZWLIQOAZODOSST-DHZHZOJOSA-N 1 1 229.367 3.964 20 0 BHADMO CC[N@@H+](C/C=C\c1ccccc1)C1CCCC1 ZINC000519124193 387013941 /nfs/dbraw/zinc/01/39/41/387013941.db2.gz ZWLIQOAZODOSST-FLIBITNWSA-N 1 1 229.367 3.964 20 0 BHADMO CC[C@@H](C)[C@@H](C)[N@@H+](CCC(C)C)C1CC1 ZINC000519188011 387027400 /nfs/dbraw/zinc/02/74/00/387027400.db2.gz XJELASJOPDBRSG-CHWSQXEVSA-N 1 1 211.393 3.932 20 0 BHADMO CC[C@@H](C)[C@H](C)[N@@H+](CCC(C)C)C1CC1 ZINC000519188012 387028090 /nfs/dbraw/zinc/02/80/90/387028090.db2.gz XJELASJOPDBRSG-OLZOCXBDSA-N 1 1 211.393 3.932 20 0 BHADMO CC[C@H](C)[C@@H](C)[N@@H+](CCC(C)C)C1CC1 ZINC000519188013 387027435 /nfs/dbraw/zinc/02/74/35/387027435.db2.gz XJELASJOPDBRSG-QWHCGFSZSA-N 1 1 211.393 3.932 20 0 BHADMO CC[C@H](C)[C@H](C)[N@@H+](CCC(C)C)C1CC1 ZINC000519188014 387027781 /nfs/dbraw/zinc/02/77/81/387027781.db2.gz XJELASJOPDBRSG-STQMWFEESA-N 1 1 211.393 3.932 20 0 BHADMO C[C@@H](C1CC1)[N@@H+](CCCc1ccccc1)C1CC1 ZINC000519227258 256645124 /nfs/dbraw/zinc/64/51/24/256645124.db2.gz FYXMYVFCEHNURI-AWEZNQCLSA-N 1 1 243.394 3.882 20 0 BHADMO C[C@H](C1CC1)[N@@H+](CCCc1ccccc1)C1CC1 ZINC000519227262 256645335 /nfs/dbraw/zinc/64/53/35/256645335.db2.gz FYXMYVFCEHNURI-CQSZACIVSA-N 1 1 243.394 3.882 20 0 BHADMO Cc1ccsc1C[N@H+]1CC(C)(C)[C@H]1C1CC1 ZINC000519243454 387039798 /nfs/dbraw/zinc/03/97/98/387039798.db2.gz APGDBNRJYLEPSQ-CYBMUJFWSA-N 1 1 235.396 3.677 20 0 BHADMO Cc1ccsc1C[N@H+]1CC(C)(C)[C@@H]1C1CC1 ZINC000519243455 387039787 /nfs/dbraw/zinc/03/97/87/387039787.db2.gz APGDBNRJYLEPSQ-ZDUSSCGKSA-N 1 1 235.396 3.677 20 0 BHADMO C[C@@H](C1CC1)[N@@H+](C)Cc1cccc(C(F)F)c1 ZINC000519256523 387042188 /nfs/dbraw/zinc/04/21/88/387042188.db2.gz OUBYGDKDNKLQPJ-JTQLQIEISA-N 1 1 239.309 3.855 20 0 BHADMO C[C@H](C1CC1)[N@@H+](C)Cc1cccc(C(F)F)c1 ZINC000519256524 387042465 /nfs/dbraw/zinc/04/24/65/387042465.db2.gz OUBYGDKDNKLQPJ-SNVBAGLBSA-N 1 1 239.309 3.855 20 0 BHADMO Cc1ccccc1OCCC[N@@H+]1CCCC[C@H]1C ZINC000519272040 387046006 /nfs/dbraw/zinc/04/60/06/387046006.db2.gz CAYHTCNNQCUPTM-OAHLLOKOSA-N 1 1 247.382 3.638 20 0 BHADMO CC[N@@H+](Cc1ccc(C)cc1)[C@H](C)C(C)C ZINC000519272767 387049014 /nfs/dbraw/zinc/04/90/14/387049014.db2.gz CRFZVASUHCCVSV-CQSZACIVSA-N 1 1 219.372 3.861 20 0 BHADMO CC(C)[N@@H+](Cc1ccccc1F)CC1(C)CC1 ZINC000519273644 387049584 /nfs/dbraw/zinc/04/95/84/387049584.db2.gz TVPPQIIQFBGMFJ-UHFFFAOYSA-N 1 1 235.346 3.836 20 0 BHADMO CC[N@@H+](CCOc1cccc(C)c1)[C@@H](C)C(C)C ZINC000519274285 387051312 /nfs/dbraw/zinc/05/13/12/387051312.db2.gz JQEKJSRVNKOLBP-HNNXBMFYSA-N 1 1 249.398 3.740 20 0 BHADMO CC(C)=CC[N@H+](C)C/C(C)=C/c1ccccc1 ZINC000519414106 323198494 /nfs/dbraw/zinc/19/84/94/323198494.db2.gz UTUBMIKHIJQTOV-NTCAYCPXSA-N 1 1 229.367 3.988 20 0 BHADMO CC(C)=CC[N@H+](C)C/C(C)=C\c1ccccc1 ZINC000519414107 323198465 /nfs/dbraw/zinc/19/84/65/323198465.db2.gz UTUBMIKHIJQTOV-QINSGFPZSA-N 1 1 229.367 3.988 20 0 BHADMO CC/C=C\CC[N@@H+](C)Cc1c(F)cccc1F ZINC000519432696 386441250 /nfs/dbraw/zinc/44/12/50/386441250.db2.gz WCVOWQSLEYLHGJ-PLNGDYQASA-N 1 1 239.309 3.753 20 0 BHADMO CC/C=C\CC[N@H+](C)Cc1c(F)cccc1F ZINC000519432696 386441245 /nfs/dbraw/zinc/44/12/45/386441245.db2.gz WCVOWQSLEYLHGJ-PLNGDYQASA-N 1 1 239.309 3.753 20 0 BHADMO CC/C=C/CC[N@@H+](C)Cc1c(F)cccc1F ZINC000519432697 386439036 /nfs/dbraw/zinc/43/90/36/386439036.db2.gz WCVOWQSLEYLHGJ-SNAWJCMRSA-N 1 1 239.309 3.753 20 0 BHADMO CC/C=C/CC[N@H+](C)Cc1c(F)cccc1F ZINC000519432697 386439030 /nfs/dbraw/zinc/43/90/30/386439030.db2.gz WCVOWQSLEYLHGJ-SNAWJCMRSA-N 1 1 239.309 3.753 20 0 BHADMO CC(C)Oc1ccc(C[N@@H+](C)C(C)(C)C)cc1 ZINC000519541673 386488657 /nfs/dbraw/zinc/48/86/57/386488657.db2.gz GANVUHOSFNDADI-UHFFFAOYSA-N 1 1 235.371 3.704 20 0 BHADMO CCCC[N@@H+](CCc1ncc(C)cc1C)C1CC1 ZINC000519547269 386484243 /nfs/dbraw/zinc/48/42/43/386484243.db2.gz WTUOVDIHOKBWMS-UHFFFAOYSA-N 1 1 246.398 3.505 20 0 BHADMO CC(C)[C@H](C)[N@@H+](C)Cc1ccc(F)cc1Cl ZINC000519559323 386491772 /nfs/dbraw/zinc/49/17/72/386491772.db2.gz XPETWKOTRBZKDG-JTQLQIEISA-N 1 1 243.753 3.955 20 0 BHADMO CC(C)[C@@H](C)[N@@H+](C)Cc1ccc(F)cc1Cl ZINC000519559389 386491446 /nfs/dbraw/zinc/49/14/46/386491446.db2.gz XPETWKOTRBZKDG-SNVBAGLBSA-N 1 1 243.753 3.955 20 0 BHADMO Cc1cc(C[N@H+]2CCC(C)=C(C)C2)cc(C)c1O ZINC000519568097 386490371 /nfs/dbraw/zinc/49/03/71/386490371.db2.gz PKFWXRSQQGUYGB-UHFFFAOYSA-N 1 1 245.366 3.551 20 0 BHADMO C[N@@H+](CC1Cc2ccccc2C1)C1CCCCC1 ZINC000519605293 256652793 /nfs/dbraw/zinc/65/27/93/256652793.db2.gz DAZGJAMNCHBOFQ-UHFFFAOYSA-N 1 1 243.394 3.666 20 0 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ZINC000521151015 388563742 /nfs/dbraw/zinc/56/37/42/388563742.db2.gz UHSMSDBDGHQRRQ-XPKDYRNWSA-N 1 1 229.367 3.652 20 0 BHADMO CCC[N@@H+](CC)Cc1csc(C(C)(C)C)n1 ZINC000521187508 363121719 /nfs/dbraw/zinc/12/17/19/363121719.db2.gz OJHNZOLZTADLOX-UHFFFAOYSA-N 1 1 240.416 3.673 20 0 BHADMO CCC[N@@H+](CC)Cc1cccc(C(F)(F)F)c1 ZINC000521188091 324178994 /nfs/dbraw/zinc/17/89/94/324178994.db2.gz LLICCJLHZRHTNA-UHFFFAOYSA-N 1 1 245.288 3.937 20 0 BHADMO CCC[N@@H+](CC)Cc1cc(C)ccc1C ZINC000521188126 324178981 /nfs/dbraw/zinc/17/89/81/324178981.db2.gz MWJKNNUDFONLSI-UHFFFAOYSA-N 1 1 205.345 3.535 20 0 BHADMO CCC[N@@H+](CC)Cc1cccc(OC(C)C)c1 ZINC000521188151 711777972 /nfs/dbraw/zinc/77/79/72/711777972.db2.gz OAUQRNHVUBJVEU-UHFFFAOYSA-N 1 1 235.371 3.706 20 0 BHADMO Cc1ccccc1[C@H](C)[N@@H+](C)CCOC(C)(C)C ZINC000521188317 324178704 /nfs/dbraw/zinc/17/87/04/324178704.db2.gz ZLSASXNOMNEIGE-AWEZNQCLSA-N 1 1 249.398 3.803 20 0 BHADMO Cc1ccccc1[C@@H](C)[N@@H+](C)CCOC(C)(C)C ZINC000521188318 388564278 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1 247.382 3.640 20 0 BHADMO CCOCC[N@H+]1CCCCC[C@@H]1c1ccccc1 ZINC000521425792 385812358 /nfs/dbraw/zinc/81/23/58/385812358.db2.gz MFUKGGQJGYZBAJ-MRXNPFEDSA-N 1 1 247.382 3.640 20 0 BHADMO CC[C@H]1CCCC[C@H]1[N@@H+](C)Cc1ccco1 ZINC000521451331 387565547 /nfs/dbraw/zinc/56/55/47/387565547.db2.gz ILTQRNJCQKJXET-GXTWGEPZSA-N 1 1 221.344 3.680 20 0 BHADMO CC[C@H]1CCCC[C@@H]1[N@@H+](C)Cc1ccco1 ZINC000521451332 387565794 /nfs/dbraw/zinc/56/57/94/387565794.db2.gz ILTQRNJCQKJXET-JSGCOSHPSA-N 1 1 221.344 3.680 20 0 BHADMO CC[C@@H]1CCCC[C@@H]1[N@@H+](C)Cc1ccco1 ZINC000521451333 387565520 /nfs/dbraw/zinc/56/55/20/387565520.db2.gz ILTQRNJCQKJXET-OCCSQVGLSA-N 1 1 221.344 3.680 20 0 BHADMO CC[C@@H]1CCCC[C@H]1[N@@H+](C)Cc1ccco1 ZINC000521451334 387564248 /nfs/dbraw/zinc/56/42/48/387564248.db2.gz ILTQRNJCQKJXET-TZMCWYRMSA-N 1 1 221.344 3.680 20 0 BHADMO CC[N@@H+](Cc1cccc(OC)c1)[C@H](C)C(C)C ZINC000521480085 259493116 /nfs/dbraw/zinc/49/31/16/259493116.db2.gz GJWPCQJYRODSPY-CYBMUJFWSA-N 1 1 235.371 3.562 20 0 BHADMO CC[N@@H+](Cc1cccc(C)c1)[C@H](C)C(C)C ZINC000521480126 259493130 /nfs/dbraw/zinc/49/31/30/259493130.db2.gz JZDVENZKMBOQEH-CQSZACIVSA-N 1 1 219.372 3.861 20 0 BHADMO CC[N@@H+](CCCOc1ccccc1C)CC(C)C ZINC000521480145 387230550 /nfs/dbraw/zinc/23/05/50/387230550.db2.gz LJYPWWLIBZEOMT-UHFFFAOYSA-N 1 1 249.398 3.742 20 0 BHADMO CC[N@@H+](CCCOc1ccccc1)[C@H](C)C(C)C ZINC000521480232 387230150 /nfs/dbraw/zinc/23/01/50/387230150.db2.gz PKDSZMKYUDOXMX-OAHLLOKOSA-N 1 1 249.398 3.822 20 0 BHADMO CC[N@@H+](Cc1ccccc1C)[C@H](C)C(C)C ZINC000521482648 388567200 /nfs/dbraw/zinc/56/72/00/388567200.db2.gz FHDPQDHWMDDOLH-CQSZACIVSA-N 1 1 219.372 3.861 20 0 BHADMO CC[N@@H+](CC1(C)CC1)[C@H](C)c1cccc(O)c1 ZINC000521530829 388616011 /nfs/dbraw/zinc/61/60/11/388616011.db2.gz HUQXAKHJMKQYAP-GFCCVEGCSA-N 1 1 233.355 3.575 20 0 BHADMO CC[N@@H+](CC1(C)CC1)[C@@H](C)c1cccc(O)c1 ZINC000521530830 388615870 /nfs/dbraw/zinc/61/58/70/388615870.db2.gz HUQXAKHJMKQYAP-LBPRGKRZSA-N 1 1 233.355 3.575 20 0 BHADMO CC[C@H]1CCCC[N@H+]1CCc1ncc(C)cc1C ZINC000521621387 388619071 /nfs/dbraw/zinc/61/90/71/388619071.db2.gz WXBQIQASWWCCKY-HNNXBMFYSA-N 1 1 246.398 3.505 20 0 BHADMO CC[C@@H]1CCCC[N@H+]1CCc1ncc(C)cc1C ZINC000521621388 388619036 /nfs/dbraw/zinc/61/90/36/388619036.db2.gz WXBQIQASWWCCKY-OAHLLOKOSA-N 1 1 246.398 3.505 20 0 BHADMO CCCc1nc(C[N@H+](CCC)C(C)C)cs1 ZINC000521639812 324186349 /nfs/dbraw/zinc/18/63/49/324186349.db2.gz IRYUJAWKRADMJQ-UHFFFAOYSA-N 1 1 240.416 3.716 20 0 BHADMO CCCC[N@@H+](CCCCCO)C1CCCCC1 ZINC000521650105 259539353 /nfs/dbraw/zinc/53/93/53/259539353.db2.gz RGZMTLODQPGSJB-UHFFFAOYSA-N 1 1 241.419 3.584 20 0 BHADMO C[C@H]1CCC[N@@H+](CCCc2ccccc2)CC1 ZINC000521710620 388626043 /nfs/dbraw/zinc/62/60/43/388626043.db2.gz VRKHFNHGZAIBOT-HNNXBMFYSA-N 1 1 231.383 3.741 20 0 BHADMO C[C@@H]1CCC[N@@H+](CCCc2ccccc2)CC1 ZINC000521710621 388626054 /nfs/dbraw/zinc/62/60/54/388626054.db2.gz VRKHFNHGZAIBOT-OAHLLOKOSA-N 1 1 231.383 3.741 20 0 BHADMO C[C@@H]1CCC[N@@H+](Cc2cccc(Cl)c2)CC1 ZINC000521714371 388626130 /nfs/dbraw/zinc/62/61/30/388626130.db2.gz ARFUZDBKOZEFCJ-GFCCVEGCSA-N 1 1 237.774 3.962 20 0 BHADMO CCc1ccc(C[N@@H+](C)Cc2occc2C)s1 ZINC000521742726 388628050 /nfs/dbraw/zinc/62/80/50/388628050.db2.gz WWNBQVVXTUNYDO-UHFFFAOYSA-N 1 1 249.379 3.844 20 0 BHADMO CCC[N@@H+](CC)Cc1c(C)cc(C)cc1C ZINC000521814553 388629564 /nfs/dbraw/zinc/62/95/64/388629564.db2.gz BYEBGQZXOMDYDC-UHFFFAOYSA-N 1 1 219.372 3.844 20 0 BHADMO CCC[N@@H+](CC)Cc1ccccc1OC(F)F ZINC000521814573 388629144 /nfs/dbraw/zinc/62/91/44/388629144.db2.gz CNJCIUGNHQLDSL-UHFFFAOYSA-N 1 1 243.297 3.520 20 0 BHADMO CCC[N@@H+](CC)Cc1cc(C)cc(C)c1 ZINC000521814903 388629764 /nfs/dbraw/zinc/62/97/64/388629764.db2.gz RFVKJSZDDFQAED-UHFFFAOYSA-N 1 1 205.345 3.535 20 0 BHADMO CC[N@@H+](CCc1cccs1)CC1CCCC1 ZINC000521817960 388630919 /nfs/dbraw/zinc/63/09/19/388630919.db2.gz BWZGXPFNLLOGAJ-UHFFFAOYSA-N 1 1 237.412 3.803 20 0 BHADMO CCC[N@@H+](CCCOC)[C@@H](CC)c1ccccc1 ZINC000521818675 388630635 /nfs/dbraw/zinc/63/06/35/388630635.db2.gz FJQOVGFPGXBMTR-INIZCTEOSA-N 1 1 249.398 3.886 20 0 BHADMO CCC[N@@H+](CCCOC)[C@H](CC)c1ccccc1 ZINC000521818676 388630242 /nfs/dbraw/zinc/63/02/42/388630242.db2.gz FJQOVGFPGXBMTR-MRXNPFEDSA-N 1 1 249.398 3.886 20 0 BHADMO CCC[N@H+](Cc1cccc(F)c1F)CC(C)C ZINC000521819970 388630113 /nfs/dbraw/zinc/63/01/13/388630113.db2.gz PDSCNFRXPXUNTR-UHFFFAOYSA-N 1 1 241.325 3.833 20 0 BHADMO CC(C)CC[N@@H+](CC(C)C)C1CCCC1 ZINC000521820101 388630105 /nfs/dbraw/zinc/63/01/05/388630105.db2.gz UZKVCBBUSHAUDB-UHFFFAOYSA-N 1 1 211.393 3.933 20 0 BHADMO CCC[N@@H+](CCOCC)[C@@H](CC)c1ccccc1 ZINC000521820130 388630328 /nfs/dbraw/zinc/63/03/28/388630328.db2.gz WSVJVALCOSOHJL-INIZCTEOSA-N 1 1 249.398 3.886 20 0 BHADMO CCC[N@@H+](CCOCC)[C@H](CC)c1ccccc1 ZINC000521820131 388630307 /nfs/dbraw/zinc/63/03/07/388630307.db2.gz WSVJVALCOSOHJL-MRXNPFEDSA-N 1 1 249.398 3.886 20 0 BHADMO COCC[N@@H+](CCC(C)C)[C@@H](C)c1ccccc1 ZINC000521859445 388635266 /nfs/dbraw/zinc/63/52/66/388635266.db2.gz CCOSKUAGJVPIPS-HNNXBMFYSA-N 1 1 249.398 3.742 20 0 BHADMO COCC[N@@H+](CCC(C)C)[C@H](C)c1ccccc1 ZINC000521859446 388635271 /nfs/dbraw/zinc/63/52/71/388635271.db2.gz CCOSKUAGJVPIPS-OAHLLOKOSA-N 1 1 249.398 3.742 20 0 BHADMO CC[N@@H+](CCOC(C)(C)C)Cc1ccc(C)cc1 ZINC000521859897 388635223 /nfs/dbraw/zinc/63/52/23/388635223.db2.gz YELUHJVEXNSDAR-UHFFFAOYSA-N 1 1 249.398 3.632 20 0 BHADMO CC[N@@H+](CC=C(C)C)Cc1ccc(C)cc1 ZINC000521860714 388635848 /nfs/dbraw/zinc/63/58/48/388635848.db2.gz HMLJHKHPUPZTLL-UHFFFAOYSA-N 1 1 217.356 3.783 20 0 BHADMO CCCC[N@@H+](CCOC)Cc1cc(C)cc(C)c1 ZINC000521875960 388638544 /nfs/dbraw/zinc/63/85/44/388638544.db2.gz WNHTYJYFIGEYPV-UHFFFAOYSA-N 1 1 249.398 3.552 20 0 BHADMO C[C@H]1C[C@H](c2ccccc2)[N@@H+](CC2(F)CC2)C1 ZINC000521942238 491116623 /nfs/dbraw/zinc/11/66/23/491116623.db2.gz DPHFGRUQYDVFIP-GXTWGEPZSA-N 1 1 233.330 3.572 20 0 BHADMO CCCC[C@@H](C)[N@@H+](C)Cc1ccc(OC)cc1 ZINC000521944061 388669168 /nfs/dbraw/zinc/66/91/68/388669168.db2.gz FZVMMTAULXKSEW-CYBMUJFWSA-N 1 1 235.371 3.706 20 0 BHADMO CCCC[C@H](C)[N@@H+](C)Cc1ccc(OC)cc1 ZINC000521944062 388668973 /nfs/dbraw/zinc/66/89/73/388668973.db2.gz FZVMMTAULXKSEW-ZDUSSCGKSA-N 1 1 235.371 3.706 20 0 BHADMO CC[C@@H](c1cccc(OC)c1)[N@@H+](C)CC(C)C ZINC000522030782 388675902 /nfs/dbraw/zinc/67/59/02/388675902.db2.gz QAFOUTOOSWRBHZ-HNNXBMFYSA-N 1 1 235.371 3.734 20 0 BHADMO CC[C@H](c1cccc(OC)c1)[N@@H+](C)CC(C)C ZINC000522030784 388675810 /nfs/dbraw/zinc/67/58/10/388675810.db2.gz QAFOUTOOSWRBHZ-OAHLLOKOSA-N 1 1 235.371 3.734 20 0 BHADMO C[N@H+](Cc1ccc(F)cc1Cl)CC1CCC1 ZINC000522068957 388683101 /nfs/dbraw/zinc/68/31/01/388683101.db2.gz SHMSTQNGWYXDCI-UHFFFAOYSA-N 1 1 241.737 3.711 20 0 BHADMO CCC[N@H+]1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC000522069060 388683250 /nfs/dbraw/zinc/68/32/50/388683250.db2.gz XUSJXDUWGLEZCT-GFCCVEGCSA-N 1 1 223.747 3.539 20 0 BHADMO CCC[N@H+]1CC[C@H](c2ccc(Cl)cc2)C1 ZINC000522069061 388683082 /nfs/dbraw/zinc/68/30/82/388683082.db2.gz XUSJXDUWGLEZCT-LBPRGKRZSA-N 1 1 223.747 3.539 20 0 BHADMO CC[C@@H](C)C[N@@H+](C)Cc1cc(C)cc(C)c1 ZINC000522080963 398109112 /nfs/dbraw/zinc/10/91/12/398109112.db2.gz HVCASRDQGQKCSQ-GFCCVEGCSA-N 1 1 219.372 3.781 20 0 BHADMO CC[C@H](C)C[N@@H+](C)Cc1cc(C)cc(C)c1 ZINC000522080964 398109138 /nfs/dbraw/zinc/10/91/38/398109138.db2.gz HVCASRDQGQKCSQ-LBPRGKRZSA-N 1 1 219.372 3.781 20 0 BHADMO CC[C@H]1CCC[N@H+]1CCCOc1ccccc1C ZINC000522081396 398108686 /nfs/dbraw/zinc/10/86/86/398108686.db2.gz AORCTLYJCILFDJ-HNNXBMFYSA-N 1 1 247.382 3.638 20 0 BHADMO CC[C@@H]1CCC[N@H+]1CCCOc1ccccc1C ZINC000522081397 398109231 /nfs/dbraw/zinc/10/92/31/398109231.db2.gz AORCTLYJCILFDJ-OAHLLOKOSA-N 1 1 247.382 3.638 20 0 BHADMO CC[C@@H](C)C[N@@H+](C)Cc1cc(C)ccc1C ZINC000522081700 398108839 /nfs/dbraw/zinc/10/88/39/398108839.db2.gz UGUBULBSYYSFLA-GFCCVEGCSA-N 1 1 219.372 3.781 20 0 BHADMO CC[C@H](C)C[N@@H+](C)Cc1cc(C)ccc1C ZINC000522081701 398108755 /nfs/dbraw/zinc/10/87/55/398108755.db2.gz UGUBULBSYYSFLA-LBPRGKRZSA-N 1 1 219.372 3.781 20 0 BHADMO CC[C@@H]1CCC[N@H+]1Cc1ccc(F)cc1Cl ZINC000522082989 324199888 /nfs/dbraw/zinc/19/98/88/324199888.db2.gz YZNJNIIUFZZRID-GFCCVEGCSA-N 1 1 241.737 3.854 20 0 BHADMO CC[C@H]1CCC[N@H+]1Cc1ccc(F)cc1Cl ZINC000522082990 324200114 /nfs/dbraw/zinc/20/01/14/324200114.db2.gz YZNJNIIUFZZRID-LBPRGKRZSA-N 1 1 241.737 3.854 20 0 BHADMO CC[C@H]1CCC[N@H+]1Cc1ccccc1OC(C)C ZINC000522083479 324199846 /nfs/dbraw/zinc/19/98/46/324199846.db2.gz YIUGNMZRFWYXKR-HNNXBMFYSA-N 1 1 247.382 3.848 20 0 BHADMO CC[C@@H]1CCC[N@H+]1Cc1ccccc1OC(C)C ZINC000522083480 324200253 /nfs/dbraw/zinc/20/02/53/324200253.db2.gz YIUGNMZRFWYXKR-OAHLLOKOSA-N 1 1 247.382 3.848 20 0 BHADMO CC[C@H]1CCC[N@H+]1Cc1cc(C)cc(C)c1 ZINC000522083498 324199675 /nfs/dbraw/zinc/19/96/75/324199675.db2.gz ZOIBXAXSRLICCV-HNNXBMFYSA-N 1 1 217.356 3.678 20 0 BHADMO CC[C@@H]1CCC[N@H+]1Cc1cc(C)cc(C)c1 ZINC000522083499 324199251 /nfs/dbraw/zinc/19/92/51/324199251.db2.gz ZOIBXAXSRLICCV-OAHLLOKOSA-N 1 1 217.356 3.678 20 0 BHADMO CC[C@H]1CCC[N@H+]1Cc1cccc(OC(C)C)c1 ZINC000522083677 324200225 /nfs/dbraw/zinc/20/02/25/324200225.db2.gz JTNJCUJNQUAMMG-HNNXBMFYSA-N 1 1 247.382 3.848 20 0 BHADMO CC[C@@H]1CCC[N@H+]1Cc1cccc(OC(C)C)c1 ZINC000522083678 324199412 /nfs/dbraw/zinc/19/94/12/324199412.db2.gz JTNJCUJNQUAMMG-OAHLLOKOSA-N 1 1 247.382 3.848 20 0 BHADMO Cc1ccc(C)c(C[N@@H+](C)CC2CCC2)c1 ZINC000522097681 388687977 /nfs/dbraw/zinc/68/79/77/388687977.db2.gz TUQQXESZCQISDE-UHFFFAOYSA-N 1 1 217.356 3.535 20 0 BHADMO CC(C)=CC[N@H+](C)Cc1ccc(F)cc1Cl ZINC000522118459 388693937 /nfs/dbraw/zinc/69/39/37/388693937.db2.gz XYOVZNDNPMJVCV-UHFFFAOYSA-N 1 1 241.737 3.877 20 0 BHADMO CC(C)=CC[N@@H+](C)Cc1ccc(F)cc1Cl ZINC000522118459 388693935 /nfs/dbraw/zinc/69/39/35/388693935.db2.gz XYOVZNDNPMJVCV-UHFFFAOYSA-N 1 1 241.737 3.877 20 0 BHADMO CC(C)C[C@@H]1CCC[N@H+]1CC1CCCC1 ZINC000522162371 388710407 /nfs/dbraw/zinc/71/04/07/388710407.db2.gz GSYVGILYCXIVLY-AWEZNQCLSA-N 1 1 209.377 3.687 20 0 BHADMO CC(C)C[C@H]1CCC[N@H+]1CC1CCCC1 ZINC000522162372 388710316 /nfs/dbraw/zinc/71/03/16/388710316.db2.gz GSYVGILYCXIVLY-CQSZACIVSA-N 1 1 209.377 3.687 20 0 BHADMO C[N@@H+](Cc1ccccc1Cl)[C@@H]1C=CCCC1 ZINC000522208495 385925379 /nfs/dbraw/zinc/92/53/79/385925379.db2.gz QVKYJTCTMJUPEZ-CYBMUJFWSA-N 1 1 235.758 3.881 20 0 BHADMO C[N@@H+](Cc1ccccc1Cl)[C@H]1C=CCCC1 ZINC000522208496 385923688 /nfs/dbraw/zinc/92/36/88/385923688.db2.gz QVKYJTCTMJUPEZ-ZDUSSCGKSA-N 1 1 235.758 3.881 20 0 BHADMO C[N@@H+](CCC(C)(C)C)Cc1cccc(F)c1 ZINC000522208701 388721256 /nfs/dbraw/zinc/72/12/56/388721256.db2.gz BBKRNNPISSQAOQ-UHFFFAOYSA-N 1 1 223.335 3.694 20 0 BHADMO CCc1ccc(C[N@@H+](C)[C@H]2C=CCCC2)cc1 ZINC000522208725 388721912 /nfs/dbraw/zinc/72/19/12/388721912.db2.gz IDXUTCNBUPOBIY-INIZCTEOSA-N 1 1 229.367 3.790 20 0 BHADMO CCc1ccc(C[N@@H+](C)[C@@H]2C=CCCC2)cc1 ZINC000522208726 388722098 /nfs/dbraw/zinc/72/20/98/388722098.db2.gz IDXUTCNBUPOBIY-MRXNPFEDSA-N 1 1 229.367 3.790 20 0 BHADMO COc1cccc(C[N@@H+](C)CCC(C)(C)C)c1 ZINC000522208781 388721655 /nfs/dbraw/zinc/72/16/55/388721655.db2.gz URMNVWHPOUQUDZ-UHFFFAOYSA-N 1 1 235.371 3.563 20 0 BHADMO C[N@@H+](CC1CCCCC1)[C@H]1C=CCCC1 ZINC000522209037 388722041 /nfs/dbraw/zinc/72/20/41/388722041.db2.gz SIFKHGWRFHMDQP-AWEZNQCLSA-N 1 1 207.361 3.607 20 0 BHADMO C[N@@H+](CC1CCCCC1)[C@@H]1C=CCCC1 ZINC000522209038 259613994 /nfs/dbraw/zinc/61/39/94/259613994.db2.gz SIFKHGWRFHMDQP-CQSZACIVSA-N 1 1 207.361 3.607 20 0 BHADMO C[N@@H+](CCC(C)(C)C)Cc1cccs1 ZINC000522209251 388722105 /nfs/dbraw/zinc/72/21/05/388722105.db2.gz HWTDFSSEBBTFIQ-UHFFFAOYSA-N 1 1 211.374 3.616 20 0 BHADMO C[N@@H+](CCC(C)(C)C)Cc1ccc(F)cc1 ZINC000522209261 388721303 /nfs/dbraw/zinc/72/13/03/388721303.db2.gz KXVDBOYTNVYNPR-UHFFFAOYSA-N 1 1 223.335 3.694 20 0 BHADMO Cc1ccccc1C[N@H+](C)[C@H]1C=CCCC1 ZINC000522209274 388721819 /nfs/dbraw/zinc/72/18/19/388721819.db2.gz PJLJPBLQBAKGHN-HNNXBMFYSA-N 1 1 215.340 3.536 20 0 BHADMO Cc1ccccc1C[N@H+](C)[C@@H]1C=CCCC1 ZINC000522209275 388721380 /nfs/dbraw/zinc/72/13/80/388721380.db2.gz PJLJPBLQBAKGHN-OAHLLOKOSA-N 1 1 215.340 3.536 20 0 BHADMO CCOc1ccc(C[N@@H+](C)[C@H]2C=CCCC2)cc1 ZINC000522209312 388721896 /nfs/dbraw/zinc/72/18/96/388721896.db2.gz UFGXXTQFUGPNOS-HNNXBMFYSA-N 1 1 245.366 3.626 20 0 BHADMO CCOc1ccc(C[N@@H+](C)[C@@H]2C=CCCC2)cc1 ZINC000522209313 388721482 /nfs/dbraw/zinc/72/14/82/388721482.db2.gz UFGXXTQFUGPNOS-OAHLLOKOSA-N 1 1 245.366 3.626 20 0 BHADMO CC(C)CC[N@@H+](C1CC1)[C@@H]1C=CCCC1 ZINC000522209319 388721776 /nfs/dbraw/zinc/72/17/76/388721776.db2.gz XUTPRLJEIMDPOI-CYBMUJFWSA-N 1 1 207.361 3.606 20 0 BHADMO CC(C)CC[N@@H+](C1CC1)[C@H]1C=CCCC1 ZINC000522209320 388721247 /nfs/dbraw/zinc/72/12/47/388721247.db2.gz XUTPRLJEIMDPOI-ZDUSSCGKSA-N 1 1 207.361 3.606 20 0 BHADMO CCc1nc(C[N@@H+](C)CCC(C)(C)C)cs1 ZINC000522209586 388722132 /nfs/dbraw/zinc/72/21/32/388722132.db2.gz FUKIVIBGMHIJGN-UHFFFAOYSA-N 1 1 240.416 3.574 20 0 BHADMO C[C@@H]1CC[N@@H+]([C@@H]2C=CCCC2)[C@H]2CCCC[C@H]12 ZINC000522209638 388721356 /nfs/dbraw/zinc/72/13/56/388721356.db2.gz LZXUSCLQWCUJCJ-FPCVCCKLSA-N 1 1 233.399 3.996 20 0 BHADMO C[C@@H]1CC[N@@H+]([C@@H]2C=CCCC2)[C@@H]2CCCC[C@H]12 ZINC000522209639 388721644 /nfs/dbraw/zinc/72/16/44/388721644.db2.gz LZXUSCLQWCUJCJ-KLHDSHLOSA-N 1 1 233.399 3.996 20 0 BHADMO C[C@@H]1CC[N@@H+]([C@@H]2C=CCCC2)[C@@H]2CCCC[C@@H]12 ZINC000522209640 388721545 /nfs/dbraw/zinc/72/15/45/388721545.db2.gz LZXUSCLQWCUJCJ-LVQVYYBASA-N 1 1 233.399 3.996 20 0 BHADMO C[C@@H]1CC[N@@H+]([C@@H]2C=CCCC2)[C@H]2CCCC[C@@H]12 ZINC000522209641 388721993 /nfs/dbraw/zinc/72/19/93/388721993.db2.gz LZXUSCLQWCUJCJ-WCVJEAGWSA-N 1 1 233.399 3.996 20 0 BHADMO COc1ccc(C[N@@H+](C)CCC(C)(C)C)cc1 ZINC000522209687 388721753 /nfs/dbraw/zinc/72/17/53/388721753.db2.gz XSVMLLPTEKJFJW-UHFFFAOYSA-N 1 1 235.371 3.563 20 0 BHADMO CC(C)(C)C[C@@H]1CCC[N@H+]1[C@H]1C=CCCC1 ZINC000522220640 388724303 /nfs/dbraw/zinc/72/43/03/388724303.db2.gz BAUSGCJLWNWREJ-KBPBESRZSA-N 1 1 221.388 3.996 20 0 BHADMO CC(C)(C)C[C@@H]1CCC[N@H+]1[C@@H]1C=CCCC1 ZINC000522220641 388724200 /nfs/dbraw/zinc/72/42/00/388724200.db2.gz BAUSGCJLWNWREJ-KGLIPLIRSA-N 1 1 221.388 3.996 20 0 BHADMO CC(C)(C)C[C@H]1CCC[N@H+]1[C@H]1C=CCCC1 ZINC000522220642 388724325 /nfs/dbraw/zinc/72/43/25/388724325.db2.gz BAUSGCJLWNWREJ-UONOGXRCSA-N 1 1 221.388 3.996 20 0 BHADMO CC(C)(C)C[C@H]1CCC[N@H+]1[C@@H]1C=CCCC1 ZINC000522220643 388724530 /nfs/dbraw/zinc/72/45/30/388724530.db2.gz BAUSGCJLWNWREJ-ZIAGYGMSSA-N 1 1 221.388 3.996 20 0 BHADMO c1ccc([C@@H]2CC[N@H+]([C@H]3C=CCCC3)C2)cc1 ZINC000522220922 259615836 /nfs/dbraw/zinc/61/58/36/259615836.db2.gz VTPPEAJCDJUPLF-CVEARBPZSA-N 1 1 227.351 3.585 20 0 BHADMO c1ccc([C@H]2CC[N@H+]([C@H]3C=CCCC3)C2)cc1 ZINC000522220923 388724106 /nfs/dbraw/zinc/72/41/06/388724106.db2.gz VTPPEAJCDJUPLF-HOTGVXAUSA-N 1 1 227.351 3.585 20 0 BHADMO c1ccc([C@@H]2CC[N@H+]([C@@H]3C=CCCC3)C2)cc1 ZINC000522220924 388724009 /nfs/dbraw/zinc/72/40/09/388724009.db2.gz VTPPEAJCDJUPLF-HZPDHXFCSA-N 1 1 227.351 3.585 20 0 BHADMO c1ccc([C@H]2CC[N@H+]([C@@H]3C=CCCC3)C2)cc1 ZINC000522220925 388723819 /nfs/dbraw/zinc/72/38/19/388723819.db2.gz VTPPEAJCDJUPLF-JKSUJKDBSA-N 1 1 227.351 3.585 20 0 BHADMO CC(C)C[N@@H+](C1CCCC1)[C@H]1C=CCCC1 ZINC000522221542 388725753 /nfs/dbraw/zinc/72/57/53/388725753.db2.gz YFZOTZBJDZFXKP-AWEZNQCLSA-N 1 1 221.388 3.996 20 0 BHADMO CC(C)C[N@@H+](C1CCCC1)[C@@H]1C=CCCC1 ZINC000522221543 388724975 /nfs/dbraw/zinc/72/49/75/388724975.db2.gz YFZOTZBJDZFXKP-CQSZACIVSA-N 1 1 221.388 3.996 20 0 BHADMO C[N@@H+](CCC1CCCCC1)[C@H]1C=CCCC1 ZINC000522221644 259615973 /nfs/dbraw/zinc/61/59/73/259615973.db2.gz HTEFDHXUIKBCPU-HNNXBMFYSA-N 1 1 221.388 3.997 20 0 BHADMO C[N@@H+](CCC1CCCCC1)[C@@H]1C=CCCC1 ZINC000522221645 388725039 /nfs/dbraw/zinc/72/50/39/388725039.db2.gz HTEFDHXUIKBCPU-OAHLLOKOSA-N 1 1 221.388 3.997 20 0 BHADMO CC(C)[C@H]1CCC[N@@H+](CCOC(C)(C)C)CC1 ZINC000522300945 388747490 /nfs/dbraw/zinc/74/74/90/388747490.db2.gz UCRFFOREZNGFOE-AWEZNQCLSA-N 1 1 241.419 3.560 20 0 BHADMO CC(C)[C@@H]1CCC[N@@H+](CCOC(C)(C)C)CC1 ZINC000522300946 388747910 /nfs/dbraw/zinc/74/79/10/388747910.db2.gz UCRFFOREZNGFOE-CQSZACIVSA-N 1 1 241.419 3.560 20 0 BHADMO CC(C)=CC[N@@H+](C)CCC1CCCCC1 ZINC000522332565 388751303 /nfs/dbraw/zinc/75/13/03/388751303.db2.gz MEQNBPJBPHFUPC-UHFFFAOYSA-N 1 1 209.377 3.855 20 0 BHADMO COc1c(C)cc(C[N@@H+](C)CC=C(C)C)cc1C ZINC000522341897 388751561 /nfs/dbraw/zinc/75/15/61/388751561.db2.gz DHSCCGVYQMVVPD-UHFFFAOYSA-N 1 1 247.382 3.710 20 0 BHADMO CCc1ccc(CC[N@@H+]2CCC[C@@H]2CC)cc1 ZINC000522442949 388755162 /nfs/dbraw/zinc/75/51/62/388755162.db2.gz JBMRIHUORMNEHG-INIZCTEOSA-N 1 1 231.383 3.666 20 0 BHADMO CCc1ccc(CC[N@@H+]2CCC[C@H]2CC)cc1 ZINC000522442950 388755438 /nfs/dbraw/zinc/75/54/38/388755438.db2.gz JBMRIHUORMNEHG-MRXNPFEDSA-N 1 1 231.383 3.666 20 0 BHADMO CCc1ccc(CC[N@H+](CC)CC2CC2)cc1 ZINC000522443130 388755122 /nfs/dbraw/zinc/75/51/22/388755122.db2.gz RJYSQOAKJJWNFA-UHFFFAOYSA-N 1 1 231.383 3.523 20 0 BHADMO CCc1ccc(CC[N@H+](CC)C(C)C)cc1 ZINC000522447915 259632908 /nfs/dbraw/zinc/63/29/08/259632908.db2.gz GNKFBOLSUICNLF-UHFFFAOYSA-N 1 1 219.372 3.522 20 0 BHADMO CC(C)C[N@H+](Cc1ccc(F)cc1)CC1CC1 ZINC000522466294 388757274 /nfs/dbraw/zinc/75/72/74/388757274.db2.gz JVDOWZCYEKRBPF-UHFFFAOYSA-N 1 1 235.346 3.694 20 0 BHADMO CCC(CC)[N@@H+](Cc1cccc(OC)c1)C1CC1 ZINC000522472349 388756419 /nfs/dbraw/zinc/75/64/19/388756419.db2.gz NRXITOIIGVKOQI-UHFFFAOYSA-N 1 1 247.382 3.848 20 0 BHADMO CCC(CC)[N@@H+](Cc1ccccc1)C1CC1 ZINC000522472474 388757163 /nfs/dbraw/zinc/75/71/63/388757163.db2.gz TYLHQJSQIHVGEX-UHFFFAOYSA-N 1 1 217.356 3.840 20 0 BHADMO CC[N@@H+](CCc1ccc(Cl)cc1)CC1CC1 ZINC000522659319 388770385 /nfs/dbraw/zinc/77/03/85/388770385.db2.gz NWJCTZMKBTZXPR-UHFFFAOYSA-N 1 1 237.774 3.614 20 0 BHADMO CC(C)CC[N@@H+](CCc1ccc(F)cc1)C1CC1 ZINC000522660770 388771384 /nfs/dbraw/zinc/77/13/84/388771384.db2.gz OAIFJHYSHYNVIW-UHFFFAOYSA-N 1 1 249.373 3.879 20 0 BHADMO CC(C)[C@H]1CCC[N@H+]1C[C@@H](C)c1ccccc1 ZINC000522663964 388770608 /nfs/dbraw/zinc/77/06/08/388770608.db2.gz BSTRCJCFBSJTLY-GDBMZVCRSA-N 1 1 231.383 3.911 20 0 BHADMO CC(C)[C@H]1CCC[N@H+]1C[C@H](C)c1ccccc1 ZINC000522663965 388771093 /nfs/dbraw/zinc/77/10/93/388771093.db2.gz BSTRCJCFBSJTLY-GOEBONIOSA-N 1 1 231.383 3.911 20 0 BHADMO CC(C)[C@@H]1CCC[N@H+]1C[C@H](C)c1ccccc1 ZINC000522663966 388771013 /nfs/dbraw/zinc/77/10/13/388771013.db2.gz BSTRCJCFBSJTLY-HOCLYGCPSA-N 1 1 231.383 3.911 20 0 BHADMO CC(C)[C@@H]1CCC[N@H+]1C[C@@H](C)c1ccccc1 ZINC000522663967 388770938 /nfs/dbraw/zinc/77/09/38/388770938.db2.gz BSTRCJCFBSJTLY-ZBFHGGJFSA-N 1 1 231.383 3.911 20 0 BHADMO CC(C)[C@@H]1CCCC[N@H+]1[C@H]1C=CCCC1 ZINC000522710984 323082207 /nfs/dbraw/zinc/08/22/07/323082207.db2.gz GELXGTBLPSLKBW-KBPBESRZSA-N 1 1 207.361 3.606 20 0 BHADMO CC(C)[C@@H]1CCCC[N@H+]1[C@@H]1C=CCCC1 ZINC000522710985 323082168 /nfs/dbraw/zinc/08/21/68/323082168.db2.gz GELXGTBLPSLKBW-KGLIPLIRSA-N 1 1 207.361 3.606 20 0 BHADMO CC(C)[C@H]1CCCC[N@H+]1[C@H]1C=CCCC1 ZINC000522710986 323082195 /nfs/dbraw/zinc/08/21/95/323082195.db2.gz GELXGTBLPSLKBW-UONOGXRCSA-N 1 1 207.361 3.606 20 0 BHADMO CC(C)[C@H]1CCCC[N@H+]1[C@@H]1C=CCCC1 ZINC000522710987 323082226 /nfs/dbraw/zinc/08/22/26/323082226.db2.gz GELXGTBLPSLKBW-ZIAGYGMSSA-N 1 1 207.361 3.606 20 0 BHADMO CCc1ccc(C[N@@H+](C)[C@H](C)C(C)C)cc1 ZINC000522711045 323082145 /nfs/dbraw/zinc/08/21/45/323082145.db2.gz ILUFEAACXGBIOB-CYBMUJFWSA-N 1 1 219.372 3.725 20 0 BHADMO CCc1ccc(C[N@@H+](C)[C@@H](C)C(C)C)cc1 ZINC000522711046 323082178 /nfs/dbraw/zinc/08/21/78/323082178.db2.gz ILUFEAACXGBIOB-ZDUSSCGKSA-N 1 1 219.372 3.725 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)Cc1ccc(CC)cc1 ZINC000522711168 323082149 /nfs/dbraw/zinc/08/21/49/323082149.db2.gz OLCFXEMDCNCRQM-CYBMUJFWSA-N 1 1 219.372 3.869 20 0 BHADMO CCC[C@H](C)[N@@H+](C)Cc1ccc(CC)cc1 ZINC000522711169 323082228 /nfs/dbraw/zinc/08/22/28/323082228.db2.gz OLCFXEMDCNCRQM-ZDUSSCGKSA-N 1 1 219.372 3.869 20 0 BHADMO CC[C@@H]1CCC[N@@H+](Cc2ccc(F)cc2)CC1 ZINC000522711691 323082181 /nfs/dbraw/zinc/08/21/81/323082181.db2.gz LUKNIOCKCZHUFS-CYBMUJFWSA-N 1 1 235.346 3.838 20 0 BHADMO CC[C@H]1CCC[N@@H+](Cc2ccc(F)cc2)CC1 ZINC000522711692 323082212 /nfs/dbraw/zinc/08/22/12/323082212.db2.gz LUKNIOCKCZHUFS-ZDUSSCGKSA-N 1 1 235.346 3.838 20 0 BHADMO CC(C)CCOCC[N@H+]1CCCC[C@H]1C(C)C ZINC000522711721 323082188 /nfs/dbraw/zinc/08/21/88/323082188.db2.gz MMXUSHOLQMARDD-HNNXBMFYSA-N 1 1 241.419 3.560 20 0 BHADMO CC(C)CCOCC[N@H+]1CCCC[C@@H]1C(C)C ZINC000522711722 323082203 /nfs/dbraw/zinc/08/22/03/323082203.db2.gz MMXUSHOLQMARDD-OAHLLOKOSA-N 1 1 241.419 3.560 20 0 BHADMO CCc1ccc(C[N@H+](C)C[C@H](C)CC)cc1 ZINC000522712150 259375928 /nfs/dbraw/zinc/37/59/28/259375928.db2.gz FCEKJGYXWPJWCT-CYBMUJFWSA-N 1 1 219.372 3.727 20 0 BHADMO CCc1ccc(C[N@H+](C)C[C@@H](C)CC)cc1 ZINC000522712151 259376081 /nfs/dbraw/zinc/37/60/81/259376081.db2.gz FCEKJGYXWPJWCT-ZDUSSCGKSA-N 1 1 219.372 3.727 20 0 BHADMO CCc1ccc(C[N@@H+](C)C(C2CC2)C2CC2)cc1 ZINC000522712776 259375944 /nfs/dbraw/zinc/37/59/44/259375944.db2.gz DLLFWWCMLTZWGK-UHFFFAOYSA-N 1 1 243.394 3.869 20 0 BHADMO CC[C@H]1CCC[N@H+]([C@H]2C=CCCC2)CC1 ZINC000522713081 323082175 /nfs/dbraw/zinc/08/21/75/323082175.db2.gz QPNVYHUSJFOFGH-KBPBESRZSA-N 1 1 207.361 3.607 20 0 BHADMO CC[C@@H]1CCC[N@H+]([C@H]2C=CCCC2)CC1 ZINC000522713082 323082142 /nfs/dbraw/zinc/08/21/42/323082142.db2.gz QPNVYHUSJFOFGH-KGLIPLIRSA-N 1 1 207.361 3.607 20 0 BHADMO CC[C@H]1CCC[N@H+]([C@@H]2C=CCCC2)CC1 ZINC000522713083 323082170 /nfs/dbraw/zinc/08/21/70/323082170.db2.gz QPNVYHUSJFOFGH-UONOGXRCSA-N 1 1 207.361 3.607 20 0 BHADMO CC[C@@H]1CCC[N@H+]([C@@H]2C=CCCC2)CC1 ZINC000522713084 323082210 /nfs/dbraw/zinc/08/22/10/323082210.db2.gz QPNVYHUSJFOFGH-ZIAGYGMSSA-N 1 1 207.361 3.607 20 0 BHADMO CC[C@H]1CCC[N@@H+](Cc2cccc(OC)c2)CC1 ZINC000522713160 323082152 /nfs/dbraw/zinc/08/21/52/323082152.db2.gz SRKCPJOOGATPBL-AWEZNQCLSA-N 1 1 247.382 3.707 20 0 BHADMO CC[C@@H]1CCC[N@@H+](Cc2cccc(OC)c2)CC1 ZINC000522713161 323082156 /nfs/dbraw/zinc/08/21/56/323082156.db2.gz SRKCPJOOGATPBL-CQSZACIVSA-N 1 1 247.382 3.707 20 0 BHADMO CC[C@H]1CCC[N@@H+](CCOCCC(C)C)CC1 ZINC000522713447 259376159 /nfs/dbraw/zinc/37/61/59/259376159.db2.gz CJZZGGRKTIYBLP-HNNXBMFYSA-N 1 1 241.419 3.561 20 0 BHADMO CC[C@@H]1CCC[N@@H+](CCOCCC(C)C)CC1 ZINC000522713448 259375877 /nfs/dbraw/zinc/37/58/77/259375877.db2.gz CJZZGGRKTIYBLP-OAHLLOKOSA-N 1 1 241.419 3.561 20 0 BHADMO CCc1ccc(C[N@@H+](C)CC(C)(C)C)cc1 ZINC000522713851 259375914 /nfs/dbraw/zinc/37/59/14/259375914.db2.gz UHENLJRVMCQMPC-UHFFFAOYSA-N 1 1 219.372 3.727 20 0 BHADMO CCc1ccc(C[N@H+]2CCCC[C@H]2C)cc1 ZINC000522713962 259375815 /nfs/dbraw/zinc/37/58/15/259375815.db2.gz YRGOBGCPCKOMCJ-CYBMUJFWSA-N 1 1 217.356 3.623 20 0 BHADMO CCc1ccc(C[N@H+]2CCCC[C@@H]2C)cc1 ZINC000522713963 259375773 /nfs/dbraw/zinc/37/57/73/259375773.db2.gz YRGOBGCPCKOMCJ-ZDUSSCGKSA-N 1 1 217.356 3.623 20 0 BHADMO CCCCC[N@@H+](C)[C@H]1CCc2ccccc21 ZINC000522775434 350004635 /nfs/dbraw/zinc/00/46/35/350004635.db2.gz VFZBVGXMSXUEQR-HNNXBMFYSA-N 1 1 217.356 3.796 20 0 BHADMO CCCCC[N@@H+](C)[C@@H]1CCc2ccccc21 ZINC000522775435 350004559 /nfs/dbraw/zinc/00/45/59/350004559.db2.gz VFZBVGXMSXUEQR-OAHLLOKOSA-N 1 1 217.356 3.796 20 0 BHADMO CCCCC[N@@H+](Cc1cccs1)C1CC1 ZINC000522776311 323091868 /nfs/dbraw/zinc/09/18/68/323091868.db2.gz ZHCVLYCXJCZTFQ-UHFFFAOYSA-N 1 1 223.385 3.903 20 0 BHADMO CCCCC[N@H+]1CCc2sccc2[C@H]1C ZINC000522776567 385868001 /nfs/dbraw/zinc/86/80/01/385868001.db2.gz NZIKLPHNENNXBB-LLVKDONJSA-N 1 1 223.385 3.857 20 0 BHADMO CCCCC[N@H+]1CCc2sccc2[C@@H]1C ZINC000522776568 385868897 /nfs/dbraw/zinc/86/88/97/385868897.db2.gz NZIKLPHNENNXBB-NSHDSACASA-N 1 1 223.385 3.857 20 0 BHADMO CCCCC[N@H+](Cc1cccc(O)c1)CC1CC1 ZINC000522776848 350011510 /nfs/dbraw/zinc/01/15/10/350011510.db2.gz BILZXNRUPAYUCR-UHFFFAOYSA-N 1 1 247.382 3.794 20 0 BHADMO CCC[N@H+](Cc1ccc(F)c(F)c1)CC(C)C ZINC000522776965 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388850595 /nfs/dbraw/zinc/85/05/95/388850595.db2.gz SJVBUSFWYWZOSR-NSHDSACASA-N 1 1 209.377 3.686 20 0 BHADMO CC(C)=CC[N@@H+](CCc1cccc(F)c1)C1CC1 ZINC000523669728 388849632 /nfs/dbraw/zinc/84/96/32/388849632.db2.gz OQEWILVSNSZOAB-UHFFFAOYSA-N 1 1 247.357 3.799 20 0 BHADMO CC(C)=CC[N@H+]1CCC[C@@]2(CC=CCC2)C1 ZINC000523701371 259656808 /nfs/dbraw/zinc/65/68/08/259656808.db2.gz JXNMJAXZUOCUFV-HNNXBMFYSA-N 1 1 219.372 3.775 20 0 BHADMO CC(C)=CC[N@H+]1CCC[C@]2(CC=CCC2)C1 ZINC000523701372 259656652 /nfs/dbraw/zinc/65/66/52/259656652.db2.gz JXNMJAXZUOCUFV-OAHLLOKOSA-N 1 1 219.372 3.775 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)Cc1ccc2c(c1)CCC2 ZINC000523776129 388859739 /nfs/dbraw/zinc/85/97/39/388859739.db2.gz RNDNEESZYCYJNI-CYBMUJFWSA-N 1 1 231.383 3.796 20 0 BHADMO CCC[C@H](C)[N@@H+](C)Cc1ccc2c(c1)CCC2 ZINC000523776130 388859902 /nfs/dbraw/zinc/85/99/02/388859902.db2.gz RNDNEESZYCYJNI-ZDUSSCGKSA-N 1 1 231.383 3.796 20 0 BHADMO CC[C@@H](C)C[N@@H+](C)Cc1ccc2c(c1)CCC2 ZINC000523776581 388859725 /nfs/dbraw/zinc/85/97/25/388859725.db2.gz HGYDFDGEPGBWPP-CYBMUJFWSA-N 1 1 231.383 3.653 20 0 BHADMO CC[C@H](C)C[N@@H+](C)Cc1ccc2c(c1)CCC2 ZINC000523776582 388858936 /nfs/dbraw/zinc/85/89/36/388858936.db2.gz HGYDFDGEPGBWPP-ZDUSSCGKSA-N 1 1 231.383 3.653 20 0 BHADMO CC[N@H+](Cc1ccc2c(c1)CCC2)CC(C)C ZINC000523778205 388858927 /nfs/dbraw/zinc/85/89/27/388858927.db2.gz KEQYBWXUAQCQNC-UHFFFAOYSA-N 1 1 231.383 3.653 20 0 BHADMO CC(C)=CC[N@@H+]1C[C@H](c2ccccc2)C[C@H]1C ZINC000523788831 259658966 /nfs/dbraw/zinc/65/89/66/259658966.db2.gz NVWCLPDNMBOHKU-GDBMZVCRSA-N 1 1 229.367 3.831 20 0 BHADMO CC(C)=CC[N@@H+]1C[C@H](c2ccccc2)C[C@@H]1C ZINC000523788832 388860123 /nfs/dbraw/zinc/86/01/23/388860123.db2.gz NVWCLPDNMBOHKU-GOEBONIOSA-N 1 1 229.367 3.831 20 0 BHADMO CC(C)=CC[N@@H+]1C[C@@H](c2ccccc2)C[C@@H]1C ZINC000523788833 388858996 /nfs/dbraw/zinc/85/89/96/388858996.db2.gz NVWCLPDNMBOHKU-HOCLYGCPSA-N 1 1 229.367 3.831 20 0 BHADMO CC(C)=CC[N@@H+]1C[C@@H](c2ccccc2)C[C@H]1C ZINC000523788834 388859331 /nfs/dbraw/zinc/85/93/31/388859331.db2.gz NVWCLPDNMBOHKU-ZBFHGGJFSA-N 1 1 229.367 3.831 20 0 BHADMO CC(C)C[N@H+]1C[C@H](c2ccccc2)C[C@@H]1C ZINC000523789243 388860056 /nfs/dbraw/zinc/86/00/56/388860056.db2.gz CQYCTAIAPUSVQC-DZGCQCFKSA-N 1 1 217.356 3.520 20 0 BHADMO CC(C)C[N@H+]1C[C@@H](c2ccccc2)C[C@H]1C ZINC000523789245 259658609 /nfs/dbraw/zinc/65/86/09/259658609.db2.gz CQYCTAIAPUSVQC-HIFRSBDPSA-N 1 1 217.356 3.520 20 0 BHADMO CC(C)C[N@H+]1C[C@H](c2ccccc2)C[C@H]1C ZINC000523789247 388859253 /nfs/dbraw/zinc/85/92/53/388859253.db2.gz CQYCTAIAPUSVQC-UKRRQHHQSA-N 1 1 217.356 3.520 20 0 BHADMO CC(C)C[N@H+]1C[C@@H](c2ccccc2)C[C@@H]1C ZINC000523789249 388859326 /nfs/dbraw/zinc/85/93/26/388859326.db2.gz CQYCTAIAPUSVQC-ZFWWWQNUSA-N 1 1 217.356 3.520 20 0 BHADMO CC(C)CC[N@H+]1CCSC[C@H]1c1ccccc1 ZINC000523791647 388858912 /nfs/dbraw/zinc/85/89/12/388858912.db2.gz KHLVLDJZLIXCTR-HNNXBMFYSA-N 1 1 249.423 3.823 20 0 BHADMO CC(C)CC[N@H+]1CCSC[C@@H]1c1ccccc1 ZINC000523791648 388859271 /nfs/dbraw/zinc/85/92/71/388859271.db2.gz KHLVLDJZLIXCTR-OAHLLOKOSA-N 1 1 249.423 3.823 20 0 BHADMO CCCC[N@H+](Cc1ccc(F)cc1)CC1CC1 ZINC000523791982 388859095 /nfs/dbraw/zinc/85/90/95/388859095.db2.gz ZSFNUEOFISDMRT-UHFFFAOYSA-N 1 1 235.346 3.838 20 0 BHADMO CCC[N@H+](Cc1cccnc1)CC1CCCCC1 ZINC000523841042 388861095 /nfs/dbraw/zinc/86/10/95/388861095.db2.gz GEVYKMOTTUFZNJ-UHFFFAOYSA-N 1 1 246.398 3.874 20 0 BHADMO CCCC[N@H+]1CCSC[C@H]1c1ccc(C)cc1 ZINC000523862576 388862015 /nfs/dbraw/zinc/86/20/15/388862015.db2.gz WVDMFCFKUIDLJR-HNNXBMFYSA-N 1 1 249.423 3.885 20 0 BHADMO CCCC[N@H+]1CCSC[C@@H]1c1ccc(C)cc1 ZINC000523862577 388863009 /nfs/dbraw/zinc/86/30/09/388863009.db2.gz WVDMFCFKUIDLJR-OAHLLOKOSA-N 1 1 249.423 3.885 20 0 BHADMO C[N@@H+](C/C=C/c1ccccc1)CC(C)(C)C ZINC000524026727 259661934 /nfs/dbraw/zinc/66/19/34/259661934.db2.gz IZOWBLCCGJHCPC-DHZHZOJOSA-N 1 1 217.356 3.678 20 0 BHADMO C[N@@H+](C/C=C\c1ccccc1)CC(C)(C)C ZINC000524026730 388346172 /nfs/dbraw/zinc/34/61/72/388346172.db2.gz IZOWBLCCGJHCPC-FLIBITNWSA-N 1 1 217.356 3.678 20 0 BHADMO C[N@@H+](Cc1cccc(Cl)c1)CC(C)(C)C ZINC000524026972 388345977 /nfs/dbraw/zinc/34/59/77/388345977.db2.gz UXYXOQDOTBMKJP-UHFFFAOYSA-N 1 1 225.763 3.818 20 0 BHADMO CCC[N@@H+](CC)Cc1cc(C)nc2ccccc12 ZINC000524081960 388347006 /nfs/dbraw/zinc/34/70/06/388347006.db2.gz JXSDSQYKYAMVPG-UHFFFAOYSA-N 1 1 242.366 3.775 20 0 BHADMO CCCC[N@H+]1CCC[C@H]1Cc1cccc(F)c1 ZINC000524156106 388348633 /nfs/dbraw/zinc/34/86/33/388348633.db2.gz JCVKMDLUKKKMNQ-HNNXBMFYSA-N 1 1 235.346 3.633 20 0 BHADMO CCCC[N@H+]1CCC[C@@H]1Cc1cccc(F)c1 ZINC000524156107 388348625 /nfs/dbraw/zinc/34/86/25/388348625.db2.gz JCVKMDLUKKKMNQ-OAHLLOKOSA-N 1 1 235.346 3.633 20 0 BHADMO CCCC[N@@H+](CCC)Cc1ccc(F)cc1 ZINC000524156118 388348130 /nfs/dbraw/zinc/34/81/30/388348130.db2.gz KPEMDASFONQJHB-UHFFFAOYSA-N 1 1 223.335 3.838 20 0 BHADMO CC[N@@H+](CCCOC(C)C)Cc1ccc(C)cc1 ZINC000524156144 259663228 /nfs/dbraw/zinc/66/32/28/259663228.db2.gz MVMACMYYIVUFSE-UHFFFAOYSA-N 1 1 249.398 3.632 20 0 BHADMO CCCC[N@H+]1CCC[C@H]1Cc1ccccc1OC ZINC000524156285 388348404 /nfs/dbraw/zinc/34/84/04/388348404.db2.gz JXXYOEUKARLLBY-HNNXBMFYSA-N 1 1 247.382 3.502 20 0 BHADMO CCCC[N@H+]1CCC[C@H]1C1CCCCC1 ZINC000524156839 388348462 /nfs/dbraw/zinc/34/84/62/388348462.db2.gz IWYVMQREXINOCF-AWEZNQCLSA-N 1 1 209.377 3.831 20 0 BHADMO CCCC[N@H+]1CCC[C@@H]1C1CCCCC1 ZINC000524156840 388348468 /nfs/dbraw/zinc/34/84/68/388348468.db2.gz IWYVMQREXINOCF-CQSZACIVSA-N 1 1 209.377 3.831 20 0 BHADMO CCCC[N@H+]1CCC[C@H]1c1cccc(F)c1 ZINC000524156902 384518394 /nfs/dbraw/zinc/51/83/94/384518394.db2.gz BZGBNCGEGJXVQM-AWEZNQCLSA-N 1 1 221.319 3.763 20 0 BHADMO CCCC[N@H+]1CCC[C@@H]1c1cccc(F)c1 ZINC000524156903 384517650 /nfs/dbraw/zinc/51/76/50/384517650.db2.gz BZGBNCGEGJXVQM-CQSZACIVSA-N 1 1 221.319 3.763 20 0 BHADMO CCCC[N@@H+](C)CCCCc1ccccc1 ZINC000524156910 388348366 /nfs/dbraw/zinc/34/83/66/388348366.db2.gz HALNHULQNHDUKT-UHFFFAOYSA-N 1 1 219.372 3.741 20 0 BHADMO CCCC[N@@H+](C)[C@@H](C)c1cc(F)ccc1F ZINC000524156919 388347930 /nfs/dbraw/zinc/34/79/30/388347930.db2.gz RGEDEMGUUBSKKD-JTQLQIEISA-N 1 1 227.298 3.758 20 0 BHADMO CCCC[N@@H+](C)[C@H](C)c1cc(F)ccc1F ZINC000524156920 388347947 /nfs/dbraw/zinc/34/79/47/388347947.db2.gz RGEDEMGUUBSKKD-SNVBAGLBSA-N 1 1 227.298 3.758 20 0 BHADMO CCCC[N@H+]1CCC[C@H]1Cc1cccc(OC)c1 ZINC000524156929 388347897 /nfs/dbraw/zinc/34/78/97/388347897.db2.gz WUSNMYOHMYGZKJ-HNNXBMFYSA-N 1 1 247.382 3.502 20 0 BHADMO CCCC[N@H+]1CCC[C@@H]1Cc1cccc(OC)c1 ZINC000524156930 388347989 /nfs/dbraw/zinc/34/79/89/388347989.db2.gz WUSNMYOHMYGZKJ-OAHLLOKOSA-N 1 1 247.382 3.502 20 0 BHADMO CCCC[N@H+]1CCC[C@@H]1c1ccc(C)cc1 ZINC000524156947 388348296 /nfs/dbraw/zinc/34/82/96/388348296.db2.gz JXPMPEZNQVZPTD-OAHLLOKOSA-N 1 1 217.356 3.932 20 0 BHADMO CCCC[N@@H+](C)[C@@H](C)c1c(F)cccc1F ZINC000524156957 388348204 /nfs/dbraw/zinc/34/82/04/388348204.db2.gz PVKDTEPXHXKXPB-JTQLQIEISA-N 1 1 227.298 3.758 20 0 BHADMO CCCC[N@@H+](C)[C@H](C)c1c(F)cccc1F ZINC000524156958 388348288 /nfs/dbraw/zinc/34/82/88/388348288.db2.gz PVKDTEPXHXKXPB-SNVBAGLBSA-N 1 1 227.298 3.758 20 0 BHADMO CCCC[N@@H+](C)[C@H](C)c1ccccc1C ZINC000524156965 388348450 /nfs/dbraw/zinc/34/84/50/388348450.db2.gz VHOWEGAXPWSHEQ-CYBMUJFWSA-N 1 1 205.345 3.788 20 0 BHADMO CCCC[N@@H+](C)[C@@H](C)c1ccccc1C ZINC000524156966 259663307 /nfs/dbraw/zinc/66/33/07/259663307.db2.gz VHOWEGAXPWSHEQ-ZDUSSCGKSA-N 1 1 205.345 3.788 20 0 BHADMO CC[N@@H+](CCc1cccs1)[C@@H]1C=CCCC1 ZINC000524175746 259664098 /nfs/dbraw/zinc/66/40/98/259664098.db2.gz QKAPHULWRNUNBZ-CYBMUJFWSA-N 1 1 235.396 3.721 20 0 BHADMO CC[N@@H+](CCc1cccs1)[C@H]1C=CCCC1 ZINC000524175750 388349017 /nfs/dbraw/zinc/34/90/17/388349017.db2.gz QKAPHULWRNUNBZ-ZDUSSCGKSA-N 1 1 235.396 3.721 20 0 BHADMO Cc1cccc(C)c1C[N@@H+]1CCCC[C@@H]1C ZINC000524251995 388353092 /nfs/dbraw/zinc/35/30/92/388353092.db2.gz WSJMMKPIVVLRFX-AWEZNQCLSA-N 1 1 217.356 3.678 20 0 BHADMO Cc1cccc(C)c1C[N@@H+]1CCCC[C@H]1C ZINC000524251996 388353555 /nfs/dbraw/zinc/35/35/55/388353555.db2.gz WSJMMKPIVVLRFX-CQSZACIVSA-N 1 1 217.356 3.678 20 0 BHADMO CC[N@H+](Cc1cccc(OC(C)C)c1)CC1CC1 ZINC000524277598 388353942 /nfs/dbraw/zinc/35/39/42/388353942.db2.gz NJVHXQVZZYDFJO-UHFFFAOYSA-N 1 1 247.382 3.706 20 0 BHADMO CC[N@H+](Cc1cc(C)cc(C)c1)CC1CC1 ZINC000524277614 388354253 /nfs/dbraw/zinc/35/42/53/388354253.db2.gz TYQMWSKQFJQKSL-UHFFFAOYSA-N 1 1 217.356 3.535 20 0 BHADMO CCCCOCC[N@@H+](C)C[C@H](C)c1ccccc1 ZINC000524307673 388355504 /nfs/dbraw/zinc/35/55/04/388355504.db2.gz OQTYQHKJRPXKGG-HNNXBMFYSA-N 1 1 249.398 3.539 20 0 BHADMO CCCCOCC[N@@H+](C)C[C@@H](C)c1ccccc1 ZINC000524307674 388355095 /nfs/dbraw/zinc/35/50/95/388355095.db2.gz OQTYQHKJRPXKGG-OAHLLOKOSA-N 1 1 249.398 3.539 20 0 BHADMO C[C@@H](C[N@@H+](C)CC1CCCC1)c1ccccc1 ZINC000524309933 388355753 /nfs/dbraw/zinc/35/57/53/388355753.db2.gz NYWCOPGFWZXXPV-AWEZNQCLSA-N 1 1 231.383 3.912 20 0 BHADMO C[C@H](C[N@@H+](C)CC1CCCC1)c1ccccc1 ZINC000524309934 388355147 /nfs/dbraw/zinc/35/51/47/388355147.db2.gz NYWCOPGFWZXXPV-CQSZACIVSA-N 1 1 231.383 3.912 20 0 BHADMO CC(C)=CC[N@@H+](CC1CC1)C1CCCCC1 ZINC000524367239 388356178 /nfs/dbraw/zinc/35/61/78/388356178.db2.gz QRKDAKWVSGYCHX-UHFFFAOYSA-N 1 1 221.388 3.997 20 0 BHADMO C[N@@H+](CCCC(C)(C)C)Cc1cccc(O)c1 ZINC000524457824 388361857 /nfs/dbraw/zinc/36/18/57/388361857.db2.gz BPJDZUGBJLPOKO-UHFFFAOYSA-N 1 1 235.371 3.650 20 0 BHADMO CC(C)=CC[N@@H+]1CCC[C@H](C(C)C)CC1 ZINC000524483515 388363628 /nfs/dbraw/zinc/36/36/28/388363628.db2.gz XCWYUMLBOXGBSM-AWEZNQCLSA-N 1 1 209.377 3.711 20 0 BHADMO CC(C)=CC[N@@H+]1CCC[C@@H](C(C)C)CC1 ZINC000524483516 388363388 /nfs/dbraw/zinc/36/33/88/388363388.db2.gz XCWYUMLBOXGBSM-CQSZACIVSA-N 1 1 209.377 3.711 20 0 BHADMO Cc1cccc(C)c1C[N@H+](C(C)C)C1CC1 ZINC000524591281 388367689 /nfs/dbraw/zinc/36/76/89/388367689.db2.gz CAVSFQQPHQFIBS-UHFFFAOYSA-N 1 1 217.356 3.676 20 0 BHADMO Cc1cccc(C)c1C[N@@H+]1CCS[C@@H](C)[C@@H]1C ZINC000524595281 388367060 /nfs/dbraw/zinc/36/70/60/388367060.db2.gz HEZVXSDYGHCRQL-KBPBESRZSA-N 1 1 249.423 3.629 20 0 BHADMO Cc1cccc(C)c1C[N@@H+]1CCS[C@@H](C)[C@H]1C ZINC000524595282 388367152 /nfs/dbraw/zinc/36/71/52/388367152.db2.gz HEZVXSDYGHCRQL-KGLIPLIRSA-N 1 1 249.423 3.629 20 0 BHADMO Cc1cccc(C)c1C[N@@H+]1CCS[C@H](C)[C@@H]1C ZINC000524595283 388367508 /nfs/dbraw/zinc/36/75/08/388367508.db2.gz HEZVXSDYGHCRQL-UONOGXRCSA-N 1 1 249.423 3.629 20 0 BHADMO Cc1cccc(C)c1C[N@@H+]1CCS[C@H](C)[C@H]1C ZINC000524595284 388367603 /nfs/dbraw/zinc/36/76/03/388367603.db2.gz HEZVXSDYGHCRQL-ZIAGYGMSSA-N 1 1 249.423 3.629 20 0 BHADMO CC[N@@H+](CCCOc1ccccc1C)C1CCC1 ZINC000524595432 388367743 /nfs/dbraw/zinc/36/77/43/388367743.db2.gz KGFRZSIAVJTMEK-UHFFFAOYSA-N 1 1 247.382 3.638 20 0 BHADMO CC(C)=CC[N@H+](C)[C@@H](C)Cc1ccc(C)cc1 ZINC000524595860 388367433 /nfs/dbraw/zinc/36/74/33/388367433.db2.gz XGUCQTJSJIVGSD-HNNXBMFYSA-N 1 1 231.383 3.824 20 0 BHADMO CC(C)=CC[N@H+](C)[C@H](C)Cc1ccc(C)cc1 ZINC000524595861 388367674 /nfs/dbraw/zinc/36/76/74/388367674.db2.gz XGUCQTJSJIVGSD-OAHLLOKOSA-N 1 1 231.383 3.824 20 0 BHADMO CC[N@@H+](Cc1c(F)cccc1Cl)C1CCC1 ZINC000524596399 388367272 /nfs/dbraw/zinc/36/72/72/388367272.db2.gz BWXAHGBVWGAOKY-UHFFFAOYSA-N 1 1 241.737 3.854 20 0 BHADMO CC[N@H+](Cc1c(F)cccc1Cl)C1CCC1 ZINC000524596399 388367270 /nfs/dbraw/zinc/36/72/70/388367270.db2.gz BWXAHGBVWGAOKY-UHFFFAOYSA-N 1 1 241.737 3.854 20 0 BHADMO CC[C@H]1CCCCC[N@H+]1Cc1ccccc1 ZINC000524608227 388679445 /nfs/dbraw/zinc/67/94/45/388679445.db2.gz PABKHZCTBFTAAO-HNNXBMFYSA-N 1 1 217.356 3.841 20 0 BHADMO CC[C@@H]1CCCCC[N@H+]1Cc1ccccc1 ZINC000524608228 387896433 /nfs/dbraw/zinc/89/64/33/387896433.db2.gz PABKHZCTBFTAAO-OAHLLOKOSA-N 1 1 217.356 3.841 20 0 BHADMO CC[C@H]1CCCCC[N@H+]1CCOc1ccccc1 ZINC000524610227 388368857 /nfs/dbraw/zinc/36/88/57/388368857.db2.gz VYEPLXCRDGIYHM-HNNXBMFYSA-N 1 1 247.382 3.720 20 0 BHADMO CC[C@@H]1CCCCC[N@H+]1CCOc1ccccc1 ZINC000524610229 388368311 /nfs/dbraw/zinc/36/83/11/388368311.db2.gz VYEPLXCRDGIYHM-OAHLLOKOSA-N 1 1 247.382 3.720 20 0 BHADMO C[C@@H](C[N@H+]1C[C@H](C)C[C@H]1C)c1ccccc1 ZINC000524620077 388368169 /nfs/dbraw/zinc/36/81/69/388368169.db2.gz UJYGYYZDOLNLDL-HZSPNIEDSA-N 1 1 217.356 3.520 20 0 BHADMO C[C@H](C[N@H+]1C[C@H](C)C[C@@H]1C)c1ccccc1 ZINC000524620078 388368537 /nfs/dbraw/zinc/36/85/37/388368537.db2.gz UJYGYYZDOLNLDL-MCIONIFRSA-N 1 1 217.356 3.520 20 0 BHADMO C[C@H](C[N@H+]1C[C@H](C)C[C@H]1C)c1ccccc1 ZINC000524620079 388368609 /nfs/dbraw/zinc/36/86/09/388368609.db2.gz UJYGYYZDOLNLDL-MGPQQGTHSA-N 1 1 217.356 3.520 20 0 BHADMO C[C@@H](C[N@H+]1C[C@H](C)C[C@@H]1C)c1ccccc1 ZINC000524620080 388368425 /nfs/dbraw/zinc/36/84/25/388368425.db2.gz UJYGYYZDOLNLDL-RDBSUJKOSA-N 1 1 217.356 3.520 20 0 BHADMO CC(C)C[N@H+]1CCC[C@@H](Cc2ccccc2)C1 ZINC000524669157 388372257 /nfs/dbraw/zinc/37/22/57/388372257.db2.gz RLMKHWQPKSDXAQ-INIZCTEOSA-N 1 1 231.383 3.597 20 0 BHADMO CC(C)C[N@H+]1CCC[C@H](Cc2ccccc2)C1 ZINC000524669158 388371791 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ZINC000524907216 388412661 /nfs/dbraw/zinc/41/26/61/388412661.db2.gz JCQAEZIMMDEYNE-UHFFFAOYSA-N 1 1 241.419 3.704 20 0 BHADMO CCSCC[N@@H+]([C@@H](C)[C@H](C)CC)C1CC1 ZINC000525110537 388417323 /nfs/dbraw/zinc/41/73/23/388417323.db2.gz SJZZALFMFBDRKA-NEPJUHHUSA-N 1 1 229.433 3.639 20 0 BHADMO CCSCC[N@@H+]([C@H](C)[C@@H](C)CC)C1CC1 ZINC000525110538 388416681 /nfs/dbraw/zinc/41/66/81/388416681.db2.gz SJZZALFMFBDRKA-NWDGAFQWSA-N 1 1 229.433 3.639 20 0 BHADMO CCSCC[N@@H+]([C@@H](C)[C@@H](C)CC)C1CC1 ZINC000525110539 388416723 /nfs/dbraw/zinc/41/67/23/388416723.db2.gz SJZZALFMFBDRKA-RYUDHWBXSA-N 1 1 229.433 3.639 20 0 BHADMO CCSCC[N@@H+]([C@H](C)[C@H](C)CC)C1CC1 ZINC000525110540 388416513 /nfs/dbraw/zinc/41/65/13/388416513.db2.gz SJZZALFMFBDRKA-VXGBXAGGSA-N 1 1 229.433 3.639 20 0 BHADMO C[N@@H+](CCC1CCCC1)CC1CCCC1 ZINC000525119432 388416508 /nfs/dbraw/zinc/41/65/08/388416508.db2.gz GMVBXIVQOVLFHK-UHFFFAOYSA-N 1 1 209.377 3.689 20 0 BHADMO COc1cccc(CCC[N@@H+](C)[C@@H](C)C(C)C)c1 ZINC000525119476 388416383 /nfs/dbraw/zinc/41/63/83/388416383.db2.gz JEQMTUZAVMZVSF-AWEZNQCLSA-N 1 1 249.398 3.604 20 0 BHADMO COc1cccc(CCC[N@@H+](C)[C@H](C)C(C)C)c1 ZINC000525119477 388417039 /nfs/dbraw/zinc/41/70/39/388417039.db2.gz JEQMTUZAVMZVSF-CQSZACIVSA-N 1 1 249.398 3.604 20 0 BHADMO CC[N@@H+](CCC1CCCC1)[C@H](C)C(C)C ZINC000525119546 388416996 /nfs/dbraw/zinc/41/69/96/388416996.db2.gz NFXUACQEKQVFCE-CYBMUJFWSA-N 1 1 211.393 3.933 20 0 BHADMO CC[N@@H+](CCC1CCCC1)[C@@H](C)C(C)C ZINC000525119547 259695598 /nfs/dbraw/zinc/69/55/98/259695598.db2.gz NFXUACQEKQVFCE-ZDUSSCGKSA-N 1 1 211.393 3.933 20 0 BHADMO COc1cccc(CCC[N@@H+](C)CC(C)(C)C)c1 ZINC000525119738 388416794 /nfs/dbraw/zinc/41/67/94/388416794.db2.gz ICJLECNSTYEPMI-UHFFFAOYSA-N 1 1 249.398 3.606 20 0 BHADMO CC[N@@H+](Cc1cc(Cl)ccc1Cl)C1CC1 ZINC000525119899 388416835 /nfs/dbraw/zinc/41/68/35/388416835.db2.gz YOVYMKCQUVDCCP-UHFFFAOYSA-N 1 1 244.165 3.978 20 0 BHADMO CCSCC[N@H+]1CC[C@H](C)[C@H]2CCCC[C@H]21 ZINC000525119918 388416984 /nfs/dbraw/zinc/41/69/84/388416984.db2.gz ATTSDTJQCNBDPF-BFHYXJOUSA-N 1 1 241.444 3.640 20 0 BHADMO CCSCC[N@H+]1CC[C@H](C)[C@@H]2CCCC[C@@H]21 ZINC000525119919 388416990 /nfs/dbraw/zinc/41/69/90/388416990.db2.gz ATTSDTJQCNBDPF-IHRRRGAJSA-N 1 1 241.444 3.640 20 0 BHADMO CCSCC[N@H+]1CC[C@H](C)[C@@H]2CCCC[C@H]21 ZINC000525119920 388416898 /nfs/dbraw/zinc/41/68/98/388416898.db2.gz ATTSDTJQCNBDPF-MELADBBJSA-N 1 1 241.444 3.640 20 0 BHADMO CCSCC[N@H+]1CC[C@H](C)[C@H]2CCCC[C@@H]21 ZINC000525119921 388416869 /nfs/dbraw/zinc/41/68/69/388416869.db2.gz ATTSDTJQCNBDPF-MJBXVCDLSA-N 1 1 241.444 3.640 20 0 BHADMO CC[C@H]1CCCC[N@H+]1CCC1CCCC1 ZINC000525120059 388416518 /nfs/dbraw/zinc/41/65/18/388416518.db2.gz PYGDRCULVNBGHM-AWEZNQCLSA-N 1 1 209.377 3.831 20 0 BHADMO CC[C@@H]1CCCC[N@H+]1CCC1CCCC1 ZINC000525120060 388416826 /nfs/dbraw/zinc/41/68/26/388416826.db2.gz PYGDRCULVNBGHM-CQSZACIVSA-N 1 1 209.377 3.831 20 0 BHADMO C[N@@H+](CCC1CCCC1)Cc1cccs1 ZINC000525120374 388416667 /nfs/dbraw/zinc/41/66/67/388416667.db2.gz QVAUXTXJWNMKPA-UHFFFAOYSA-N 1 1 223.385 3.760 20 0 BHADMO C[N@@H+](CCOc1ccccc1)CCC1CCCC1 ZINC000525120614 259695260 /nfs/dbraw/zinc/69/52/60/259695260.db2.gz JHPFGVJWWKOWTL-UHFFFAOYSA-N 1 1 247.382 3.578 20 0 BHADMO CC(C)=CC[N@H+]1CC[C@@H](Cc2ccccc2)C1 ZINC000525120682 388416660 /nfs/dbraw/zinc/41/66/60/388416660.db2.gz NSYIAOPNYUTXEZ-INIZCTEOSA-N 1 1 229.367 3.517 20 0 BHADMO CC(C)=CC[N@H+]1CC[C@H](Cc2ccccc2)C1 ZINC000525120683 388416322 /nfs/dbraw/zinc/41/63/22/388416322.db2.gz NSYIAOPNYUTXEZ-MRXNPFEDSA-N 1 1 229.367 3.517 20 0 BHADMO C[C@@H]1CCC[N@@H+](CCCc2ccccc2)[C@H]1C ZINC000525120748 388417029 /nfs/dbraw/zinc/41/70/29/388417029.db2.gz SGPILKGEMXHJLS-CABCVRRESA-N 1 1 231.383 3.740 20 0 BHADMO C[C@H]1CCC[N@@H+](CCCc2ccccc2)[C@H]1C ZINC000525120749 388416462 /nfs/dbraw/zinc/41/64/62/388416462.db2.gz SGPILKGEMXHJLS-GJZGRUSLSA-N 1 1 231.383 3.740 20 0 BHADMO C[C@@H]1CCC[N@@H+](CCCc2ccccc2)[C@@H]1C ZINC000525120750 388416084 /nfs/dbraw/zinc/41/60/84/388416084.db2.gz SGPILKGEMXHJLS-HUUCEWRRSA-N 1 1 231.383 3.740 20 0 BHADMO C[C@@H]1[C@@H](C)CCC[N@H+]1CCCc1ccccc1 ZINC000525120751 388415802 /nfs/dbraw/zinc/41/58/02/388415802.db2.gz SGPILKGEMXHJLS-LSDHHAIUSA-N 1 1 231.383 3.740 20 0 BHADMO CCSCC[N@@H+](C)[C@H]1CCCc2ccccc21 ZINC000525120757 388416948 /nfs/dbraw/zinc/41/69/48/388416948.db2.gz SUBMAFVPUBPGGD-HNNXBMFYSA-N 1 1 249.423 3.749 20 0 BHADMO CCSCC[N@@H+](C)[C@@H]1CCCc2ccccc21 ZINC000525120758 388416599 /nfs/dbraw/zinc/41/65/99/388416599.db2.gz SUBMAFVPUBPGGD-OAHLLOKOSA-N 1 1 249.423 3.749 20 0 BHADMO C[C@@H]1CCC[N@@H+](CC2CCCCC2)[C@@H]1C ZINC000525120867 388416713 /nfs/dbraw/zinc/41/67/13/388416713.db2.gz BBCAJHDJLQHMNM-CHWSQXEVSA-N 1 1 209.377 3.687 20 0 BHADMO C[C@@H]1CCC[N@@H+](CC2CCCCC2)[C@H]1C ZINC000525120868 388417229 /nfs/dbraw/zinc/41/72/29/388417229.db2.gz BBCAJHDJLQHMNM-OLZOCXBDSA-N 1 1 209.377 3.687 20 0 BHADMO C[C@@H]1[C@@H](C)CCC[N@H+]1CC1CCCCC1 ZINC000525120869 388416574 /nfs/dbraw/zinc/41/65/74/388416574.db2.gz BBCAJHDJLQHMNM-QWHCGFSZSA-N 1 1 209.377 3.687 20 0 BHADMO C[C@H]1CCC[N@@H+](CC2CCCCC2)[C@H]1C ZINC000525120870 388416697 /nfs/dbraw/zinc/41/66/97/388416697.db2.gz BBCAJHDJLQHMNM-STQMWFEESA-N 1 1 209.377 3.687 20 0 BHADMO C[C@@H]1CCC[N@@H+](CCC2CCCC2)[C@@H]1C ZINC000525121007 388416616 /nfs/dbraw/zinc/41/66/16/388416616.db2.gz KLLBNVFURLBSJY-CHWSQXEVSA-N 1 1 209.377 3.687 20 0 BHADMO C[C@@H]1CCC[N@@H+](CCC2CCCC2)[C@H]1C ZINC000525121008 388416891 /nfs/dbraw/zinc/41/68/91/388416891.db2.gz KLLBNVFURLBSJY-OLZOCXBDSA-N 1 1 209.377 3.687 20 0 BHADMO C[C@@H]1[C@@H](C)CCC[N@H+]1CCC1CCCC1 ZINC000525121009 388416921 /nfs/dbraw/zinc/41/69/21/388416921.db2.gz KLLBNVFURLBSJY-QWHCGFSZSA-N 1 1 209.377 3.687 20 0 BHADMO C[C@H]1CCC[N@@H+](CCC2CCCC2)[C@H]1C ZINC000525121010 388416405 /nfs/dbraw/zinc/41/64/05/388416405.db2.gz KLLBNVFURLBSJY-STQMWFEESA-N 1 1 209.377 3.687 20 0 BHADMO CC(C)C[N@@H+](CCC1CCCC1)C1CC1 ZINC000525121029 388416620 /nfs/dbraw/zinc/41/66/20/388416620.db2.gz LZGUJFFFMYTXMS-UHFFFAOYSA-N 1 1 209.377 3.687 20 0 BHADMO CCCC[N@H+]1CC[C@@H](c2ccccc2)[C@H](C)C1 ZINC000525121592 388417192 /nfs/dbraw/zinc/41/71/92/388417192.db2.gz UYUUZHCSSMZTJW-GDBMZVCRSA-N 1 1 231.383 3.912 20 0 BHADMO CCCC[N@H+]1CC[C@@H](c2ccccc2)[C@@H](C)C1 ZINC000525121593 388417116 /nfs/dbraw/zinc/41/71/16/388417116.db2.gz UYUUZHCSSMZTJW-GOEBONIOSA-N 1 1 231.383 3.912 20 0 BHADMO CCCC[N@H+]1CC[C@H](c2ccccc2)[C@@H](C)C1 ZINC000525121594 388416790 /nfs/dbraw/zinc/41/67/90/388416790.db2.gz UYUUZHCSSMZTJW-HOCLYGCPSA-N 1 1 231.383 3.912 20 0 BHADMO CCCC[N@H+]1CC[C@H](c2ccccc2)[C@H](C)C1 ZINC000525121595 259695282 /nfs/dbraw/zinc/69/52/82/259695282.db2.gz UYUUZHCSSMZTJW-ZBFHGGJFSA-N 1 1 231.383 3.912 20 0 BHADMO C[C@@H]1CCC[C@@H](C)[N@@H+](Cc2ccccc2F)C1 ZINC000525121844 388416805 /nfs/dbraw/zinc/41/68/05/388416805.db2.gz GZIFZQVVGHHMGV-CHWSQXEVSA-N 1 1 235.346 3.836 20 0 BHADMO C[C@@H]1CCC[C@H](C)[N@@H+](Cc2ccccc2F)C1 ZINC000525121845 388416764 /nfs/dbraw/zinc/41/67/64/388416764.db2.gz GZIFZQVVGHHMGV-OLZOCXBDSA-N 1 1 235.346 3.836 20 0 BHADMO C[C@@H]1CCC[C@H](C)C[N@@H+]1Cc1ccccc1F ZINC000525121846 388417306 /nfs/dbraw/zinc/41/73/06/388417306.db2.gz GZIFZQVVGHHMGV-QWHCGFSZSA-N 1 1 235.346 3.836 20 0 BHADMO C[C@H]1CCC[C@H](C)[N@@H+](Cc2ccccc2F)C1 ZINC000525121847 388417057 /nfs/dbraw/zinc/41/70/57/388417057.db2.gz GZIFZQVVGHHMGV-STQMWFEESA-N 1 1 235.346 3.836 20 0 BHADMO FC(F)(F)CC[N@H+]1CCC2(C1)CCCCC2 ZINC000525122806 388416562 /nfs/dbraw/zinc/41/65/62/388416562.db2.gz MVMPQRHPIKPCIP-UHFFFAOYSA-N 1 1 235.293 3.595 20 0 BHADMO CCCCC[N@H+]1CCC2(C1)CCCCC2 ZINC000525123055 259695601 /nfs/dbraw/zinc/69/56/01/259695601.db2.gz UPHPSJMXKJKARH-UHFFFAOYSA-N 1 1 209.377 3.833 20 0 BHADMO CC[C@H](c1ccccc1)[N@@H+]1C[C@@H]2[C@H](C1)C2(C)C ZINC000525123720 388416978 /nfs/dbraw/zinc/41/69/78/388416978.db2.gz NHCCEJSTOFVDJQ-QLFBSQMISA-N 1 1 229.367 3.726 20 0 BHADMO CC[C@@H](c1ccccc1)[N@@H+]1C[C@@H]2[C@H](C1)C2(C)C ZINC000525123723 388416751 /nfs/dbraw/zinc/41/67/51/388416751.db2.gz NHCCEJSTOFVDJQ-ZNMIVQPWSA-N 1 1 229.367 3.726 20 0 BHADMO CC1(C)CCC[N@H+]1CCOC1CCCCCC1 ZINC000525124493 388417928 /nfs/dbraw/zinc/41/79/28/388417928.db2.gz ABGNTCPVIZUSAQ-UHFFFAOYSA-N 1 1 239.403 3.600 20 0 BHADMO c1ccc(C[C@@H]2CC[N@H+]([C@@H]3C=CCCC3)C2)cc1 ZINC000525124586 388417915 /nfs/dbraw/zinc/41/79/15/388417915.db2.gz CLXINFMDWVVBJF-DLBZAZTESA-N 1 1 241.378 3.660 20 0 BHADMO c1ccc(C[C@H]2CC[N@H+]([C@@H]3C=CCCC3)C2)cc1 ZINC000525124587 388417736 /nfs/dbraw/zinc/41/77/36/388417736.db2.gz CLXINFMDWVVBJF-IAGOWNOFSA-N 1 1 241.378 3.660 20 0 BHADMO c1ccc(C[C@@H]2CC[N@H+]([C@H]3C=CCCC3)C2)cc1 ZINC000525124588 388417614 /nfs/dbraw/zinc/41/76/14/388417614.db2.gz CLXINFMDWVVBJF-IRXDYDNUSA-N 1 1 241.378 3.660 20 0 BHADMO c1ccc(C[C@H]2CC[N@H+]([C@H]3C=CCCC3)C2)cc1 ZINC000525124589 388417465 /nfs/dbraw/zinc/41/74/65/388417465.db2.gz CLXINFMDWVVBJF-SJORKVTESA-N 1 1 241.378 3.660 20 0 BHADMO Cc1cccc(C)c1C[N@H+]1CCCC1(C)C ZINC000525124731 388418013 /nfs/dbraw/zinc/41/80/13/388418013.db2.gz GWGGSEXHKPOJOV-UHFFFAOYSA-N 1 1 217.356 3.678 20 0 BHADMO Cc1cccc(C[N@@H+]2CCC[C@H](C)[C@@H]2C)c1 ZINC000525124745 388417711 /nfs/dbraw/zinc/41/77/11/388417711.db2.gz HULWHSDFOBCPSV-KBPBESRZSA-N 1 1 217.356 3.615 20 0 BHADMO Cc1cccc(C[N@@H+]2CCC[C@@H](C)[C@@H]2C)c1 ZINC000525124746 388417696 /nfs/dbraw/zinc/41/76/96/388417696.db2.gz HULWHSDFOBCPSV-KGLIPLIRSA-N 1 1 217.356 3.615 20 0 BHADMO Cc1cccc(C[N@@H+]2CCC[C@H](C)[C@H]2C)c1 ZINC000525124747 388417858 /nfs/dbraw/zinc/41/78/58/388417858.db2.gz HULWHSDFOBCPSV-UONOGXRCSA-N 1 1 217.356 3.615 20 0 BHADMO Cc1cccc(C[N@@H+]2CCC[C@@H](C)[C@H]2C)c1 ZINC000525124748 388417682 /nfs/dbraw/zinc/41/76/82/388417682.db2.gz HULWHSDFOBCPSV-ZIAGYGMSSA-N 1 1 217.356 3.615 20 0 BHADMO CCCC[N@@H+](C)[C@@H](CC)Cc1ccccc1 ZINC000525126355 388417585 /nfs/dbraw/zinc/41/75/85/388417585.db2.gz TXIKPXQLJQGKQJ-HNNXBMFYSA-N 1 1 219.372 3.740 20 0 BHADMO CCCC[N@@H+](C)[C@H](CC)Cc1ccccc1 ZINC000525126356 388417558 /nfs/dbraw/zinc/41/75/58/388417558.db2.gz TXIKPXQLJQGKQJ-OAHLLOKOSA-N 1 1 219.372 3.740 20 0 BHADMO Cc1ccccc1C[N@@H+]1CCC[C@H](C)[C@H]1C ZINC000525126386 259696247 /nfs/dbraw/zinc/69/62/47/259696247.db2.gz UTFHRBFQYLVLTG-GXTWGEPZSA-N 1 1 217.356 3.615 20 0 BHADMO Cc1ccccc1C[N@@H+]1CCC[C@H](C)[C@@H]1C ZINC000525126387 388417658 /nfs/dbraw/zinc/41/76/58/388417658.db2.gz UTFHRBFQYLVLTG-JSGCOSHPSA-N 1 1 217.356 3.615 20 0 BHADMO Cc1ccccc1C[N@@H+]1CCC[C@@H](C)[C@@H]1C ZINC000525126388 388418082 /nfs/dbraw/zinc/41/80/82/388418082.db2.gz UTFHRBFQYLVLTG-OCCSQVGLSA-N 1 1 217.356 3.615 20 0 BHADMO Cc1ccccc1C[N@@H+]1CCC[C@@H](C)[C@H]1C ZINC000525126436 388417498 /nfs/dbraw/zinc/41/74/98/388417498.db2.gz UTFHRBFQYLVLTG-TZMCWYRMSA-N 1 1 217.356 3.615 20 0 BHADMO CC[C@H]1CCC[N@H+]1CCCc1cccc(OC)c1 ZINC000525127044 388417670 /nfs/dbraw/zinc/41/76/70/388417670.db2.gz HDZALHZLBFLVIV-HNNXBMFYSA-N 1 1 247.382 3.502 20 0 BHADMO CC[C@@H]1CCC[N@H+]1CCCc1cccc(OC)c1 ZINC000525127045 388417484 /nfs/dbraw/zinc/41/74/84/388417484.db2.gz HDZALHZLBFLVIV-OAHLLOKOSA-N 1 1 247.382 3.502 20 0 BHADMO Cc1ccc(C[N@@H+]2CCC[C@H](C)[C@@H]2C)cc1 ZINC000525127178 388417618 /nfs/dbraw/zinc/41/76/18/388417618.db2.gz UPESIRLOQOJYJZ-KBPBESRZSA-N 1 1 217.356 3.615 20 0 BHADMO Cc1ccc(C[N@@H+]2CCC[C@@H](C)[C@@H]2C)cc1 ZINC000525127179 388417663 /nfs/dbraw/zinc/41/76/63/388417663.db2.gz UPESIRLOQOJYJZ-KGLIPLIRSA-N 1 1 217.356 3.615 20 0 BHADMO Cc1ccc(C[N@@H+]2CCC[C@H](C)[C@H]2C)cc1 ZINC000525127180 388417630 /nfs/dbraw/zinc/41/76/30/388417630.db2.gz UPESIRLOQOJYJZ-UONOGXRCSA-N 1 1 217.356 3.615 20 0 BHADMO Cc1ccc(C[N@@H+]2CCC[C@@H](C)[C@H]2C)cc1 ZINC000525127181 388417820 /nfs/dbraw/zinc/41/78/20/388417820.db2.gz UPESIRLOQOJYJZ-ZIAGYGMSSA-N 1 1 217.356 3.615 20 0 BHADMO CCC(CC)(CC)[NH2+]Cc1ccc2nc[nH]c2c1 ZINC000525195770 388420743 /nfs/dbraw/zinc/42/07/43/388420743.db2.gz IVBLFZAYQWWBHL-UHFFFAOYSA-N 1 1 245.370 3.621 20 0 BHADMO Cc1cccc(C[N@@H+](C)CCc2cccs2)c1 ZINC000525266915 259699184 /nfs/dbraw/zinc/69/91/84/259699184.db2.gz ZCJUTFAXQAVKJY-UHFFFAOYSA-N 1 1 245.391 3.731 20 0 BHADMO Cc1ccccc1C[N@@H+](C)CCc1cccs1 ZINC000525267172 388423307 /nfs/dbraw/zinc/42/33/07/388423307.db2.gz LWNCQKDPTFANMP-UHFFFAOYSA-N 1 1 245.391 3.731 20 0 BHADMO CC(C)[C@H]1C[N@H+]([C@@H](C)c2ccccc2)CCS1 ZINC000525268766 388423226 /nfs/dbraw/zinc/42/32/26/388423226.db2.gz CNSWECIAFDRQAG-DZGCQCFKSA-N 1 1 249.423 3.821 20 0 BHADMO CC(C)[C@@H]1C[N@H+]([C@H](C)c2ccccc2)CCS1 ZINC000525268767 388423746 /nfs/dbraw/zinc/42/37/46/388423746.db2.gz CNSWECIAFDRQAG-HIFRSBDPSA-N 1 1 249.423 3.821 20 0 BHADMO CC(C)[C@H]1C[N@H+]([C@H](C)c2ccccc2)CCS1 ZINC000525268768 388423026 /nfs/dbraw/zinc/42/30/26/388423026.db2.gz CNSWECIAFDRQAG-UKRRQHHQSA-N 1 1 249.423 3.821 20 0 BHADMO CC(C)[C@@H]1C[N@H+]([C@@H](C)c2ccccc2)CCS1 ZINC000525268769 259699669 /nfs/dbraw/zinc/69/96/69/259699669.db2.gz CNSWECIAFDRQAG-ZFWWWQNUSA-N 1 1 249.423 3.821 20 0 BHADMO C[N@@H+](CCC1CC1)Cc1c(F)cccc1Cl ZINC000525270972 388423592 /nfs/dbraw/zinc/42/35/92/388423592.db2.gz URJQSPLNISPPHI-UHFFFAOYSA-N 1 1 241.737 3.711 20 0 BHADMO C[N@H+](CCC1CC1)Cc1c(F)cccc1Cl ZINC000525270972 388423590 /nfs/dbraw/zinc/42/35/90/388423590.db2.gz URJQSPLNISPPHI-UHFFFAOYSA-N 1 1 241.737 3.711 20 0 BHADMO C[N@@H+](Cc1ccc(Cl)cc1Cl)C1CCC1 ZINC000525271406 388423476 /nfs/dbraw/zinc/42/34/76/388423476.db2.gz XWJJFDHUYPAHHS-UHFFFAOYSA-N 1 1 244.165 3.978 20 0 BHADMO C[N@@H+](Cc1c(Cl)cccc1Cl)C1CCC1 ZINC000525271410 388423219 /nfs/dbraw/zinc/42/32/19/388423219.db2.gz YTSWPMLCVQBMTH-UHFFFAOYSA-N 1 1 244.165 3.978 20 0 BHADMO C[N@H+](Cc1c(Cl)cccc1Cl)C1CCC1 ZINC000525271410 388423217 /nfs/dbraw/zinc/42/32/17/388423217.db2.gz YTSWPMLCVQBMTH-UHFFFAOYSA-N 1 1 244.165 3.978 20 0 BHADMO CC(C)C[N@H+]1C[C@H](C)C[C@H]1c1cccc(F)c1 ZINC000525271728 388423826 /nfs/dbraw/zinc/42/38/26/388423826.db2.gz JEGRHCDDZXTTFI-DOMZBBRYSA-N 1 1 235.346 3.865 20 0 BHADMO CC(C)C[N@H+]1C[C@H](C)C[C@@H]1c1cccc(F)c1 ZINC000525271729 388423908 /nfs/dbraw/zinc/42/39/08/388423908.db2.gz JEGRHCDDZXTTFI-IUODEOHRSA-N 1 1 235.346 3.865 20 0 BHADMO CC(C)C[N@H+]1C[C@@H](C)C[C@@H]1c1cccc(F)c1 ZINC000525271730 388423812 /nfs/dbraw/zinc/42/38/12/388423812.db2.gz JEGRHCDDZXTTFI-SWLSCSKDSA-N 1 1 235.346 3.865 20 0 BHADMO CC(C)C[N@H+]1C[C@@H](C)C[C@H]1c1cccc(F)c1 ZINC000525271731 388423194 /nfs/dbraw/zinc/42/31/94/388423194.db2.gz JEGRHCDDZXTTFI-WFASDCNBSA-N 1 1 235.346 3.865 20 0 BHADMO Cc1cc(C)c(C[N@H+](C)C2CCC2)c(C)c1 ZINC000525272131 388423127 /nfs/dbraw/zinc/42/31/27/388423127.db2.gz KSNZZWZIFGGCMI-UHFFFAOYSA-N 1 1 217.356 3.596 20 0 BHADMO C[N@@H+](Cc1ccc2ccccc2c1)C1CCC1 ZINC000525272187 388422993 /nfs/dbraw/zinc/42/29/93/388422993.db2.gz SMNCEXUOGLPWQU-UHFFFAOYSA-N 1 1 225.335 3.824 20 0 BHADMO Cc1cccc(C)c1C[N@H+]1C[C@@H](C)S[C@@H](C)C1 ZINC000525272567 388423370 /nfs/dbraw/zinc/42/33/70/388423370.db2.gz LRNWUZLENPMKEF-OKILXGFUSA-N 1 1 249.423 3.629 20 0 BHADMO CC(C)(C)[C@@H]1CCC[N@H+]1Cc1ccccc1F ZINC000525272966 388423232 /nfs/dbraw/zinc/42/32/32/388423232.db2.gz GVBVJNFOTAXLKM-AWEZNQCLSA-N 1 1 235.346 3.836 20 0 BHADMO CC(C)(C)[C@H]1CCC[N@H+]1Cc1ccccc1F ZINC000525272967 388423353 /nfs/dbraw/zinc/42/33/53/388423353.db2.gz GVBVJNFOTAXLKM-CQSZACIVSA-N 1 1 235.346 3.836 20 0 BHADMO CC[C@@H](c1ccccc1)[N@@H+]1C[C@@H](C)S[C@@H](C)C1 ZINC000525273669 388423501 /nfs/dbraw/zinc/42/35/01/388423501.db2.gz NKPRJSSAESOUCP-GUTXKFCHSA-N 1 1 249.423 3.964 20 0 BHADMO CC[C@H](c1ccccc1)[N@@H+]1C[C@@H](C)S[C@@H](C)C1 ZINC000525273672 259699212 /nfs/dbraw/zinc/69/92/12/259699212.db2.gz NKPRJSSAESOUCP-VNHYZAJKSA-N 1 1 249.423 3.964 20 0 BHADMO CCCCC[N@@H+](C[C@@H]1CCCO1)C1CCCC1 ZINC000525274338 388423061 /nfs/dbraw/zinc/42/30/61/388423061.db2.gz SPDOBOUITHMPHY-HNNXBMFYSA-N 1 1 239.403 3.600 20 0 BHADMO CCCCC[N@@H+](C[C@H]1CCCO1)C1CCCC1 ZINC000525274339 388423175 /nfs/dbraw/zinc/42/31/75/388423175.db2.gz SPDOBOUITHMPHY-OAHLLOKOSA-N 1 1 239.403 3.600 20 0 BHADMO CC(C)(C)[C@H]1CCC[N@H+]1[C@@H]1C=CCCC1 ZINC000525274735 388423667 /nfs/dbraw/zinc/42/36/67/388423667.db2.gz BPEPYJUBEKGPHO-CHWSQXEVSA-N 1 1 207.361 3.606 20 0 BHADMO CC(C)(C)[C@@H]1CCC[N@H+]1[C@@H]1C=CCCC1 ZINC000525274736 388423626 /nfs/dbraw/zinc/42/36/26/388423626.db2.gz BPEPYJUBEKGPHO-OLZOCXBDSA-N 1 1 207.361 3.606 20 0 BHADMO CC(C)(C)[C@H]1CCC[N@H+]1[C@H]1C=CCCC1 ZINC000525274737 388423118 /nfs/dbraw/zinc/42/31/18/388423118.db2.gz BPEPYJUBEKGPHO-QWHCGFSZSA-N 1 1 207.361 3.606 20 0 BHADMO CC(C)(C)[C@@H]1CCC[N@H+]1[C@H]1C=CCCC1 ZINC000525274738 388423567 /nfs/dbraw/zinc/42/35/67/388423567.db2.gz BPEPYJUBEKGPHO-STQMWFEESA-N 1 1 207.361 3.606 20 0 BHADMO C[C@@H]1CC[N@@H+](CCC2CC2)[C@@H]2CCCC[C@H]12 ZINC000525275739 388423937 /nfs/dbraw/zinc/42/39/37/388423937.db2.gz RHKLGQXNSBZEDC-BPLDGKMQSA-N 1 1 221.388 3.687 20 0 BHADMO C[C@@H]1CC[N@@H+](CCC2CC2)[C@H]2CCCC[C@@H]12 ZINC000525275740 388423607 /nfs/dbraw/zinc/42/36/07/388423607.db2.gz RHKLGQXNSBZEDC-SNPRPXQTSA-N 1 1 221.388 3.687 20 0 BHADMO C[C@@H]1CC[N@@H+](CCC2CC2)[C@@H]2CCCC[C@@H]12 ZINC000525275741 388423585 /nfs/dbraw/zinc/42/35/85/388423585.db2.gz RHKLGQXNSBZEDC-VHDGCEQUSA-N 1 1 221.388 3.687 20 0 BHADMO C[C@@H]1CC[N@@H+](CCC2CC2)[C@H]2CCCC[C@H]12 ZINC000525275742 388423471 /nfs/dbraw/zinc/42/34/71/388423471.db2.gz RHKLGQXNSBZEDC-YUELXQCFSA-N 1 1 221.388 3.687 20 0 BHADMO CC1(C)CC[N@@H+](Cc2ccccc2Cl)C1 ZINC000525283067 388423860 /nfs/dbraw/zinc/42/38/60/388423860.db2.gz ITBCDMCCLFYUQH-UHFFFAOYSA-N 1 1 223.747 3.572 20 0 BHADMO CC1(C)CC[N@@H+](Cc2cccc(Cl)c2)C1 ZINC000525283433 388424601 /nfs/dbraw/zinc/42/46/01/388424601.db2.gz DHAZQVJEEVTZDY-UHFFFAOYSA-N 1 1 223.747 3.572 20 0 BHADMO CC(C)Oc1cccc(C[N@H+]2CCC(C)(C)C2)c1 ZINC000525283546 388424464 /nfs/dbraw/zinc/42/44/64/388424464.db2.gz QIRZCCVLMPNDQA-UHFFFAOYSA-N 1 1 247.382 3.706 20 0 BHADMO COc1ccc(C)cc1C[N@@H+]1[C@H](C)CCC[C@@H]1C ZINC000525307397 388426069 /nfs/dbraw/zinc/42/60/69/388426069.db2.gz RGINBBXXDCDMGG-OKILXGFUSA-N 1 1 247.382 3.767 20 0 BHADMO CC[C@@H](C)[C@H]1CCCC[N@H+]1CCc1ccccn1 ZINC000525328282 259701054 /nfs/dbraw/zinc/70/10/54/259701054.db2.gz JIASTWDJBRQHMQ-GDBMZVCRSA-N 1 1 246.398 3.525 20 0 BHADMO CC[C@H](C)[C@H]1CCCC[N@H+]1CCc1ccccn1 ZINC000525328283 259701046 /nfs/dbraw/zinc/70/10/46/259701046.db2.gz JIASTWDJBRQHMQ-GOEBONIOSA-N 1 1 246.398 3.525 20 0 BHADMO CC[C@H](C)[C@@H]1CCCC[N@H+]1CCc1ccccn1 ZINC000525328284 388425621 /nfs/dbraw/zinc/42/56/21/388425621.db2.gz JIASTWDJBRQHMQ-HOCLYGCPSA-N 1 1 246.398 3.525 20 0 BHADMO CC[C@@H](C)[C@@H]1CCCC[N@H+]1CCc1ccccn1 ZINC000525328285 388425569 /nfs/dbraw/zinc/42/55/69/388425569.db2.gz JIASTWDJBRQHMQ-ZBFHGGJFSA-N 1 1 246.398 3.525 20 0 BHADMO Clc1cccc2c1CC[N@H+]([C@@H]1C=CCCC1)C2 ZINC000525328462 388425966 /nfs/dbraw/zinc/42/59/66/388425966.db2.gz ZOMIMTYVQVHNCU-CYBMUJFWSA-N 1 1 247.769 3.807 20 0 BHADMO Clc1cccc2c1CC[N@H+]([C@H]1C=CCCC1)C2 ZINC000525328463 388425919 /nfs/dbraw/zinc/42/59/19/388425919.db2.gz ZOMIMTYVQVHNCU-ZDUSSCGKSA-N 1 1 247.769 3.807 20 0 BHADMO CC[C@@H](C)[C@@H]1CCCC[N@H+]1CCCCCOC ZINC000525328773 388426972 /nfs/dbraw/zinc/42/69/72/388426972.db2.gz NNYHNZCYPZYOGA-CABCVRRESA-N 1 1 241.419 3.704 20 0 BHADMO CC[C@H](C)[C@@H]1CCCC[N@H+]1CCCCCOC ZINC000525328774 388426977 /nfs/dbraw/zinc/42/69/77/388426977.db2.gz NNYHNZCYPZYOGA-GJZGRUSLSA-N 1 1 241.419 3.704 20 0 BHADMO CC[C@@H](C)[C@H]1CCCC[N@H+]1CCCCCOC ZINC000525328775 259701130 /nfs/dbraw/zinc/70/11/30/259701130.db2.gz NNYHNZCYPZYOGA-HUUCEWRRSA-N 1 1 241.419 3.704 20 0 BHADMO CC[C@H](C)[C@H]1CCCC[N@H+]1CCCCCOC ZINC000525328776 388426924 /nfs/dbraw/zinc/42/69/24/388426924.db2.gz NNYHNZCYPZYOGA-LSDHHAIUSA-N 1 1 241.419 3.704 20 0 BHADMO C[N@H+](Cc1ccc2ccccc2c1)CC1CC1 ZINC000525329042 388426111 /nfs/dbraw/zinc/42/61/11/388426111.db2.gz YBFNGRJWCAIJHN-UHFFFAOYSA-N 1 1 225.335 3.682 20 0 BHADMO CCCCOCC[N@H+]1CCCC[C@H]1[C@H](C)CC ZINC000525329279 259701654 /nfs/dbraw/zinc/70/16/54/259701654.db2.gz RUKCIVXDQWMWKJ-CABCVRRESA-N 1 1 241.419 3.704 20 0 BHADMO CCCCOCC[N@H+]1CCCC[C@H]1[C@@H](C)CC ZINC000525329280 388426473 /nfs/dbraw/zinc/42/64/73/388426473.db2.gz RUKCIVXDQWMWKJ-GJZGRUSLSA-N 1 1 241.419 3.704 20 0 BHADMO CCCCOCC[N@H+]1CCCC[C@@H]1[C@H](C)CC ZINC000525329281 388426332 /nfs/dbraw/zinc/42/63/32/388426332.db2.gz RUKCIVXDQWMWKJ-HUUCEWRRSA-N 1 1 241.419 3.704 20 0 BHADMO CCCCOCC[N@H+]1CCCC[C@@H]1[C@@H](C)CC ZINC000525329282 388426752 /nfs/dbraw/zinc/42/67/52/388426752.db2.gz RUKCIVXDQWMWKJ-LSDHHAIUSA-N 1 1 241.419 3.704 20 0 BHADMO CC[N@@H+](CCOC1CCCCCC1)C1CCC1 ZINC000525407625 388427636 /nfs/dbraw/zinc/42/76/36/388427636.db2.gz BHPJYWVGOWXQGR-UHFFFAOYSA-N 1 1 239.403 3.600 20 0 BHADMO CC[C@@H](C)[C@H]1CCCC[N@H+]1CCC(F)(F)F ZINC000525407974 259702340 /nfs/dbraw/zinc/70/23/40/259702340.db2.gz LVMXJDZZNKBKAZ-GHMZBOCLSA-N 1 1 237.309 3.839 20 0 BHADMO CC[C@@H](C)[C@@H]1CCCC[N@H+]1CCC(F)(F)F ZINC000525407979 388427877 /nfs/dbraw/zinc/42/78/77/388427877.db2.gz LVMXJDZZNKBKAZ-MNOVXSKESA-N 1 1 237.309 3.839 20 0 BHADMO CC[C@H](C)[C@@H]1CCCC[N@H+]1CCC(F)(F)F ZINC000525407981 388427405 /nfs/dbraw/zinc/42/74/05/388427405.db2.gz LVMXJDZZNKBKAZ-QWRGUYRKSA-N 1 1 237.309 3.839 20 0 BHADMO CC[C@H](C)[C@H]1CCCC[N@H+]1CCC(F)(F)F ZINC000525407983 388427805 /nfs/dbraw/zinc/42/78/05/388427805.db2.gz LVMXJDZZNKBKAZ-WDEREUQCSA-N 1 1 237.309 3.839 20 0 BHADMO CC(C)C[C@@H]1CCCCC[N@H+]1Cc1cccnc1 ZINC000525408262 388427916 /nfs/dbraw/zinc/42/79/16/388427916.db2.gz RKKXLQKHRUSGDY-INIZCTEOSA-N 1 1 246.398 3.872 20 0 BHADMO CC(C)C[C@H]1CCCCC[N@H+]1Cc1cccnc1 ZINC000525408263 388427442 /nfs/dbraw/zinc/42/74/42/388427442.db2.gz RKKXLQKHRUSGDY-MRXNPFEDSA-N 1 1 246.398 3.872 20 0 BHADMO Cc1ccc(C[N@H+](CC(C)C)C2CC2)cc1C ZINC000525408564 388427251 /nfs/dbraw/zinc/42/72/51/388427251.db2.gz SNKSFKXRVXTOCY-UHFFFAOYSA-N 1 1 231.383 3.924 20 0 BHADMO C[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2Cl)C1 ZINC000525408628 388428264 /nfs/dbraw/zinc/42/82/64/388428264.db2.gz UZRHMVPPJLRZAB-GHMZBOCLSA-N 1 1 223.747 3.570 20 0 BHADMO C[C@@H]1C[C@H](C)[N@@H+](Cc2ccccc2Cl)C1 ZINC000525408629 259702320 /nfs/dbraw/zinc/70/23/20/259702320.db2.gz UZRHMVPPJLRZAB-MNOVXSKESA-N 1 1 223.747 3.570 20 0 BHADMO C[C@H]1C[C@H](C)[N@@H+](Cc2ccccc2Cl)C1 ZINC000525408630 388428416 /nfs/dbraw/zinc/42/84/16/388428416.db2.gz UZRHMVPPJLRZAB-QWRGUYRKSA-N 1 1 223.747 3.570 20 0 BHADMO C[C@@H]1C[C@H](C)C[N@@H+]1Cc1ccccc1Cl ZINC000525408631 388428499 /nfs/dbraw/zinc/42/84/99/388428499.db2.gz UZRHMVPPJLRZAB-WDEREUQCSA-N 1 1 223.747 3.570 20 0 BHADMO CO[C@@H](C)C[N@@H+](Cc1cc(C)cc(C)c1)C(C)C ZINC000525409215 388428397 /nfs/dbraw/zinc/42/83/97/388428397.db2.gz RAHHKHPWNHKKIJ-HNNXBMFYSA-N 1 1 249.398 3.549 20 0 BHADMO CO[C@H](C)C[N@@H+](Cc1cc(C)cc(C)c1)C(C)C ZINC000525409216 388428370 /nfs/dbraw/zinc/42/83/70/388428370.db2.gz RAHHKHPWNHKKIJ-OAHLLOKOSA-N 1 1 249.398 3.549 20 0 BHADMO CC[N@@H+](CC1CCC1)[C@H](C)c1ccccc1 ZINC000525409301 388428284 /nfs/dbraw/zinc/42/82/84/388428284.db2.gz TUTUTQZEUFYDMV-CYBMUJFWSA-N 1 1 217.356 3.870 20 0 BHADMO CC[N@@H+](CC1CCC1)[C@@H](C)c1ccccc1 ZINC000525409302 388428658 /nfs/dbraw/zinc/42/86/58/388428658.db2.gz TUTUTQZEUFYDMV-ZDUSSCGKSA-N 1 1 217.356 3.870 20 0 BHADMO Cc1cccc(C)c1C[N@H+]1C[C@H](C)C[C@H]1C ZINC000525409855 388428912 /nfs/dbraw/zinc/42/89/12/388428912.db2.gz TZJATTPTCCGFED-BXUZGUMPSA-N 1 1 217.356 3.534 20 0 BHADMO Cc1cccc(C)c1C[N@H+]1C[C@@H](C)C[C@@H]1C ZINC000525409856 388428906 /nfs/dbraw/zinc/42/89/06/388428906.db2.gz TZJATTPTCCGFED-FZMZJTMJSA-N 1 1 217.356 3.534 20 0 BHADMO Cc1cccc(C)c1C[N@H+]1C[C@H](C)C[C@@H]1C ZINC000525409857 388428547 /nfs/dbraw/zinc/42/85/47/388428547.db2.gz TZJATTPTCCGFED-RISCZKNCSA-N 1 1 217.356 3.534 20 0 BHADMO Cc1cccc(C)c1C[N@H+]1C[C@@H](C)C[C@H]1C ZINC000525409858 259701890 /nfs/dbraw/zinc/70/18/90/259701890.db2.gz TZJATTPTCCGFED-SMDDNHRTSA-N 1 1 217.356 3.534 20 0 BHADMO C[C@@H]1C[C@@H](C)[N@@H+](Cc2c(F)cccc2Cl)C1 ZINC000525410451 388428891 /nfs/dbraw/zinc/42/88/91/388428891.db2.gz JCIMBRVUGZKJKY-NXEZZACHSA-N 1 1 241.737 3.709 20 0 BHADMO C[C@H]1C[C@H](C)[N@@H+](Cc2c(F)cccc2Cl)C1 ZINC000525410452 388428853 /nfs/dbraw/zinc/42/88/53/388428853.db2.gz JCIMBRVUGZKJKY-UWVGGRQHSA-N 1 1 241.737 3.709 20 0 BHADMO C[C@@H]1C[C@H](C)C[N@@H+]1Cc1c(F)cccc1Cl ZINC000525410453 388428463 /nfs/dbraw/zinc/42/84/63/388428463.db2.gz JCIMBRVUGZKJKY-VHSXEESVSA-N 1 1 241.737 3.709 20 0 BHADMO C[C@@H]1C[C@H](C)[N@@H+](Cc2c(F)cccc2Cl)C1 ZINC000525410454 388428618 /nfs/dbraw/zinc/42/86/18/388428618.db2.gz JCIMBRVUGZKJKY-ZJUUUORDSA-N 1 1 241.737 3.709 20 0 BHADMO C[C@@H]1C[C@@H](C)[N@@H+](Cc2ccc(Cl)cc2)C1 ZINC000525410821 388428453 /nfs/dbraw/zinc/42/84/53/388428453.db2.gz LGLUFHYYGPVOLI-GHMZBOCLSA-N 1 1 223.747 3.570 20 0 BHADMO C[C@@H]1C[C@H](C)[N@@H+](Cc2ccc(Cl)cc2)C1 ZINC000525410822 388428757 /nfs/dbraw/zinc/42/87/57/388428757.db2.gz LGLUFHYYGPVOLI-MNOVXSKESA-N 1 1 223.747 3.570 20 0 BHADMO C[C@H]1C[C@H](C)[N@@H+](Cc2ccc(Cl)cc2)C1 ZINC000525410823 388428577 /nfs/dbraw/zinc/42/85/77/388428577.db2.gz LGLUFHYYGPVOLI-QWRGUYRKSA-N 1 1 223.747 3.570 20 0 BHADMO C[C@@H]1C[C@H](C)C[N@@H+]1Cc1ccc(Cl)cc1 ZINC000525410824 388428835 /nfs/dbraw/zinc/42/88/35/388428835.db2.gz LGLUFHYYGPVOLI-WDEREUQCSA-N 1 1 223.747 3.570 20 0 BHADMO CC(C)C[C@@H]1CCCCC[N@H+]1CCOC(C)C ZINC000525411466 388428864 /nfs/dbraw/zinc/42/88/64/388428864.db2.gz RPXNWJLNXYXBNV-HNNXBMFYSA-N 1 1 241.419 3.702 20 0 BHADMO CC(C)C[C@H]1CCCCC[N@H+]1CCOC(C)C ZINC000525411467 388429019 /nfs/dbraw/zinc/42/90/19/388429019.db2.gz RPXNWJLNXYXBNV-OAHLLOKOSA-N 1 1 241.419 3.702 20 0 BHADMO CC[N@@H+](CCCc1ccc(Cl)cc1)C1CC1 ZINC000525422252 259702731 /nfs/dbraw/zinc/70/27/31/259702731.db2.gz POGPTYMRHWIZKM-UHFFFAOYSA-N 1 1 237.774 3.757 20 0 BHADMO C[N@@H+](CCCc1ccc(Cl)cc1)CC1CC1 ZINC000525422319 388428322 /nfs/dbraw/zinc/42/83/22/388428322.db2.gz SUUMTKJPGXPSHN-UHFFFAOYSA-N 1 1 237.774 3.614 20 0 BHADMO CC(C)[N@@H+](CCOC1CCCCCC1)C1CC1 ZINC000525422707 388428296 /nfs/dbraw/zinc/42/82/96/388428296.db2.gz KDBPRTHQONMBHO-UHFFFAOYSA-N 1 1 239.403 3.599 20 0 BHADMO Cc1ccccc1[C@@H](C)[N@@H+](C)CCC(F)(F)F ZINC000525422804 388428512 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CSCCC[N@H+]1CCC[C@H](C(C)(C)C)CC1 ZINC000525784485 259396049 /nfs/dbraw/zinc/39/60/49/259396049.db2.gz WXSJXOIRQVYFHD-ZDUSSCGKSA-N 1 1 243.460 3.888 20 0 BHADMO CCCC[N@@H+](C[C@H](O)CC)[C@H](C)c1ccccc1 ZINC000525785202 259397185 /nfs/dbraw/zinc/39/71/85/259397185.db2.gz UZZXFKUXAXFCDA-GDBMZVCRSA-N 1 1 249.398 3.621 20 0 BHADMO CCCC[N@@H+](C[C@H](O)CC)[C@@H](C)c1ccccc1 ZINC000525785203 259397005 /nfs/dbraw/zinc/39/70/05/259397005.db2.gz UZZXFKUXAXFCDA-GOEBONIOSA-N 1 1 249.398 3.621 20 0 BHADMO Cc1cc(C)cc(C[N@H+]2C[C@@H](C)S[C@@H](C)C2)c1 ZINC000525785333 259397198 /nfs/dbraw/zinc/39/71/98/259397198.db2.gz KZTUMDVHLSDMCD-OKILXGFUSA-N 1 1 249.423 3.629 20 0 BHADMO C[C@@H]1c2c(F)cccc2CC[N@@H+]1CC1CCC1 ZINC000525785351 259396887 /nfs/dbraw/zinc/39/68/87/259396887.db2.gz OCXDXVWUHMTGEF-LLVKDONJSA-N 1 1 233.330 3.545 20 0 BHADMO C[C@H]1c2c(F)cccc2CC[N@@H+]1CC1CCC1 ZINC000525785352 259396750 /nfs/dbraw/zinc/39/67/50/259396750.db2.gz OCXDXVWUHMTGEF-NSHDSACASA-N 1 1 233.330 3.545 20 0 BHADMO CCCC[N@H+]1CCC[C@H]1c1cccc(N(C)C)c1 ZINC000525785442 259397038 /nfs/dbraw/zinc/39/70/38/259397038.db2.gz ZOKAJQYZGXSLBL-INIZCTEOSA-N 1 1 246.398 3.690 20 0 BHADMO CCCC[N@H+]1CCC[C@@H]1c1cccc(N(C)C)c1 ZINC000525785443 259397164 /nfs/dbraw/zinc/39/71/64/259397164.db2.gz ZOKAJQYZGXSLBL-MRXNPFEDSA-N 1 1 246.398 3.690 20 0 BHADMO CCC(C)(C)CC[N@@H+]1C[C@@H](C)S[C@@H](C)C1 ZINC000525786300 259397099 /nfs/dbraw/zinc/39/70/99/259397099.db2.gz MLFZYQUNPWQVTK-TXEJJXNPSA-N 1 1 229.433 3.639 20 0 BHADMO COc1cccc(C[N@H+]2CCC[C@H]2C(C)(C)C)c1 ZINC000525786379 259397109 /nfs/dbraw/zinc/39/71/09/259397109.db2.gz ZKHLDLOIDASYQL-HNNXBMFYSA-N 1 1 247.382 3.706 20 0 BHADMO COc1cccc(C[N@H+]2CCC[C@@H]2C(C)(C)C)c1 ZINC000525786380 259396792 /nfs/dbraw/zinc/39/67/92/259396792.db2.gz ZKHLDLOIDASYQL-OAHLLOKOSA-N 1 1 247.382 3.706 20 0 BHADMO CCC(CC)[N@@H+](Cc1csc(C)n1)C1CC1 ZINC000525787663 259397448 /nfs/dbraw/zinc/39/74/48/259397448.db2.gz LHPYOKWYHKOTON-UHFFFAOYSA-N 1 1 238.400 3.605 20 0 BHADMO C[C@@H]1CC[N@@H+](CC2CCC2)[C@@H]2CCCC[C@H]12 ZINC000525787957 259398079 /nfs/dbraw/zinc/39/80/79/259398079.db2.gz PAQACOSOTZQWIL-BPLDGKMQSA-N 1 1 221.388 3.687 20 0 BHADMO C[C@@H]1CC[N@@H+](CC2CCC2)[C@H]2CCCC[C@@H]12 ZINC000525787958 259397954 /nfs/dbraw/zinc/39/79/54/259397954.db2.gz PAQACOSOTZQWIL-SNPRPXQTSA-N 1 1 221.388 3.687 20 0 BHADMO C[C@@H]1CC[N@@H+](CC2CCC2)[C@@H]2CCCC[C@@H]12 ZINC000525787959 259397852 /nfs/dbraw/zinc/39/78/52/259397852.db2.gz PAQACOSOTZQWIL-VHDGCEQUSA-N 1 1 221.388 3.687 20 0 BHADMO C[C@@H]1CC[N@@H+](CC2CCC2)[C@H]2CCCC[C@H]12 ZINC000525787960 259397888 /nfs/dbraw/zinc/39/78/88/259397888.db2.gz PAQACOSOTZQWIL-YUELXQCFSA-N 1 1 221.388 3.687 20 0 BHADMO C[N@@H+](CCC1CC1)Cc1ccc(Cl)cc1 ZINC000525788051 259397838 /nfs/dbraw/zinc/39/78/38/259397838.db2.gz BHCHSYUMFUURLY-UHFFFAOYSA-N 1 1 223.747 3.572 20 0 BHADMO CC[C@@H]1C[C@H](C)C[N@H+]1Cc1cccc(F)c1F ZINC000525819579 386425873 /nfs/dbraw/zinc/42/58/73/386425873.db2.gz BHYPCLLSNRPUSO-CMPLNLGQSA-N 1 1 239.309 3.585 20 0 BHADMO CC[C@H]1C[C@H](C)C[N@H+]1Cc1cccc(F)c1F ZINC000525819580 386426519 /nfs/dbraw/zinc/42/65/19/386426519.db2.gz BHYPCLLSNRPUSO-JQWIXIFHSA-N 1 1 239.309 3.585 20 0 BHADMO CC[C@H]1C[C@@H](C)C[N@H+]1Cc1cccc(F)c1F ZINC000525819581 386427000 /nfs/dbraw/zinc/42/70/00/386427000.db2.gz BHYPCLLSNRPUSO-PWSUYJOCSA-N 1 1 239.309 3.585 20 0 BHADMO CC[C@@H]1C[C@@H](C)C[N@H+]1Cc1cccc(F)c1F ZINC000525819582 386424996 /nfs/dbraw/zinc/42/49/96/386424996.db2.gz BHYPCLLSNRPUSO-ZYHUDNBSSA-N 1 1 239.309 3.585 20 0 BHADMO CC[C@@H]1C[C@H](C)C[N@H+]1Cc1ccc(F)c(F)c1 ZINC000525819822 350463769 /nfs/dbraw/zinc/46/37/69/350463769.db2.gz UNFQXDIDDGGXSG-CMPLNLGQSA-N 1 1 239.309 3.585 20 0 BHADMO CC[C@H]1C[C@H](C)C[N@H+]1Cc1ccc(F)c(F)c1 ZINC000525819823 350463748 /nfs/dbraw/zinc/46/37/48/350463748.db2.gz UNFQXDIDDGGXSG-JQWIXIFHSA-N 1 1 239.309 3.585 20 0 BHADMO CC[C@H]1C[C@@H](C)C[N@H+]1Cc1ccc(F)c(F)c1 ZINC000525819824 350463567 /nfs/dbraw/zinc/46/35/67/350463567.db2.gz UNFQXDIDDGGXSG-PWSUYJOCSA-N 1 1 239.309 3.585 20 0 BHADMO CC[C@@H]1C[C@@H](C)C[N@H+]1Cc1ccc(F)c(F)c1 ZINC000525819825 350463676 /nfs/dbraw/zinc/46/36/76/350463676.db2.gz UNFQXDIDDGGXSG-ZYHUDNBSSA-N 1 1 239.309 3.585 20 0 BHADMO CCC(C)(C)[N@@H+](C)Cc1ccccc1Cl ZINC000525827301 386490255 /nfs/dbraw/zinc/49/02/55/386490255.db2.gz GQVBLZSHLXCGOO-UHFFFAOYSA-N 1 1 225.763 3.960 20 0 BHADMO CCC(C)(C)[N@@H+](C)Cc1ccc(Cl)cc1 ZINC000525827971 386493538 /nfs/dbraw/zinc/49/35/38/386493538.db2.gz KONPXAXJYYEDSZ-UHFFFAOYSA-N 1 1 225.763 3.960 20 0 BHADMO CCC[N@@H+](CC)Cc1cc(F)ccc1Cl ZINC000525833008 323100116 /nfs/dbraw/zinc/10/01/16/323100116.db2.gz ZRGMFFUKAUXGEO-UHFFFAOYSA-N 1 1 229.726 3.711 20 0 BHADMO CCc1ccccc1C[N@@H+](C)Cc1cccs1 ZINC000525833524 323100160 /nfs/dbraw/zinc/10/01/60/323100160.db2.gz LIMHNGFISLAIBJ-UHFFFAOYSA-N 1 1 245.391 3.943 20 0 BHADMO CCc1ccccc1C[N@@H+](C)Cc1ccc(C)o1 ZINC000525833541 323100120 /nfs/dbraw/zinc/10/01/20/323100120.db2.gz OYWVEFIXVRNNKA-UHFFFAOYSA-N 1 1 243.350 3.782 20 0 BHADMO C[C@H](C[N@@H+](C)CC1CC1)c1cccc(Cl)c1 ZINC000525864830 386514472 /nfs/dbraw/zinc/51/44/72/386514472.db2.gz HRFGTXBOFBDIBV-LLVKDONJSA-N 1 1 237.774 3.785 20 0 BHADMO C[C@@H](C[N@@H+](C)CC1CC1)c1cccc(Cl)c1 ZINC000525864831 386516042 /nfs/dbraw/zinc/51/60/42/386516042.db2.gz HRFGTXBOFBDIBV-NSHDSACASA-N 1 1 237.774 3.785 20 0 BHADMO COC[C@@H](C)C[N@@H+](C)Cc1ccc(C(C)C)cc1 ZINC000525865145 259442203 /nfs/dbraw/zinc/44/22/03/259442203.db2.gz MSAUWUHRFWGLLY-AWEZNQCLSA-N 1 1 249.398 3.524 20 0 BHADMO COC[C@H](C)C[N@@H+](C)Cc1ccc(C(C)C)cc1 ZINC000525865146 386514109 /nfs/dbraw/zinc/51/41/09/386514109.db2.gz MSAUWUHRFWGLLY-CQSZACIVSA-N 1 1 249.398 3.524 20 0 BHADMO CC[N@@H+](CCCCOc1ccccc1)CC(C)C ZINC000525865431 386514178 /nfs/dbraw/zinc/51/41/78/386514178.db2.gz KSOPZNUBFOMERK-UHFFFAOYSA-N 1 1 249.398 3.824 20 0 BHADMO COC[C@@H](C)C[N@@H+](CCC(C)C)C1CCCC1 ZINC000525865463 386513662 /nfs/dbraw/zinc/51/36/62/386513662.db2.gz SYHSQKYXTPSRQT-AWEZNQCLSA-N 1 1 241.419 3.560 20 0 BHADMO COC[C@H](C)C[N@@H+](CCC(C)C)C1CCCC1 ZINC000525865464 259441943 /nfs/dbraw/zinc/44/19/43/259441943.db2.gz SYHSQKYXTPSRQT-CQSZACIVSA-N 1 1 241.419 3.560 20 0 BHADMO C[N@@H+](CCCCOc1ccccc1)CC1CCC1 ZINC000525865474 386515520 /nfs/dbraw/zinc/51/55/20/386515520.db2.gz VUFRRTLTONCCMG-UHFFFAOYSA-N 1 1 247.382 3.578 20 0 BHADMO C[C@@H]1C[C@H](C)[N@@H+](CCCCOc2ccccc2)C1 ZINC000525874184 386631879 /nfs/dbraw/zinc/63/18/79/386631879.db2.gz SETQGPZZLAIPMO-CABCVRRESA-N 1 1 247.382 3.576 20 0 BHADMO C[C@H]1C[C@H](C)[N@@H+](CCCCOc2ccccc2)C1 ZINC000525874185 259444268 /nfs/dbraw/zinc/44/42/68/259444268.db2.gz SETQGPZZLAIPMO-GJZGRUSLSA-N 1 1 247.382 3.576 20 0 BHADMO C[C@@H]1C[C@@H](C)[N@@H+](CCCCOc2ccccc2)C1 ZINC000525874186 386630061 /nfs/dbraw/zinc/63/00/61/386630061.db2.gz SETQGPZZLAIPMO-HUUCEWRRSA-N 1 1 247.382 3.576 20 0 BHADMO C[C@@H]1C[C@H](C)C[N@@H+]1CCCCOc1ccccc1 ZINC000525874187 386630419 /nfs/dbraw/zinc/63/04/19/386630419.db2.gz SETQGPZZLAIPMO-LSDHHAIUSA-N 1 1 247.382 3.576 20 0 BHADMO C[C@H](C[N@H+]1CCC[C@@H]1C)c1cccc(Cl)c1 ZINC000525874371 323182346 /nfs/dbraw/zinc/18/23/46/323182346.db2.gz BNNFMCBQZSCHCD-NEPJUHHUSA-N 1 1 237.774 3.928 20 0 BHADMO C[C@@H](C[N@H+]1CCC[C@H]1C)c1cccc(Cl)c1 ZINC000525874372 323182332 /nfs/dbraw/zinc/18/23/32/323182332.db2.gz BNNFMCBQZSCHCD-NWDGAFQWSA-N 1 1 237.774 3.928 20 0 BHADMO C[C@@H](C[N@H+]1CCC[C@@H]1C)c1cccc(Cl)c1 ZINC000525874373 323182349 /nfs/dbraw/zinc/18/23/49/323182349.db2.gz BNNFMCBQZSCHCD-RYUDHWBXSA-N 1 1 237.774 3.928 20 0 BHADMO C[C@H](C[N@H+]1CCC[C@H]1C)c1cccc(Cl)c1 ZINC000525874374 323182340 /nfs/dbraw/zinc/18/23/40/323182340.db2.gz BNNFMCBQZSCHCD-VXGBXAGGSA-N 1 1 237.774 3.928 20 0 BHADMO CC1(C)CCC[N@H+]1CCCCOc1ccccc1 ZINC000525874483 386632406 /nfs/dbraw/zinc/63/24/06/386632406.db2.gz BVMLFHOKEVYVQU-UHFFFAOYSA-N 1 1 247.382 3.720 20 0 BHADMO CC1(C)CC[N@H+]1[C@H]1CC[C@@](C)(c2ccccc2)C1 ZINC000525874686 386631023 /nfs/dbraw/zinc/63/10/23/386631023.db2.gz UALQRCUQFBJMEA-DOTOQJQBSA-N 1 1 243.394 3.981 20 0 BHADMO CC1(C)CC[N@H+]1[C@@H]1CC[C@@](C)(c2ccccc2)C1 ZINC000525874687 386629895 /nfs/dbraw/zinc/62/98/95/386629895.db2.gz UALQRCUQFBJMEA-NVXWUHKLSA-N 1 1 243.394 3.981 20 0 BHADMO CC1(C)CC[N@H+]1[C@H]1CC[C@](C)(c2ccccc2)C1 ZINC000525874688 386630838 /nfs/dbraw/zinc/63/08/38/386630838.db2.gz UALQRCUQFBJMEA-RDJZCZTQSA-N 1 1 243.394 3.981 20 0 BHADMO CC1(C)CC[N@H+]1[C@@H]1CC[C@](C)(c2ccccc2)C1 ZINC000525874689 259444606 /nfs/dbraw/zinc/44/46/06/259444606.db2.gz UALQRCUQFBJMEA-WBVHZDCISA-N 1 1 243.394 3.981 20 0 BHADMO C[C@@H](C[N@H+]1CC[C@@H](C)C1)c1cccc(Cl)c1 ZINC000525875067 386633100 /nfs/dbraw/zinc/63/31/00/386633100.db2.gz PJHQHMKQEPTTGC-NEPJUHHUSA-N 1 1 237.774 3.785 20 0 BHADMO C[C@H](C[N@H+]1CC[C@H](C)C1)c1cccc(Cl)c1 ZINC000525875068 386635332 /nfs/dbraw/zinc/63/53/32/386635332.db2.gz PJHQHMKQEPTTGC-NWDGAFQWSA-N 1 1 237.774 3.785 20 0 BHADMO C[C@@H](C[N@H+]1CC[C@H](C)C1)c1cccc(Cl)c1 ZINC000525875069 386634313 /nfs/dbraw/zinc/63/43/13/386634313.db2.gz PJHQHMKQEPTTGC-RYUDHWBXSA-N 1 1 237.774 3.785 20 0 BHADMO C[C@H](C[N@H+]1CC[C@@H](C)C1)c1cccc(Cl)c1 ZINC000525875070 386634292 /nfs/dbraw/zinc/63/42/92/386634292.db2.gz PJHQHMKQEPTTGC-VXGBXAGGSA-N 1 1 237.774 3.785 20 0 BHADMO C[C@H](C[N@@H+](C)C1CCC1)c1cccc(Cl)c1 ZINC000525875163 259444566 /nfs/dbraw/zinc/44/45/66/259444566.db2.gz GBEFZEMAHWFWEL-LLVKDONJSA-N 1 1 237.774 3.928 20 0 BHADMO C[C@@H](C[N@@H+](C)C1CCC1)c1cccc(Cl)c1 ZINC000525875164 259444557 /nfs/dbraw/zinc/44/45/57/259444557.db2.gz GBEFZEMAHWFWEL-NSHDSACASA-N 1 1 237.774 3.928 20 0 BHADMO CC[C@H](C)C[N@@H+](C)CCCCOc1ccccc1 ZINC000525875253 386633493 /nfs/dbraw/zinc/63/34/93/386633493.db2.gz ULHNKEYGUNKZHJ-HNNXBMFYSA-N 1 1 249.398 3.824 20 0 BHADMO CC[C@@H](C)C[N@@H+](C)CCCCOc1ccccc1 ZINC000525875254 386633984 /nfs/dbraw/zinc/63/39/84/386633984.db2.gz ULHNKEYGUNKZHJ-OAHLLOKOSA-N 1 1 249.398 3.824 20 0 BHADMO CCC(CC)[N@@H+](Cc1cncc(C)c1)C1CC1 ZINC000525949135 357832805 /nfs/dbraw/zinc/83/28/05/357832805.db2.gz AEZOQGVSFGWLFD-UHFFFAOYSA-N 1 1 232.371 3.543 20 0 BHADMO CC[C@@H](C)[N@@H+](Cc1ccccc1)CC1(F)CC1 ZINC000525976751 353861241 /nfs/dbraw/zinc/86/12/41/353861241.db2.gz ABUZTNRGRPUMOD-CYBMUJFWSA-N 1 1 235.346 3.789 20 0 BHADMO CC[C@H](C)[N@@H+](Cc1ccccc1)CC1(F)CC1 ZINC000525976752 353861477 /nfs/dbraw/zinc/86/14/77/353861477.db2.gz ABUZTNRGRPUMOD-ZDUSSCGKSA-N 1 1 235.346 3.789 20 0 BHADMO CCC(CC)[N@@H+](Cc1cnccc1C)C1CC1 ZINC000525976809 388439186 /nfs/dbraw/zinc/43/91/86/388439186.db2.gz MZWUVNYXROIMJO-UHFFFAOYSA-N 1 1 232.371 3.543 20 0 BHADMO CCC[N@@H+](Cc1ccc(C)cc1)CC1(F)CC1 ZINC000525976854 388438883 /nfs/dbraw/zinc/43/88/83/388438883.db2.gz XPFRXCBQHZVXAW-UHFFFAOYSA-N 1 1 235.346 3.709 20 0 BHADMO Cc1ccccc1[C@@H]1CCC[N@H+]1CC1(F)CC1 ZINC000525976855 388438693 /nfs/dbraw/zinc/43/86/93/388438693.db2.gz XTZYUCAHIAUIGG-AWEZNQCLSA-N 1 1 233.330 3.634 20 0 BHADMO Cc1ccccc1[C@H]1CCC[N@H+]1CC1(F)CC1 ZINC000525976856 388438786 /nfs/dbraw/zinc/43/87/86/388438786.db2.gz XTZYUCAHIAUIGG-CQSZACIVSA-N 1 1 233.330 3.634 20 0 BHADMO CC(C)C[N@@H+](CCc1ccccc1)CC1(F)CC1 ZINC000525977480 388439987 /nfs/dbraw/zinc/43/99/87/388439987.db2.gz GZQRCLNKDDHSRI-UHFFFAOYSA-N 1 1 249.373 3.689 20 0 BHADMO Cc1ccc([C@@H]2CCC[N@H+]2CC2(F)CC2)cc1 ZINC000525977548 388439976 /nfs/dbraw/zinc/43/99/76/388439976.db2.gz UDLMPOAJKUKYAE-AWEZNQCLSA-N 1 1 233.330 3.634 20 0 BHADMO Cc1ccc([C@H]2CCC[N@H+]2CC2(F)CC2)cc1 ZINC000525977549 388439668 /nfs/dbraw/zinc/43/96/68/388439668.db2.gz UDLMPOAJKUKYAE-CQSZACIVSA-N 1 1 233.330 3.634 20 0 BHADMO CC[N@@H+](Cc1ccccc1Cl)CC1(F)CC1 ZINC000525977582 388441154 /nfs/dbraw/zinc/44/11/54/388441154.db2.gz ZQMBKWDZEMWWBV-UHFFFAOYSA-N 1 1 241.737 3.664 20 0 BHADMO CC[N@H+](Cc1ccccc1Cl)CC1(F)CC1 ZINC000525977582 388441152 /nfs/dbraw/zinc/44/11/52/388441152.db2.gz ZQMBKWDZEMWWBV-UHFFFAOYSA-N 1 1 241.737 3.664 20 0 BHADMO FC1(C[N@H+]2CCCC3(CCCCC3)C2)CC1 ZINC000525977623 388440836 /nfs/dbraw/zinc/44/08/36/388440836.db2.gz HOVCGINWUTVOCF-UHFFFAOYSA-N 1 1 225.351 3.535 20 0 BHADMO CC[N@@H+](CC1(F)CC1)[C@H](C)c1ccc(F)cc1 ZINC000525977632 388441430 /nfs/dbraw/zinc/44/14/30/388441430.db2.gz JCHLLYJDYHDDNY-LLVKDONJSA-N 1 1 239.309 3.711 20 0 BHADMO CC[N@@H+](CC1(F)CC1)[C@@H](C)c1ccc(F)cc1 ZINC000525977633 388441036 /nfs/dbraw/zinc/44/10/36/388441036.db2.gz JCHLLYJDYHDDNY-NSHDSACASA-N 1 1 239.309 3.711 20 0 BHADMO C[C@]1(c2ccccc2)CCC[N@@H+](CC2(F)CC2)C1 ZINC000525977784 388441407 /nfs/dbraw/zinc/44/14/07/388441407.db2.gz KAZMNKMPCFQOEL-HNNXBMFYSA-N 1 1 247.357 3.542 20 0 BHADMO C[C@@]1(c2ccccc2)CCC[N@@H+](CC2(F)CC2)C1 ZINC000525977785 388441328 /nfs/dbraw/zinc/44/13/28/388441328.db2.gz KAZMNKMPCFQOEL-OAHLLOKOSA-N 1 1 247.357 3.542 20 0 BHADMO Cc1ccc(C[N@@H+](CC2(F)CC2)C2CC2)cc1C ZINC000525977871 388441166 /nfs/dbraw/zinc/44/11/66/388441166.db2.gz ZQLPNOJCOYKHMZ-UHFFFAOYSA-N 1 1 247.357 3.770 20 0 BHADMO Cc1ccc(C[C@@H]2CCC[N@H+]2CC2(F)CC2)cc1 ZINC000525977893 388441367 /nfs/dbraw/zinc/44/13/67/388441367.db2.gz FIMSQUFTJPZWAD-HNNXBMFYSA-N 1 1 247.357 3.504 20 0 BHADMO Cc1ccc(C[C@H]2CCC[N@H+]2CC2(F)CC2)cc1 ZINC000525977894 259711940 /nfs/dbraw/zinc/71/19/40/259711940.db2.gz FIMSQUFTJPZWAD-OAHLLOKOSA-N 1 1 247.357 3.504 20 0 BHADMO FC1(C[N@H+]2CCC[C@H](c3ccccc3)CC2)CC1 ZINC000525978575 386843299 /nfs/dbraw/zinc/84/32/99/386843299.db2.gz AILGMQBJNBGJKU-HNNXBMFYSA-N 1 1 247.357 3.758 20 0 BHADMO FC1(C[N@H+]2CCC[C@@H](c3ccccc3)CC2)CC1 ZINC000525978576 386843594 /nfs/dbraw/zinc/84/35/94/386843594.db2.gz AILGMQBJNBGJKU-OAHLLOKOSA-N 1 1 247.357 3.758 20 0 BHADMO Cc1ccc(C)c([C@@H]2CCC[N@H+]2CC2(F)CC2)c1 ZINC000525978754 388443171 /nfs/dbraw/zinc/44/31/71/388443171.db2.gz CZIQZJOHEAFPNM-HNNXBMFYSA-N 1 1 247.357 3.942 20 0 BHADMO Cc1ccc(C)c([C@H]2CCC[N@H+]2CC2(F)CC2)c1 ZINC000525978755 388442973 /nfs/dbraw/zinc/44/29/73/388442973.db2.gz CZIQZJOHEAFPNM-OAHLLOKOSA-N 1 1 247.357 3.942 20 0 BHADMO Cc1cc([NH+]2CCCC2)ccc1NCC1(F)CC1 ZINC000525979412 388444021 /nfs/dbraw/zinc/44/40/21/388444021.db2.gz YCGUJUZSZSDCLB-UHFFFAOYSA-N 1 1 248.345 3.509 20 0 BHADMO CC(C)[C@H]1CC[N@H+]1Cc1ccc(C(F)F)cc1 ZINC000525981605 388446821 /nfs/dbraw/zinc/44/68/21/388446821.db2.gz KIRSYMJKXRKQDG-CYBMUJFWSA-N 1 1 239.309 3.855 20 0 BHADMO CC(C)[C@@H]1CC[N@H+]1Cc1ccc(C(F)F)cc1 ZINC000525981606 388446902 /nfs/dbraw/zinc/44/69/02/388446902.db2.gz KIRSYMJKXRKQDG-ZDUSSCGKSA-N 1 1 239.309 3.855 20 0 BHADMO Cc1ccc[nH+]c1NCc1ccc(C(F)F)cc1 ZINC000525982054 388448092 /nfs/dbraw/zinc/44/80/92/388448092.db2.gz MUPZVYCTOJCOSK-UHFFFAOYSA-N 1 1 248.276 3.940 20 0 BHADMO Cc1cc(C)cc([C@H]2CC[N@@H+](CC3(F)CC3)C2)c1 ZINC000525993572 388452859 /nfs/dbraw/zinc/45/28/59/388452859.db2.gz JTTMXVPTYGBRIP-AWEZNQCLSA-N 1 1 247.357 3.595 20 0 BHADMO Cc1cc(C)cc([C@@H]2CC[N@@H+](CC3(F)CC3)C2)c1 ZINC000525993573 388452341 /nfs/dbraw/zinc/45/23/41/388452341.db2.gz JTTMXVPTYGBRIP-CQSZACIVSA-N 1 1 247.357 3.595 20 0 BHADMO C[C@@H](C[N@@H+]1[C@H](C)C[C@@H]1C)c1cccc(Cl)c1 ZINC000525996705 388454291 /nfs/dbraw/zinc/45/42/91/388454291.db2.gz XUVYDBBRXHEORJ-SDDRHHMPSA-N 1 1 237.774 3.926 20 0 BHADMO C[C@H](C[N@@H+]1[C@H](C)C[C@@H]1C)c1cccc(Cl)c1 ZINC000525996706 388453980 /nfs/dbraw/zinc/45/39/80/388453980.db2.gz XUVYDBBRXHEORJ-UTUOFQBUSA-N 1 1 237.774 3.926 20 0 BHADMO Cc1cc(C)c(C[N@@H+]2[C@H](C)C[C@@H]2C)cc1C ZINC000525996790 262730231 /nfs/dbraw/zinc/73/02/31/262730231.db2.gz JDGWREORPIRSEO-OKILXGFUSA-N 1 1 217.356 3.595 20 0 BHADMO CC[C@H](C[N@@H+]1[C@H](C)C[C@@H]1C)c1ccccc1 ZINC000525996816 388453508 /nfs/dbraw/zinc/45/35/08/388453508.db2.gz LFVUFWHCBQGQMS-HZSPNIEDSA-N 1 1 217.356 3.663 20 0 BHADMO CC[C@@H](C[N@@H+]1[C@H](C)C[C@@H]1C)c1ccccc1 ZINC000525996819 388453923 /nfs/dbraw/zinc/45/39/23/388453923.db2.gz LFVUFWHCBQGQMS-MJBXVCDLSA-N 1 1 217.356 3.663 20 0 BHADMO C[C@@H]1C[C@H](C)[N@@H+]1Cc1ccc(-c2ccccc2)o1 ZINC000525996934 388453555 /nfs/dbraw/zinc/45/35/55/388453555.db2.gz XAGCNHJDZYZCEI-BETUJISGSA-N 1 1 241.334 3.929 20 0 BHADMO Cc1cc(C[N@@H+]2[C@H](C)C[C@@H]2C)cc2cccnc12 ZINC000525996946 388453540 /nfs/dbraw/zinc/45/35/40/388453540.db2.gz YOTCXUPSTROFJH-BETUJISGSA-N 1 1 240.350 3.526 20 0 BHADMO C[C@@H]1C[C@@H](C)[NH+]1Cc1ccc(C(F)(F)F)s1 ZINC000525996968 388453427 /nfs/dbraw/zinc/45/34/27/388453427.db2.gz CAFQIAAUGREFHF-HTQZYQBOSA-N 1 1 249.301 3.750 20 0 BHADMO C[C@@H]1C[C@H](C)[N@@H+]1Cc1ccc(C(F)(F)F)s1 ZINC000525996969 388453796 /nfs/dbraw/zinc/45/37/96/388453796.db2.gz CAFQIAAUGREFHF-OCAPTIKFSA-N 1 1 249.301 3.750 20 0 BHADMO C[C@@H]1C[C@H](C)[N@H+]1Cc1ccc(C(F)(F)F)s1 ZINC000525996969 388453794 /nfs/dbraw/zinc/45/37/94/388453794.db2.gz CAFQIAAUGREFHF-OCAPTIKFSA-N 1 1 249.301 3.750 20 0 BHADMO C[C@H]1C[C@H](C)[NH+]1Cc1ccc(C(F)(F)F)s1 ZINC000525996970 388454020 /nfs/dbraw/zinc/45/40/20/388454020.db2.gz CAFQIAAUGREFHF-YUMQZZPRSA-N 1 1 249.301 3.750 20 0 BHADMO Cc1oc2ccccc2c1C[N@@H+]1[C@H](C)C[C@@H]1C ZINC000525996987 388454149 /nfs/dbraw/zinc/45/41/49/388454149.db2.gz HOWDZCHHLYQFRG-PHIMTYICSA-N 1 1 229.323 3.724 20 0 BHADMO CCC(C)(C)[N@@H+](C)CCCCOc1ccccc1 ZINC000525997023 388453131 /nfs/dbraw/zinc/45/31/31/388453131.db2.gz NOVNRONMSXZMLD-UHFFFAOYSA-N 1 1 249.398 3.966 20 0 BHADMO C/C(=C\c1ccccc1)C[N@@H+]1[C@H](C)C[C@@H]1C ZINC000525997089 388454110 /nfs/dbraw/zinc/45/41/10/388454110.db2.gz ZWMSEBONSFSWRV-IRBPBCMDSA-N 1 1 215.340 3.573 20 0 BHADMO C/C(=C/c1ccccc1)C[N@@H+]1[C@H](C)C[C@@H]1C ZINC000525997091 388453463 /nfs/dbraw/zinc/45/34/63/388453463.db2.gz ZWMSEBONSFSWRV-JVGGDYBHSA-N 1 1 215.340 3.573 20 0 BHADMO Cc1cc(Cl)ccc1C[N@@H+]1[C@H](C)C[C@@H]1C ZINC000525997363 388453670 /nfs/dbraw/zinc/45/36/70/388453670.db2.gz IXXMDLCJWFNZLW-PHIMTYICSA-N 1 1 223.747 3.631 20 0 BHADMO CCC(C)(C)[N@@H+](C)C[C@@H](C)c1ccccc1 ZINC000525999057 388453872 /nfs/dbraw/zinc/45/38/72/388453872.db2.gz QMSXKJBGZPTFMI-CYBMUJFWSA-N 1 1 219.372 3.911 20 0 BHADMO CCC(C)(C)[N@@H+](C)C[C@H](C)c1ccccc1 ZINC000525999058 388453707 /nfs/dbraw/zinc/45/37/07/388453707.db2.gz QMSXKJBGZPTFMI-ZDUSSCGKSA-N 1 1 219.372 3.911 20 0 BHADMO CCOc1cccc(C[N@@H+](C)C(C)(C)CC)c1 ZINC000525999059 388454013 /nfs/dbraw/zinc/45/40/13/388454013.db2.gz QOXAJVNEUNZCJB-UHFFFAOYSA-N 1 1 235.371 3.706 20 0 BHADMO CCOc1ccc(C[N@@H+](C)C(C)(C)CC)cc1 ZINC000525999359 388454261 /nfs/dbraw/zinc/45/42/61/388454261.db2.gz BMMOKDVBJXNDNA-UHFFFAOYSA-N 1 1 235.371 3.706 20 0 BHADMO CCC(C)(C)[N@@H+](C)Cc1ccc(F)cc1C ZINC000526077013 386814436 /nfs/dbraw/zinc/81/44/36/386814436.db2.gz SJDSQNYTPUTNGA-UHFFFAOYSA-N 1 1 223.335 3.755 20 0 BHADMO CCC(C)(C)[N@@H+](C)CCCOCc1ccccc1 ZINC000526077016 386813929 /nfs/dbraw/zinc/81/39/29/386813929.db2.gz SRRCNEXHMZBYFK-UHFFFAOYSA-N 1 1 249.398 3.714 20 0 BHADMO CCC(C)(C)[N@@H+](C)CCCc1ccsc1 ZINC000526077499 386810707 /nfs/dbraw/zinc/81/07/07/386810707.db2.gz XKDCDDSWFPXZJY-UHFFFAOYSA-N 1 1 225.401 3.801 20 0 BHADMO CCC[N@@H+](Cc1cc(F)ccc1Cl)C1CC1 ZINC000526083021 323187955 /nfs/dbraw/zinc/18/79/55/323187955.db2.gz CTYSDZGTRGSPKH-UHFFFAOYSA-N 1 1 241.737 3.854 20 0 BHADMO CC(C)[N@@H+](Cc1cc(F)ccc1Cl)C1CC1 ZINC000526083663 323188398 /nfs/dbraw/zinc/18/83/98/323188398.db2.gz KJSNTPMMWKRIOH-UHFFFAOYSA-N 1 1 241.737 3.852 20 0 BHADMO CCC[N@@H+](CC)CCCCOc1ccccc1 ZINC000526114146 323228277 /nfs/dbraw/zinc/22/82/77/323228277.db2.gz VMFGCXLNGDHGFS-UHFFFAOYSA-N 1 1 235.371 3.578 20 0 BHADMO CC(C)CCC[N@@H+](Cc1ccccn1)C(C)C ZINC000526114257 356225932 /nfs/dbraw/zinc/22/59/32/356225932.db2.gz ANHXPWPVZWOLII-UHFFFAOYSA-N 1 1 234.387 3.728 20 0 BHADMO CC(C)[N@@H+](CCCCOc1ccccc1)C1CC1 ZINC000526115716 323229582 /nfs/dbraw/zinc/22/95/82/323229582.db2.gz CHSCQUFJFRXXKU-UHFFFAOYSA-N 1 1 247.382 3.718 20 0 BHADMO CCc1nc(C[N@@H+](C)CCCC(C)C)cs1 ZINC000526115746 323229517 /nfs/dbraw/zinc/22/95/17/323229517.db2.gz NTNRNYDDTCNMAG-UHFFFAOYSA-N 1 1 240.416 3.574 20 0 BHADMO CCc1nc(C[N@H+](C)CCCC(C)C)cs1 ZINC000526115746 323229514 /nfs/dbraw/zinc/22/95/14/323229514.db2.gz NTNRNYDDTCNMAG-UHFFFAOYSA-N 1 1 240.416 3.574 20 0 BHADMO COC[C@H](C)C[N@@H+](C)[C@@H](c1ccccc1)C(C)C ZINC000526124242 356360873 /nfs/dbraw/zinc/36/08/73/356360873.db2.gz VEJMIXPWWURHTE-GDBMZVCRSA-N 1 1 249.398 3.598 20 0 BHADMO COC[C@@H](C)C[N@@H+](C)[C@@H](c1ccccc1)C(C)C ZINC000526124243 356360967 /nfs/dbraw/zinc/36/09/67/356360967.db2.gz VEJMIXPWWURHTE-GOEBONIOSA-N 1 1 249.398 3.598 20 0 BHADMO COC[C@@H](C)C[N@@H+](C)[C@H](c1ccccc1)C(C)C ZINC000526124244 356361124 /nfs/dbraw/zinc/36/11/24/356361124.db2.gz VEJMIXPWWURHTE-HOCLYGCPSA-N 1 1 249.398 3.598 20 0 BHADMO COC[C@H](C)C[N@@H+](C)[C@H](c1ccccc1)C(C)C ZINC000526124245 356360893 /nfs/dbraw/zinc/36/08/93/356360893.db2.gz VEJMIXPWWURHTE-ZBFHGGJFSA-N 1 1 249.398 3.598 20 0 BHADMO CC[N@@H+](CC=C(C)C)Cc1c[nH]c2ccccc12 ZINC000526949890 386702794 /nfs/dbraw/zinc/70/27/94/386702794.db2.gz NIUWFEZEXULQRB-UHFFFAOYSA-N 1 1 242.366 3.956 20 0 BHADMO C[C@H](Cc1ccsc1)[N@H+]1CCCC(C)(C)C1 ZINC000526966281 323309227 /nfs/dbraw/zinc/30/92/27/323309227.db2.gz JPAZVFHTVSLPLW-GFCCVEGCSA-N 1 1 237.412 3.801 20 0 BHADMO C[C@@H](Cc1ccsc1)[N@H+]1CCCC(C)(C)C1 ZINC000526966282 323309187 /nfs/dbraw/zinc/30/91/87/323309187.db2.gz JPAZVFHTVSLPLW-LBPRGKRZSA-N 1 1 237.412 3.801 20 0 BHADMO Cc1cccc([C@@H]2CCC[N@H+]2CC2(F)CC2)c1 ZINC000526969399 323309307 /nfs/dbraw/zinc/30/93/07/323309307.db2.gz ODCCVCYICIZNIG-AWEZNQCLSA-N 1 1 233.330 3.634 20 0 BHADMO Cc1cccc([C@H]2CCC[N@H+]2CC2(F)CC2)c1 ZINC000526969400 323308921 /nfs/dbraw/zinc/30/89/21/323308921.db2.gz ODCCVCYICIZNIG-CQSZACIVSA-N 1 1 233.330 3.634 20 0 BHADMO FC1(C[N@H+](Cc2ccccc2)CC2CCC2)CC1 ZINC000526969928 323308879 /nfs/dbraw/zinc/30/88/79/323308879.db2.gz RSJIBNDSWJPGRN-UHFFFAOYSA-N 1 1 247.357 3.791 20 0 BHADMO CCc1ccc(C[N@@H+](CC2(F)CC2)C2CC2)cc1 ZINC000526970021 323309494 /nfs/dbraw/zinc/30/94/94/323309494.db2.gz YRXOJUOOFQWKBJ-UHFFFAOYSA-N 1 1 247.357 3.716 20 0 BHADMO CC(C)[N@@H+](Cc1ccc(F)cc1)CC1(F)CC1 ZINC000526970163 323309502 /nfs/dbraw/zinc/30/95/02/323309502.db2.gz YOGYUBSITCCGLY-UHFFFAOYSA-N 1 1 239.309 3.538 20 0 BHADMO CC(C)CC[N@@H+](CC1(F)CC1)C1CCCC1 ZINC000526970278 323309744 /nfs/dbraw/zinc/30/97/44/323309744.db2.gz PJMSTRYDHFWJFE-UHFFFAOYSA-N 1 1 227.367 3.779 20 0 BHADMO CCC(CC)[N@@H+](CC(C)C)CC1(F)CC1 ZINC000526970372 386714151 /nfs/dbraw/zinc/71/41/51/386714151.db2.gz DIGQUMPVTWBYJO-UHFFFAOYSA-N 1 1 215.356 3.635 20 0 BHADMO FC1(C[N@H+]2CCCC[C@H]2Cc2ccccc2)CC1 ZINC000526970860 386714431 /nfs/dbraw/zinc/71/44/31/386714431.db2.gz RLGZQKHPXFSDFG-HNNXBMFYSA-N 1 1 247.357 3.586 20 0 BHADMO FC1(C[N@H+]2CCCC[C@@H]2Cc2ccccc2)CC1 ZINC000526970861 386713540 /nfs/dbraw/zinc/71/35/40/386713540.db2.gz RLGZQKHPXFSDFG-OAHLLOKOSA-N 1 1 247.357 3.586 20 0 BHADMO C[C@H]1C[N@@H+](CC2(F)CC2)CC[C@H]1c1ccccc1 ZINC000526971264 386715354 /nfs/dbraw/zinc/71/53/54/386715354.db2.gz JYWJSAGZGUBIRK-DZGCQCFKSA-N 1 1 247.357 3.614 20 0 BHADMO C[C@@H]1C[N@@H+](CC2(F)CC2)CC[C@@H]1c1ccccc1 ZINC000526971265 386714011 /nfs/dbraw/zinc/71/40/11/386714011.db2.gz JYWJSAGZGUBIRK-HIFRSBDPSA-N 1 1 247.357 3.614 20 0 BHADMO C[C@@H]1C[N@@H+](CC2(F)CC2)CC[C@H]1c1ccccc1 ZINC000526971266 386715183 /nfs/dbraw/zinc/71/51/83/386715183.db2.gz JYWJSAGZGUBIRK-UKRRQHHQSA-N 1 1 247.357 3.614 20 0 BHADMO C[C@H]1C[N@@H+](CC2(F)CC2)CC[C@@H]1c1ccccc1 ZINC000526971267 386714772 /nfs/dbraw/zinc/71/47/72/386714772.db2.gz JYWJSAGZGUBIRK-ZFWWWQNUSA-N 1 1 247.357 3.614 20 0 BHADMO CC[C@@H](Cc1ccccc1)[N@@H+](CC)CC1(F)CC1 ZINC000526971665 386715395 /nfs/dbraw/zinc/71/53/95/386715395.db2.gz VDKDVLYFHGSUMV-HNNXBMFYSA-N 1 1 249.373 3.832 20 0 BHADMO CC[C@H](Cc1ccccc1)[N@@H+](CC)CC1(F)CC1 ZINC000526971666 386715463 /nfs/dbraw/zinc/71/54/63/386715463.db2.gz VDKDVLYFHGSUMV-OAHLLOKOSA-N 1 1 249.373 3.832 20 0 BHADMO CCCCC[C@@H]1CCC[N@H+]1CC1(F)CC1 ZINC000526973445 583931614 /nfs/dbraw/zinc/93/16/14/583931614.db2.gz YVFUYIMIFHRXSM-GFCCVEGCSA-N 1 1 213.340 3.533 20 0 BHADMO CCCCC[C@H]1CCC[N@H+]1CC1(F)CC1 ZINC000526973446 583931642 /nfs/dbraw/zinc/93/16/42/583931642.db2.gz YVFUYIMIFHRXSM-LBPRGKRZSA-N 1 1 213.340 3.533 20 0 BHADMO CCC[N@@H+](CCc1cccs1)CC1(F)CC1 ZINC000526984863 386717917 /nfs/dbraw/zinc/71/79/17/386717917.db2.gz LZTHLCLOGHWMOB-UHFFFAOYSA-N 1 1 241.375 3.505 20 0 BHADMO C[C@@H]1C[C@H](C)[N@@H+]1[C@H]1CC[C@](C)(c2ccccc2)C1 ZINC000526989304 262801705 /nfs/dbraw/zinc/80/17/05/262801705.db2.gz IJPFFBXTNRRFFA-FSDCSDTHSA-N 1 1 243.394 3.980 20 0 BHADMO C[C@@H]1C[C@H](C)[N@@H+]1[C@H]1CC[C@@](C)(c2ccccc2)C1 ZINC000526989305 262801551 /nfs/dbraw/zinc/80/15/51/262801551.db2.gz IJPFFBXTNRRFFA-HDEZJCGLSA-N 1 1 243.394 3.980 20 0 BHADMO C[C@@H]1C[C@H](C)[N@@H+]1[C@@H]1CC[C@](C)(c2ccccc2)C1 ZINC000526989306 386726740 /nfs/dbraw/zinc/72/67/40/386726740.db2.gz IJPFFBXTNRRFFA-WTTBNOFXSA-N 1 1 243.394 3.980 20 0 BHADMO C[C@@H]1C[C@H](C)[N@@H+]1[C@@H]1CC[C@@](C)(c2ccccc2)C1 ZINC000526989307 386726411 /nfs/dbraw/zinc/72/64/11/386726411.db2.gz IJPFFBXTNRRFFA-YALNPMBYSA-N 1 1 243.394 3.980 20 0 BHADMO C[C@@H]1C[C@H](C)[N@@H+]1Cc1cc2cc(F)ccc2o1 ZINC000526989309 386726709 /nfs/dbraw/zinc/72/67/09/386726709.db2.gz IZVDDNPQYUKUBE-AOOOYVTPSA-N 1 1 233.286 3.555 20 0 BHADMO C[C@@H](CCc1cccc(F)c1)[N@@H+]1[C@H](C)C[C@@H]1C ZINC000526989429 386726468 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386760892 /nfs/dbraw/zinc/76/08/92/386760892.db2.gz LSXPKNZKODSXCB-UHFFFAOYSA-N 1 1 249.398 3.632 20 0 BHADMO C[N@@H+](CCC1CC1)Cc1cc(Cl)ccc1F ZINC000527048173 386760340 /nfs/dbraw/zinc/76/03/40/386760340.db2.gz OALNSOALTPYTBG-UHFFFAOYSA-N 1 1 241.737 3.711 20 0 BHADMO CC(C)=CC[N@H+]1CC[C@H](C(F)(F)F)C1(C)C ZINC000527053240 386759664 /nfs/dbraw/zinc/75/96/64/386759664.db2.gz VTLJBFZBZYNMBD-JTQLQIEISA-N 1 1 235.293 3.615 20 0 BHADMO CC(C)=CC[N@H+]1CC[C@@H](C(F)(F)F)C1(C)C ZINC000527053241 386761104 /nfs/dbraw/zinc/76/11/04/386761104.db2.gz VTLJBFZBZYNMBD-SNVBAGLBSA-N 1 1 235.293 3.615 20 0 BHADMO c1cc(C[N@H+]2CCCC3(CCCCC3)CC2)on1 ZINC000527055991 386767219 /nfs/dbraw/zinc/76/72/19/386767219.db2.gz SWLNCWXREKYHRW-UHFFFAOYSA-N 1 1 248.370 3.611 20 0 BHADMO C[N@H+](Cc1cc(F)ccc1Cl)CC1CCC1 ZINC000527074179 386775644 /nfs/dbraw/zinc/77/56/44/386775644.db2.gz FNSYNAFFEDMAEJ-UHFFFAOYSA-N 1 1 241.737 3.711 20 0 BHADMO CC(C)C[N@@H+](C)Cc1cc(F)ccc1Cl ZINC000527074212 386775832 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CC[C@H]([NH2+]Cc1ccon1)c1cc(C)ccc1C ZINC000527867266 387739741 /nfs/dbraw/zinc/73/97/41/387739741.db2.gz PLYKFWAMZNWOOD-HNNXBMFYSA-N 1 1 244.338 3.532 20 0 BHADMO CC[C@@H]([NH2+]Cc1ccon1)c1cc(C)ccc1C ZINC000527867268 387741564 /nfs/dbraw/zinc/74/15/64/387741564.db2.gz PLYKFWAMZNWOOD-OAHLLOKOSA-N 1 1 244.338 3.532 20 0 BHADMO C[C@@H](Nc1cccc2cc[nH+]cc21)[C@H]1CC12CC2 ZINC000527881736 387771287 /nfs/dbraw/zinc/77/12/87/387771287.db2.gz IKPKFVALQPJKPN-BXUZGUMPSA-N 1 1 238.334 3.835 20 0 BHADMO C[C@H](Nc1cccc2cc[nH+]cc21)[C@@H]1CC12CC2 ZINC000527881737 387771233 /nfs/dbraw/zinc/77/12/33/387771233.db2.gz IKPKFVALQPJKPN-FZMZJTMJSA-N 1 1 238.334 3.835 20 0 BHADMO C[C@@H](Nc1cccc2cc[nH+]cc21)[C@@H]1CC12CC2 ZINC000527881738 262890150 /nfs/dbraw/zinc/89/01/50/262890150.db2.gz IKPKFVALQPJKPN-RISCZKNCSA-N 1 1 238.334 3.835 20 0 BHADMO C[C@H](Nc1cccc2cc[nH+]cc21)[C@H]1CC12CC2 ZINC000527881739 387771591 /nfs/dbraw/zinc/77/15/91/387771591.db2.gz IKPKFVALQPJKPN-SMDDNHRTSA-N 1 1 238.334 3.835 20 0 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244.313 3.633 20 0 BHADMO CC(C)(F)CCNc1[nH+]ccc2ccccc21 ZINC000528053211 387837547 /nfs/dbraw/zinc/83/75/47/387837547.db2.gz JSLCDGFPWWWNKS-UHFFFAOYSA-N 1 1 232.302 3.785 20 0 BHADMO C[C@]1(CNc2[nH+]ccc3ccccc32)CC1(F)F ZINC000528053821 387837968 /nfs/dbraw/zinc/83/79/68/387837968.db2.gz KVJHTLOLGXTTQJ-CYBMUJFWSA-N 1 1 248.276 3.692 20 0 BHADMO C[C@@]1(CNc2[nH+]ccc3ccccc32)CC1(F)F ZINC000528053823 387838833 /nfs/dbraw/zinc/83/88/33/387838833.db2.gz KVJHTLOLGXTTQJ-ZDUSSCGKSA-N 1 1 248.276 3.692 20 0 BHADMO FC1(F)C[C@H]1CCNc1[nH+]ccc2ccccc21 ZINC000528057829 323754215 /nfs/dbraw/zinc/75/42/15/323754215.db2.gz JHEXPBNNTHIATR-LLVKDONJSA-N 1 1 248.276 3.692 20 0 BHADMO FC1(F)C[C@@H]1CCNc1[nH+]ccc2ccccc21 ZINC000528058016 387838638 /nfs/dbraw/zinc/83/86/38/387838638.db2.gz JHEXPBNNTHIATR-NSHDSACASA-N 1 1 248.276 3.692 20 0 BHADMO C1=CCC(CNc2[nH+]ccc3ccccc32)C1 ZINC000528112776 387848686 /nfs/dbraw/zinc/84/86/86/387848686.db2.gz FFBWDZHRGVJSPH-UHFFFAOYSA-N 1 1 224.307 3.613 20 0 BHADMO CC[N@@H+](C/C=C(/C)Cl)Cc1cccs1 ZINC000528337051 262911294 /nfs/dbraw/zinc/91/12/94/262911294.db2.gz KGTAXJDWCXOUAJ-POHAHGRESA-N 1 1 229.776 3.713 20 0 BHADMO CC[N@@H+](C/C=C(\C)Cl)Cc1cccs1 ZINC000528337058 387895288 /nfs/dbraw/zinc/89/52/88/387895288.db2.gz KGTAXJDWCXOUAJ-UXBLZVDNSA-N 1 1 229.776 3.713 20 0 BHADMO C/C(Cl)=C\C[N@H+](C)Cc1sccc1C ZINC000528338611 387894860 /nfs/dbraw/zinc/89/48/60/387894860.db2.gz MBXXBRIIKGGIBJ-ONNFQVAWSA-N 1 1 229.776 3.631 20 0 BHADMO C/C(Cl)=C/C[N@H+](C)Cc1sccc1C ZINC000528338612 387895855 /nfs/dbraw/zinc/89/58/55/387895855.db2.gz MBXXBRIIKGGIBJ-WMZJFQQLSA-N 1 1 229.776 3.631 20 0 BHADMO C/C(Cl)=C/C[N@@H+](Cc1cccs1)C1CC1 ZINC000528339082 387894697 /nfs/dbraw/zinc/89/46/97/387894697.db2.gz IVIADTNQIGXLIB-POHAHGRESA-N 1 1 241.787 3.855 20 0 BHADMO C/C(Cl)=C/C[N@H+](Cc1cccs1)C1CC1 ZINC000528339082 387894694 /nfs/dbraw/zinc/89/46/94/387894694.db2.gz IVIADTNQIGXLIB-POHAHGRESA-N 1 1 241.787 3.855 20 0 BHADMO C/C(Cl)=C\C[N@@H+](Cc1cccs1)C1CC1 ZINC000528339086 387895308 /nfs/dbraw/zinc/89/53/08/387895308.db2.gz IVIADTNQIGXLIB-UXBLZVDNSA-N 1 1 241.787 3.855 20 0 BHADMO C/C(Cl)=C\C[N@H+](Cc1cccs1)C1CC1 ZINC000528339086 387895302 /nfs/dbraw/zinc/89/53/02/387895302.db2.gz IVIADTNQIGXLIB-UXBLZVDNSA-N 1 1 241.787 3.855 20 0 BHADMO CCCC[N@@H+](C)Cc1nc2cc(C)ccc2s1 ZINC000528341508 387895406 /nfs/dbraw/zinc/89/54/06/387895406.db2.gz WOAUZDQALCUSGB-UHFFFAOYSA-N 1 1 248.395 3.837 20 0 BHADMO C/C(Cl)=C\C[N@H+](C)[C@H](C)c1ccccc1 ZINC000528343004 262911355 /nfs/dbraw/zinc/91/13/55/262911355.db2.gz WYXQHHABRMGKPT-LMMOQWNQSA-N 1 1 223.747 3.822 20 0 BHADMO C/C(Cl)=C/C[N@H+](C)[C@@H](C)c1ccccc1 ZINC000528343005 387895871 /nfs/dbraw/zinc/89/58/71/387895871.db2.gz WYXQHHABRMGKPT-MMRAYRKESA-N 1 1 223.747 3.822 20 0 BHADMO C/C(Cl)=C/C[N@H+](C)[C@H](C)c1ccccc1 ZINC000528343006 387895473 /nfs/dbraw/zinc/89/54/73/387895473.db2.gz WYXQHHABRMGKPT-UCQJPZFISA-N 1 1 223.747 3.822 20 0 BHADMO C/C(Cl)=C\C[N@H+](C)[C@@H](C)c1ccccc1 ZINC000528343007 387895492 /nfs/dbraw/zinc/89/54/92/387895492.db2.gz WYXQHHABRMGKPT-ZKQHCESOSA-N 1 1 223.747 3.822 20 0 BHADMO CC[N@@H+](Cc1nc2cc(C)ccc2s1)C1CC1 ZINC000528351122 387907257 /nfs/dbraw/zinc/90/72/57/387907257.db2.gz QCGHHGHLYPQNGL-UHFFFAOYSA-N 1 1 246.379 3.589 20 0 BHADMO CC(C)C[N@@H+](Cc1ncccc1Cl)C(C)C ZINC000528351441 387906492 /nfs/dbraw/zinc/90/64/92/387906492.db2.gz OJYSFTVAZDXSJW-UHFFFAOYSA-N 1 1 240.778 3.601 20 0 BHADMO C[C@H]([N@@H+](C)Cc1ncccc1Cl)C(C)(C)C ZINC000528351522 387907246 /nfs/dbraw/zinc/90/72/46/387907246.db2.gz WZRZYAJNNSWTOF-JTQLQIEISA-N 1 1 240.778 3.601 20 0 BHADMO C[C@@H]([N@@H+](C)Cc1ncccc1Cl)C(C)(C)C ZINC000528351524 387905504 /nfs/dbraw/zinc/90/55/04/387905504.db2.gz WZRZYAJNNSWTOF-SNVBAGLBSA-N 1 1 240.778 3.601 20 0 BHADMO C/C(Cl)=C/C[N@H+](C)Cc1ccc(F)c(F)c1 ZINC000528354487 387908378 /nfs/dbraw/zinc/90/83/78/387908378.db2.gz YQDKPCSLELLMKR-UITAMQMPSA-N 1 1 245.700 3.539 20 0 BHADMO C/C(Cl)=C/C[N@@H+](C)Cc1ccc(F)c(F)c1 ZINC000528354487 387908373 /nfs/dbraw/zinc/90/83/73/387908373.db2.gz YQDKPCSLELLMKR-UITAMQMPSA-N 1 1 245.700 3.539 20 0 BHADMO C/C(Cl)=C\C[N@H+](C)Cc1ccc(F)c(F)c1 ZINC000528354489 387907513 /nfs/dbraw/zinc/90/75/13/387907513.db2.gz YQDKPCSLELLMKR-WEVVVXLNSA-N 1 1 245.700 3.539 20 0 BHADMO C/C(Cl)=C\C[N@@H+](C)Cc1ccc(F)c(F)c1 ZINC000528354489 387907507 /nfs/dbraw/zinc/90/75/07/387907507.db2.gz YQDKPCSLELLMKR-WEVVVXLNSA-N 1 1 245.700 3.539 20 0 BHADMO CC[N@@H+](Cc1nc2cc(C)ccc2s1)C(C)C ZINC000528354563 387907492 /nfs/dbraw/zinc/90/74/92/387907492.db2.gz QONJDNVLYJNOSM-UHFFFAOYSA-N 1 1 248.395 3.835 20 0 BHADMO C/C(Cl)=C\C[N@@H+](Cc1ccc(C)o1)C1CC1 ZINC000528355676 387908488 /nfs/dbraw/zinc/90/84/88/387908488.db2.gz NGLLVKNNNHZMJB-JXMROGBWSA-N 1 1 239.746 3.695 20 0 BHADMO C/C(Cl)=C\C[N@H+](Cc1ccc(C)o1)C1CC1 ZINC000528355676 387908485 /nfs/dbraw/zinc/90/84/85/387908485.db2.gz NGLLVKNNNHZMJB-JXMROGBWSA-N 1 1 239.746 3.695 20 0 BHADMO C/C(Cl)=C/C[N@@H+](Cc1ccc(C)o1)C1CC1 ZINC000528355681 387909114 /nfs/dbraw/zinc/90/91/14/387909114.db2.gz NGLLVKNNNHZMJB-YFHOEESVSA-N 1 1 239.746 3.695 20 0 BHADMO C/C(Cl)=C/C[N@H+](Cc1ccc(C)o1)C1CC1 ZINC000528355681 387909108 /nfs/dbraw/zinc/90/91/08/387909108.db2.gz NGLLVKNNNHZMJB-YFHOEESVSA-N 1 1 239.746 3.695 20 0 BHADMO Cc1cc([C@H]2CCC[N@H+]2CC2CC(C)(C)C2)on1 ZINC000528356676 387908121 /nfs/dbraw/zinc/90/81/21/387908121.db2.gz MAUAIWUJPWUIGK-CYBMUJFWSA-N 1 1 248.370 3.556 20 0 BHADMO Cc1cc([C@@H]2CCC[N@H+]2CC2CC(C)(C)C2)on1 ZINC000528356682 387908707 /nfs/dbraw/zinc/90/87/07/387908707.db2.gz MAUAIWUJPWUIGK-ZDUSSCGKSA-N 1 1 248.370 3.556 20 0 BHADMO CC[N@@H+](Cc1ncccc1Cl)[C@H](C)C(C)C ZINC000528356841 387909234 /nfs/dbraw/zinc/90/92/34/387909234.db2.gz FAVFVCPCEBJABE-LLVKDONJSA-N 1 1 240.778 3.601 20 0 BHADMO CC[N@@H+](Cc1ncccc1Cl)[C@@H](C)C(C)C ZINC000528356842 387907434 /nfs/dbraw/zinc/90/74/34/387907434.db2.gz FAVFVCPCEBJABE-NSHDSACASA-N 1 1 240.778 3.601 20 0 BHADMO C/C(Cl)=C/C[N@H+](C)[C@H](C)c1cccs1 ZINC000528357450 387907788 /nfs/dbraw/zinc/90/77/88/387907788.db2.gz SXANUTYINUQHNM-ABRRARGCSA-N 1 1 229.776 3.884 20 0 BHADMO C/C(Cl)=C/C[N@H+](C)[C@@H](C)c1cccs1 ZINC000528357453 387908475 /nfs/dbraw/zinc/90/84/75/387908475.db2.gz SXANUTYINUQHNM-MBACFSSFSA-N 1 1 229.776 3.884 20 0 BHADMO C/C(Cl)=C\C[N@H+](C)[C@H](C)c1cccs1 ZINC000528357455 387907705 /nfs/dbraw/zinc/90/77/05/387907705.db2.gz SXANUTYINUQHNM-OLKPEBQYSA-N 1 1 229.776 3.884 20 0 BHADMO C/C(Cl)=C\C[N@H+](C)[C@@H](C)c1cccs1 ZINC000528357456 387908460 /nfs/dbraw/zinc/90/84/60/387908460.db2.gz SXANUTYINUQHNM-ZKXNXJMVSA-N 1 1 229.776 3.884 20 0 BHADMO CC(C)[N@H+](Cc1ccccn1)CC1CC(C)(C)C1 ZINC000528358011 387907649 /nfs/dbraw/zinc/90/76/49/387907649.db2.gz XRVSESAWJHRUEK-UHFFFAOYSA-N 1 1 246.398 3.728 20 0 BHADMO C/C(Cl)=C\C[N@@H+](Cc1ccco1)C(C)C ZINC000528359578 387910604 /nfs/dbraw/zinc/91/06/04/387910604.db2.gz JVLWTBFJXVWGMT-IZZDOVSWSA-N 1 1 227.735 3.633 20 0 BHADMO C/C(Cl)=C\C[N@H+](Cc1ccco1)C(C)C ZINC000528359578 387910600 /nfs/dbraw/zinc/91/06/00/387910600.db2.gz JVLWTBFJXVWGMT-IZZDOVSWSA-N 1 1 227.735 3.633 20 0 BHADMO C/C(Cl)=C/C[N@@H+](Cc1ccco1)C(C)C ZINC000528359581 387911538 /nfs/dbraw/zinc/91/15/38/387911538.db2.gz JVLWTBFJXVWGMT-WDZFZDKYSA-N 1 1 227.735 3.633 20 0 BHADMO C/C(Cl)=C/C[N@H+](Cc1ccco1)C(C)C ZINC000528359581 387911533 /nfs/dbraw/zinc/91/15/33/387911533.db2.gz JVLWTBFJXVWGMT-WDZFZDKYSA-N 1 1 227.735 3.633 20 0 BHADMO CCC[N@@H+](CC)Cc1nc2cc(C)ccc2s1 ZINC000528360158 387911316 /nfs/dbraw/zinc/91/13/16/387911316.db2.gz NGWHBSHUNQPZOB-UHFFFAOYSA-N 1 1 248.395 3.837 20 0 BHADMO Cc1ccc2sc(C[N@H+](C)CC(C)C)nc2c1 ZINC000528360269 387911099 /nfs/dbraw/zinc/91/10/99/387911099.db2.gz NYNZGGFIJBKJML-UHFFFAOYSA-N 1 1 248.395 3.693 20 0 BHADMO CCC[N@H+](Cc1ncccc1Cl)CC(C)C ZINC000528368739 388451780 /nfs/dbraw/zinc/45/17/80/388451780.db2.gz WBVGUUNUCSNZIK-UHFFFAOYSA-N 1 1 240.778 3.603 20 0 BHADMO C/C(Cl)=C\C[N@H+](C)Cc1ccc(C)s1 ZINC000528371866 388451932 /nfs/dbraw/zinc/45/19/32/388451932.db2.gz KSTWNXSWGBWXJE-RMKNXTFCSA-N 1 1 229.776 3.631 20 0 BHADMO C/C(Cl)=C/C[N@H+](C)Cc1ccc(C)s1 ZINC000528371867 388451789 /nfs/dbraw/zinc/45/17/89/388451789.db2.gz KSTWNXSWGBWXJE-TWGQIWQCSA-N 1 1 229.776 3.631 20 0 BHADMO C/C(Cl)=C\C[N@H+]1CCCc2sccc2C1 ZINC000528376062 385776037 /nfs/dbraw/zinc/77/60/37/385776037.db2.gz FTFOQQVJVURAIC-ONNFQVAWSA-N 1 1 241.787 3.639 20 0 BHADMO C/C(Cl)=C/C[N@H+]1CCCc2sccc2C1 ZINC000528376064 385777418 /nfs/dbraw/zinc/77/74/18/385777418.db2.gz FTFOQQVJVURAIC-WMZJFQQLSA-N 1 1 241.787 3.639 20 0 BHADMO C/C(Cl)=C\C[N@@H+](C1CC1)C1CCCC1 ZINC000528379688 388518139 /nfs/dbraw/zinc/51/81/39/388518139.db2.gz JKLRCKLMAQSBAO-CSKARUKUSA-N 1 1 213.752 3.536 20 0 BHADMO C/C(Cl)=C/C[N@@H+](C1CC1)C1CCCC1 ZINC000528379689 388518644 /nfs/dbraw/zinc/51/86/44/388518644.db2.gz JKLRCKLMAQSBAO-NTMALXAHSA-N 1 1 213.752 3.536 20 0 BHADMO C/C(Cl)=C/C[N@H+]1CCCC[C@H]1c1ccco1 ZINC000528381286 262943114 /nfs/dbraw/zinc/94/31/14/262943114.db2.gz HBDIXJAUSSOEBD-RDQDRAATSA-N 1 1 239.746 3.949 20 0 BHADMO C/C(Cl)=C/C[N@H+]1CCCC[C@@H]1c1ccco1 ZINC000528381296 388518536 /nfs/dbraw/zinc/51/85/36/388518536.db2.gz HBDIXJAUSSOEBD-SEVUFMINSA-N 1 1 239.746 3.949 20 0 BHADMO C/C(Cl)=C\C[N@H+]1CCCC[C@H]1c1ccco1 ZINC000528381302 388518507 /nfs/dbraw/zinc/51/85/07/388518507.db2.gz HBDIXJAUSSOEBD-VNKGSWCUSA-N 1 1 239.746 3.949 20 0 BHADMO C/C(Cl)=C\C[N@H+]1CCCC[C@@H]1c1ccco1 ZINC000528381308 388517609 /nfs/dbraw/zinc/51/76/09/388517609.db2.gz HBDIXJAUSSOEBD-YTRUQHMWSA-N 1 1 239.746 3.949 20 0 BHADMO C/C(Cl)=C/C[N@H+]1CCC[C@@H]1c1ccc(C)o1 ZINC000528381411 386816954 /nfs/dbraw/zinc/81/69/54/386816954.db2.gz HHSUILBBDVDTPA-MQGYJPLLSA-N 1 1 239.746 3.868 20 0 BHADMO C/C(Cl)=C\C[N@H+]1CCC[C@@H]1c1ccc(C)o1 ZINC000528381422 386815739 /nfs/dbraw/zinc/81/57/39/386815739.db2.gz HHSUILBBDVDTPA-OFFHKIPUSA-N 1 1 239.746 3.868 20 0 BHADMO C/C(Cl)=C\C[N@H+]1CCC[C@H]1c1ccc(C)o1 ZINC000528381426 386815158 /nfs/dbraw/zinc/81/51/58/386815158.db2.gz HHSUILBBDVDTPA-PMDBQALLSA-N 1 1 239.746 3.868 20 0 BHADMO C/C(Cl)=C/C[N@H+]1CCC[C@H]1c1ccc(C)o1 ZINC000528381430 386815189 /nfs/dbraw/zinc/81/51/89/386815189.db2.gz HHSUILBBDVDTPA-UMAGTOLTSA-N 1 1 239.746 3.868 20 0 BHADMO C/C(Cl)=C\C[N@H+]1CCC[C@@H]1c1ccco1 ZINC000528385147 388520114 /nfs/dbraw/zinc/52/01/14/388520114.db2.gz WWCAOLXLGVXTAU-CDCCAWJDSA-N 1 1 225.719 3.559 20 0 BHADMO C/C(Cl)=C\C[N@H+]1CCC[C@H]1c1ccco1 ZINC000528385148 388519916 /nfs/dbraw/zinc/51/99/16/388519916.db2.gz WWCAOLXLGVXTAU-RUYJGKKWSA-N 1 1 225.719 3.559 20 0 BHADMO C/C(Cl)=C/C[N@H+]1CCC[C@@H]1c1ccco1 ZINC000528385149 388518619 /nfs/dbraw/zinc/51/86/19/388518619.db2.gz WWCAOLXLGVXTAU-SDKXAQGSSA-N 1 1 225.719 3.559 20 0 BHADMO C/C(Cl)=C/C[N@H+]1CCC[C@H]1c1ccco1 ZINC000528385150 388518388 /nfs/dbraw/zinc/51/83/88/388518388.db2.gz WWCAOLXLGVXTAU-YAEJEKNGSA-N 1 1 225.719 3.559 20 0 BHADMO Cc1ccc2sc(C[N@H+](C)C3CCC3)nc2c1 ZINC000528389282 324217694 /nfs/dbraw/zinc/21/76/94/324217694.db2.gz KKMCSZMMDQUGSR-UHFFFAOYSA-N 1 1 246.379 3.589 20 0 BHADMO C/C(Cl)=C\C[N@H+]1CC[C@H]1c1ccccc1 ZINC000528394739 324220461 /nfs/dbraw/zinc/22/04/61/324220461.db2.gz KDAOQUYRSXYEHJ-HJTPGIPUSA-N 1 1 221.731 3.576 20 0 BHADMO C/C(Cl)=C/C[N@H+]1CC[C@@H]1c1ccccc1 ZINC000528394741 324220488 /nfs/dbraw/zinc/22/04/88/324220488.db2.gz KDAOQUYRSXYEHJ-LWMSPQMPSA-N 1 1 221.731 3.576 20 0 BHADMO C/C(Cl)=C\C[N@H+]1CC[C@@H]1c1ccccc1 ZINC000528395134 324220556 /nfs/dbraw/zinc/22/05/56/324220556.db2.gz KDAOQUYRSXYEHJ-SVTZGKHISA-N 1 1 221.731 3.576 20 0 BHADMO C/C(Cl)=C/C[N@H+]1CC[C@H]1c1ccccc1 ZINC000528395136 324220631 /nfs/dbraw/zinc/22/06/31/324220631.db2.gz KDAOQUYRSXYEHJ-YLBKJLTLSA-N 1 1 221.731 3.576 20 0 BHADMO CC1(C)CC(C[N@H+]2CCC[C@H]2c2ccccn2)C1 ZINC000528395455 324220302 /nfs/dbraw/zinc/22/03/02/324220302.db2.gz LKCKRZSQQQSLNU-HNNXBMFYSA-N 1 1 244.382 3.655 20 0 BHADMO CC1(C)CC(C[N@H+]2CCC[C@@H]2c2ccccn2)C1 ZINC000528395472 324220040 /nfs/dbraw/zinc/22/00/40/324220040.db2.gz LKCKRZSQQQSLNU-OAHLLOKOSA-N 1 1 244.382 3.655 20 0 BHADMO CC[C@@H](C)C[N@@H+](CC)Cc1ncccc1Cl ZINC000528397581 387584972 /nfs/dbraw/zinc/58/49/72/387584972.db2.gz QWQSGVHZKZYGSM-LLVKDONJSA-N 1 1 240.778 3.603 20 0 BHADMO CC[C@H](C)C[N@@H+](CC)Cc1ncccc1Cl ZINC000528397587 387584245 /nfs/dbraw/zinc/58/42/45/387584245.db2.gz QWQSGVHZKZYGSM-NSHDSACASA-N 1 1 240.778 3.603 20 0 BHADMO C/C(Cl)=C/C[N@H+]1Cc2ccccc2[C@@H]1C ZINC000528398600 387587372 /nfs/dbraw/zinc/58/73/72/387587372.db2.gz VSEDHFJJBMFBPY-BRNRAETOSA-N 1 1 221.731 3.706 20 0 BHADMO C/C(Cl)=C/C[N@@H+]1Cc2ccccc2[C@@H]1C ZINC000528398600 387587370 /nfs/dbraw/zinc/58/73/70/387587370.db2.gz VSEDHFJJBMFBPY-BRNRAETOSA-N 1 1 221.731 3.706 20 0 BHADMO C/C(Cl)=C\C[N@H+]1Cc2ccccc2[C@@H]1C ZINC000528398604 387587066 /nfs/dbraw/zinc/58/70/66/387587066.db2.gz VSEDHFJJBMFBPY-HUYFXPKMSA-N 1 1 221.731 3.706 20 0 BHADMO C/C(Cl)=C\C[N@@H+]1Cc2ccccc2[C@@H]1C ZINC000528398604 387587061 /nfs/dbraw/zinc/58/70/61/387587061.db2.gz VSEDHFJJBMFBPY-HUYFXPKMSA-N 1 1 221.731 3.706 20 0 BHADMO C/C(Cl)=C\C[N@H+]1Cc2ccccc2[C@H]1C ZINC000528398607 387587152 /nfs/dbraw/zinc/58/71/52/387587152.db2.gz VSEDHFJJBMFBPY-PFEDMVJOSA-N 1 1 221.731 3.706 20 0 BHADMO C/C(Cl)=C\C[N@@H+]1Cc2ccccc2[C@H]1C ZINC000528398607 387587148 /nfs/dbraw/zinc/58/71/48/387587148.db2.gz VSEDHFJJBMFBPY-PFEDMVJOSA-N 1 1 221.731 3.706 20 0 BHADMO C/C(Cl)=C/C[N@H+]1Cc2ccccc2[C@H]1C ZINC000528398617 387587433 /nfs/dbraw/zinc/58/74/33/387587433.db2.gz VSEDHFJJBMFBPY-ZJRUKIMVSA-N 1 1 221.731 3.706 20 0 BHADMO C/C(Cl)=C/C[N@@H+]1Cc2ccccc2[C@H]1C ZINC000528398617 387587431 /nfs/dbraw/zinc/58/74/31/387587431.db2.gz VSEDHFJJBMFBPY-ZJRUKIMVSA-N 1 1 221.731 3.706 20 0 BHADMO CC1(C)CC(C[N@H+]2CCC[C@H]2c2ccc[nH]2)C1 ZINC000528405402 323097167 /nfs/dbraw/zinc/09/71/67/323097167.db2.gz GDWHNQVNWAVAIT-AWEZNQCLSA-N 1 1 232.371 3.588 20 0 BHADMO CC1(C)CC(C[N@H+]2CCC[C@@H]2c2ccc[nH]2)C1 ZINC000528405403 323097086 /nfs/dbraw/zinc/09/70/86/323097086.db2.gz GDWHNQVNWAVAIT-CQSZACIVSA-N 1 1 232.371 3.588 20 0 BHADMO CC[C@@H](C)[N@@H+](C)Cc1nc2cc(C)ccc2s1 ZINC000528415696 388520621 /nfs/dbraw/zinc/52/06/21/388520621.db2.gz MXPSJNBKRDDYQG-LLVKDONJSA-N 1 1 248.395 3.835 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1nc2cc(C)ccc2s1 ZINC000528415699 388520895 /nfs/dbraw/zinc/52/08/95/388520895.db2.gz MXPSJNBKRDDYQG-NSHDSACASA-N 1 1 248.395 3.835 20 0 BHADMO C/C(Cl)=C/C[N@H+](C)[C@@H](C)c1cccc(O)c1 ZINC000528420069 323060689 /nfs/dbraw/zinc/06/06/89/323060689.db2.gz SLYIVZQMZYBZDU-BRNRAETOSA-N 1 1 239.746 3.528 20 0 BHADMO C/C(Cl)=C/C[N@@H+](C)[C@@H](C)c1cccc(O)c1 ZINC000528420069 323060688 /nfs/dbraw/zinc/06/06/88/323060688.db2.gz SLYIVZQMZYBZDU-BRNRAETOSA-N 1 1 239.746 3.528 20 0 BHADMO C/C(Cl)=C\C[N@H+](C)[C@@H](C)c1cccc(O)c1 ZINC000528420073 323060789 /nfs/dbraw/zinc/06/07/89/323060789.db2.gz SLYIVZQMZYBZDU-HUYFXPKMSA-N 1 1 239.746 3.528 20 0 BHADMO C/C(Cl)=C\C[N@@H+](C)[C@@H](C)c1cccc(O)c1 ZINC000528420073 323060788 /nfs/dbraw/zinc/06/07/88/323060788.db2.gz SLYIVZQMZYBZDU-HUYFXPKMSA-N 1 1 239.746 3.528 20 0 BHADMO C/C(Cl)=C\C[N@H+](C)[C@H](C)c1cccc(O)c1 ZINC000528420075 323060734 /nfs/dbraw/zinc/06/07/34/323060734.db2.gz SLYIVZQMZYBZDU-PFEDMVJOSA-N 1 1 239.746 3.528 20 0 BHADMO C/C(Cl)=C\C[N@@H+](C)[C@H](C)c1cccc(O)c1 ZINC000528420075 323060733 /nfs/dbraw/zinc/06/07/33/323060733.db2.gz SLYIVZQMZYBZDU-PFEDMVJOSA-N 1 1 239.746 3.528 20 0 BHADMO C/C(Cl)=C/C[N@H+](C)[C@H](C)c1cccc(O)c1 ZINC000528420079 323060673 /nfs/dbraw/zinc/06/06/73/323060673.db2.gz SLYIVZQMZYBZDU-ZJRUKIMVSA-N 1 1 239.746 3.528 20 0 BHADMO C/C(Cl)=C/C[N@@H+](C)[C@H](C)c1cccc(O)c1 ZINC000528420079 323060672 /nfs/dbraw/zinc/06/06/72/323060672.db2.gz SLYIVZQMZYBZDU-ZJRUKIMVSA-N 1 1 239.746 3.528 20 0 BHADMO CC(C)[N@H+](Cc1cccnc1)CC1CC(C)(C)C1 ZINC000528421260 388521919 /nfs/dbraw/zinc/52/19/19/388521919.db2.gz DWJWWVFAWWAPGB-UHFFFAOYSA-N 1 1 246.398 3.728 20 0 BHADMO C/C(Cl)=C/C[N@H+]([C@@H](C)c1ccco1)C1CC1 ZINC000528423026 388522074 /nfs/dbraw/zinc/52/20/74/388522074.db2.gz FZNJOVSWEJRXIR-BRNRAETOSA-N 1 1 239.746 3.948 20 0 BHADMO C/C(Cl)=C/C[N@@H+]([C@@H](C)c1ccco1)C1CC1 ZINC000528423026 388522073 /nfs/dbraw/zinc/52/20/73/388522073.db2.gz FZNJOVSWEJRXIR-BRNRAETOSA-N 1 1 239.746 3.948 20 0 BHADMO C/C(Cl)=C\C[N@H+]([C@@H](C)c1ccco1)C1CC1 ZINC000528423027 388522177 /nfs/dbraw/zinc/52/21/77/388522177.db2.gz FZNJOVSWEJRXIR-HUYFXPKMSA-N 1 1 239.746 3.948 20 0 BHADMO C/C(Cl)=C\C[N@@H+]([C@@H](C)c1ccco1)C1CC1 ZINC000528423027 388522176 /nfs/dbraw/zinc/52/21/76/388522176.db2.gz FZNJOVSWEJRXIR-HUYFXPKMSA-N 1 1 239.746 3.948 20 0 BHADMO C/C(Cl)=C\C[N@H+]([C@H](C)c1ccco1)C1CC1 ZINC000528423028 388522166 /nfs/dbraw/zinc/52/21/66/388522166.db2.gz FZNJOVSWEJRXIR-PFEDMVJOSA-N 1 1 239.746 3.948 20 0 BHADMO C/C(Cl)=C\C[N@@H+]([C@H](C)c1ccco1)C1CC1 ZINC000528423028 388522164 /nfs/dbraw/zinc/52/21/64/388522164.db2.gz FZNJOVSWEJRXIR-PFEDMVJOSA-N 1 1 239.746 3.948 20 0 BHADMO C/C(Cl)=C/C[N@H+]([C@H](C)c1ccco1)C1CC1 ZINC000528423029 388522717 /nfs/dbraw/zinc/52/27/17/388522717.db2.gz FZNJOVSWEJRXIR-ZJRUKIMVSA-N 1 1 239.746 3.948 20 0 BHADMO C/C(Cl)=C/C[N@@H+]([C@H](C)c1ccco1)C1CC1 ZINC000528423029 388522715 /nfs/dbraw/zinc/52/27/15/388522715.db2.gz FZNJOVSWEJRXIR-ZJRUKIMVSA-N 1 1 239.746 3.948 20 0 BHADMO CC1(C)CC(C[N@H+]2CCC[C@H]2c2cccnc2)C1 ZINC000528423180 262945826 /nfs/dbraw/zinc/94/58/26/262945826.db2.gz GWQDEDQNVVZBBW-HNNXBMFYSA-N 1 1 244.382 3.655 20 0 BHADMO CC1(C)CC(C[N@H+]2CCC[C@@H]2c2cccnc2)C1 ZINC000528423183 388522743 /nfs/dbraw/zinc/52/27/43/388522743.db2.gz GWQDEDQNVVZBBW-OAHLLOKOSA-N 1 1 244.382 3.655 20 0 BHADMO CC1(C)CC(C[N@H+]2CCC[C@H]2c2ccncc2)C1 ZINC000528423241 388521645 /nfs/dbraw/zinc/52/16/45/388521645.db2.gz HKNKMWKVOGHGBO-HNNXBMFYSA-N 1 1 244.382 3.655 20 0 BHADMO CC1(C)CC(C[N@H+]2CCC[C@@H]2c2ccncc2)C1 ZINC000528423243 388521712 /nfs/dbraw/zinc/52/17/12/388521712.db2.gz HKNKMWKVOGHGBO-OAHLLOKOSA-N 1 1 244.382 3.655 20 0 BHADMO C[C@H](c1ccccn1)[N@@H+](C)CC1CC(C)(C)C1 ZINC000528423376 388522209 /nfs/dbraw/zinc/52/22/09/388522209.db2.gz LJMBWZBCTSTQAW-GFCCVEGCSA-N 1 1 232.371 3.511 20 0 BHADMO C[C@@H](c1ccccn1)[N@@H+](C)CC1CC(C)(C)C1 ZINC000528423379 388522759 /nfs/dbraw/zinc/52/27/59/388522759.db2.gz LJMBWZBCTSTQAW-LBPRGKRZSA-N 1 1 232.371 3.511 20 0 BHADMO C[C@H](c1ccncc1)[N@@H+](C)CC1CC(C)(C)C1 ZINC000528425047 262945529 /nfs/dbraw/zinc/94/55/29/262945529.db2.gz UDPFKLDFMBJBNQ-GFCCVEGCSA-N 1 1 232.371 3.511 20 0 BHADMO C[C@@H](c1ccncc1)[N@@H+](C)CC1CC(C)(C)C1 ZINC000528425049 388521987 /nfs/dbraw/zinc/52/19/87/388521987.db2.gz UDPFKLDFMBJBNQ-LBPRGKRZSA-N 1 1 232.371 3.511 20 0 BHADMO C[C@H](c1cccnc1)[N@@H+](C)CC1CC(C)(C)C1 ZINC000528426351 388523308 /nfs/dbraw/zinc/52/33/08/388523308.db2.gz YXPHACKLVLYONL-GFCCVEGCSA-N 1 1 232.371 3.511 20 0 BHADMO C[C@@H](c1cccnc1)[N@@H+](C)CC1CC(C)(C)C1 ZINC000528426352 388523318 /nfs/dbraw/zinc/52/33/18/388523318.db2.gz YXPHACKLVLYONL-LBPRGKRZSA-N 1 1 232.371 3.511 20 0 BHADMO C/C(Cl)=C\C[NH2+][C@H](C)c1c(F)cccc1F ZINC000528430366 388523821 /nfs/dbraw/zinc/52/38/21/388523821.db2.gz IIQPJJKKEGJHDR-BNICOGTQSA-N 1 1 245.700 3.758 20 0 BHADMO C/C(Cl)=C/C[NH2+][C@H](C)c1c(F)cccc1F ZINC000528430369 388523108 /nfs/dbraw/zinc/52/31/08/388523108.db2.gz IIQPJJKKEGJHDR-JGAIRUGNSA-N 1 1 245.700 3.758 20 0 BHADMO C/C(Cl)=C\C[NH2+][C@@H](C)c1c(F)cccc1F ZINC000528430370 388523073 /nfs/dbraw/zinc/52/30/73/388523073.db2.gz IIQPJJKKEGJHDR-ORZBULNSSA-N 1 1 245.700 3.758 20 0 BHADMO C/C(Cl)=C/C[NH2+][C@@H](C)c1c(F)cccc1F ZINC000528430371 388525360 /nfs/dbraw/zinc/52/53/60/388525360.db2.gz IIQPJJKKEGJHDR-XZLDQRQTSA-N 1 1 245.700 3.758 20 0 BHADMO CC[C@@H](c1ccncc1)[N@@H+](C)CC1CC(C)(C)C1 ZINC000528431422 388524536 /nfs/dbraw/zinc/52/45/36/388524536.db2.gz JAHUPNZITUTTHE-HNNXBMFYSA-N 1 1 246.398 3.901 20 0 BHADMO CC[C@H](c1ccncc1)[N@@H+](C)CC1CC(C)(C)C1 ZINC000528431426 388525289 /nfs/dbraw/zinc/52/52/89/388525289.db2.gz JAHUPNZITUTTHE-OAHLLOKOSA-N 1 1 246.398 3.901 20 0 BHADMO CC1(C)CC(C[N@H+]2CC[C@@H](CC(F)(F)F)C2)C1 ZINC000528478678 262772540 /nfs/dbraw/zinc/77/25/40/262772540.db2.gz VCSYCJGJIFDPCP-JTQLQIEISA-N 1 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AOXXHSDOYXSDOW-UITAMQMPSA-N 1 1 237.721 3.639 20 0 BHADMO C/C(Cl)=C\C[N@H+](C)C1CCC(F)(F)CC1 ZINC000528500417 388535087 /nfs/dbraw/zinc/53/50/87/388535087.db2.gz AOXXHSDOYXSDOW-WEVVVXLNSA-N 1 1 237.721 3.639 20 0 BHADMO CCC(CC)[N@@H+](CC)Cc1ncccc1Cl ZINC000528501397 388535443 /nfs/dbraw/zinc/53/54/43/388535443.db2.gz FYEPKSZZGMBYHE-UHFFFAOYSA-N 1 1 240.778 3.746 20 0 BHADMO C/C(Cl)=C\C[N@H+]1CCC=C(c2ccco2)C1 ZINC000528508558 388537996 /nfs/dbraw/zinc/53/79/96/388537996.db2.gz QFNSTBSJZNAEFG-IZZDOVSWSA-N 1 1 237.730 3.511 20 0 BHADMO C/C(Cl)=C/C[N@H+]1CCC=C(c2ccco2)C1 ZINC000528508560 388538536 /nfs/dbraw/zinc/53/85/36/388538536.db2.gz QFNSTBSJZNAEFG-WDZFZDKYSA-N 1 1 237.730 3.511 20 0 BHADMO CC[N@@H+](Cc1ncccc1Cl)CC(C)(C)C ZINC000528510206 262954068 /nfs/dbraw/zinc/95/40/68/262954068.db2.gz WNKWLMDZHSXGDK-UHFFFAOYSA-N 1 1 240.778 3.603 20 0 BHADMO CC[N@@H+](C/C=C(\C)Cl)Cc1occc1C ZINC000528517695 388540552 /nfs/dbraw/zinc/54/05/52/388540552.db2.gz CFDZJRADDIWXNT-VZUCSPMQSA-N 1 1 227.735 3.553 20 0 BHADMO CC[N@H+](C/C=C(\C)Cl)Cc1occc1C ZINC000528517695 388540550 /nfs/dbraw/zinc/54/05/50/388540550.db2.gz CFDZJRADDIWXNT-VZUCSPMQSA-N 1 1 227.735 3.553 20 0 BHADMO CC[N@@H+](C/C=C(/C)Cl)Cc1occc1C ZINC000528517697 388541054 /nfs/dbraw/zinc/54/10/54/388541054.db2.gz CFDZJRADDIWXNT-WZUFQYTHSA-N 1 1 227.735 3.553 20 0 BHADMO CC[N@H+](C/C=C(/C)Cl)Cc1occc1C ZINC000528517697 388541050 /nfs/dbraw/zinc/54/10/50/388541050.db2.gz CFDZJRADDIWXNT-WZUFQYTHSA-N 1 1 227.735 3.553 20 0 BHADMO Cc1ccc2sc(C[N@H+](C)C(C)(C)C)nc2c1 ZINC000528537575 388545361 /nfs/dbraw/zinc/54/53/61/388545361.db2.gz JYRFAZCIQIFTPY-UHFFFAOYSA-N 1 1 248.395 3.835 20 0 BHADMO C[N@@H+](CCC(C)(C)C)Cc1ncccc1Cl ZINC000528537663 388545214 /nfs/dbraw/zinc/54/52/14/388545214.db2.gz LSFFITUTUVYGJY-UHFFFAOYSA-N 1 1 240.778 3.603 20 0 BHADMO FC1(F)CC12C[C@H]1CC[C@@H](C2)[N@@H+]1C1CCCC1 ZINC000528584938 388549549 /nfs/dbraw/zinc/54/95/49/388549549.db2.gz RVMRIRWDAYUMOT-FUNVUKJBSA-N 1 1 241.325 3.581 20 0 BHADMO 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343439093 /nfs/dbraw/zinc/43/90/93/343439093.db2.gz RNCBNAWNYFIZEW-HOCLYGCPSA-N 1 1 229.367 3.831 20 0 BHADMO CC(C)=CC[N@@H+]1CC[C@H](c2ccccc2)[C@H]1C ZINC000530964022 343439079 /nfs/dbraw/zinc/43/90/79/343439079.db2.gz RNCBNAWNYFIZEW-ZBFHGGJFSA-N 1 1 229.367 3.831 20 0 BHADMO CC(C)Oc1ccccc1C[N@H+]1CC[C@H](C)[C@@H]1C ZINC000530971784 384555847 /nfs/dbraw/zinc/55/58/47/384555847.db2.gz FFZGLTRNHOSSHW-KBPBESRZSA-N 1 1 247.382 3.704 20 0 BHADMO CC(C)Oc1ccccc1C[N@H+]1CC[C@@H](C)[C@@H]1C ZINC000530971793 384557803 /nfs/dbraw/zinc/55/78/03/384557803.db2.gz FFZGLTRNHOSSHW-KGLIPLIRSA-N 1 1 247.382 3.704 20 0 BHADMO CC(C)Oc1ccccc1C[N@H+]1CC[C@H](C)[C@H]1C ZINC000530971794 384556970 /nfs/dbraw/zinc/55/69/70/384556970.db2.gz FFZGLTRNHOSSHW-UONOGXRCSA-N 1 1 247.382 3.704 20 0 BHADMO CC(C)Oc1ccccc1C[N@H+]1CC[C@@H](C)[C@H]1C ZINC000530971795 384558139 /nfs/dbraw/zinc/55/81/39/384558139.db2.gz FFZGLTRNHOSSHW-ZIAGYGMSSA-N 1 1 247.382 3.704 20 0 BHADMO CC(C)Oc1cccc(C[N@H+]2CC[C@H](C)[C@@H]2C)c1 ZINC000530975640 384847995 /nfs/dbraw/zinc/84/79/95/384847995.db2.gz OZGSLYDNAWRUOD-KBPBESRZSA-N 1 1 247.382 3.704 20 0 BHADMO CC(C)Oc1cccc(C[N@H+]2CC[C@@H](C)[C@@H]2C)c1 ZINC000530975641 384844955 /nfs/dbraw/zinc/84/49/55/384844955.db2.gz OZGSLYDNAWRUOD-KGLIPLIRSA-N 1 1 247.382 3.704 20 0 BHADMO CC(C)Oc1cccc(C[N@H+]2CC[C@H](C)[C@H]2C)c1 ZINC000530975642 384847535 /nfs/dbraw/zinc/84/75/35/384847535.db2.gz OZGSLYDNAWRUOD-UONOGXRCSA-N 1 1 247.382 3.704 20 0 BHADMO CC(C)Oc1cccc(C[N@H+]2CC[C@@H](C)[C@H]2C)c1 ZINC000530975643 384846136 /nfs/dbraw/zinc/84/61/36/384846136.db2.gz OZGSLYDNAWRUOD-ZIAGYGMSSA-N 1 1 247.382 3.704 20 0 BHADMO C[C@@H]1CC[N@@H+](Cc2cccc(Cl)c2)[C@@H]1C ZINC000530976016 384869694 /nfs/dbraw/zinc/86/96/94/384869694.db2.gz KWEWMXZAYKDZJF-GHMZBOCLSA-N 1 1 223.747 3.570 20 0 BHADMO C[C@@H]1CC[N@@H+](Cc2cccc(Cl)c2)[C@H]1C ZINC000530976017 384868601 /nfs/dbraw/zinc/86/86/01/384868601.db2.gz KWEWMXZAYKDZJF-MNOVXSKESA-N 1 1 223.747 3.570 20 0 BHADMO C[C@H]1CC[N@@H+](Cc2cccc(Cl)c2)[C@H]1C ZINC000530976018 384870702 /nfs/dbraw/zinc/87/07/02/384870702.db2.gz KWEWMXZAYKDZJF-QWRGUYRKSA-N 1 1 223.747 3.570 20 0 BHADMO C[C@@H]1[C@@H](C)CC[N@H+]1Cc1cccc(Cl)c1 ZINC000530976019 384870560 /nfs/dbraw/zinc/87/05/60/384870560.db2.gz KWEWMXZAYKDZJF-WDEREUQCSA-N 1 1 223.747 3.570 20 0 BHADMO C[C@@H]([N@@H+](C)Cc1ccc(Cl)cc1)C1(C)CC1 ZINC000530992668 384303569 /nfs/dbraw/zinc/30/35/69/384303569.db2.gz PRUHUIAXLFRTGN-LLVKDONJSA-N 1 1 237.774 3.960 20 0 BHADMO C[C@H]([N@@H+](C)Cc1ccc(Cl)cc1)C1(C)CC1 ZINC000530992669 384302785 /nfs/dbraw/zinc/30/27/85/384302785.db2.gz PRUHUIAXLFRTGN-NSHDSACASA-N 1 1 237.774 3.960 20 0 BHADMO c1ccc(C[N@H+]2CCS[C@H]3CCCC[C@H]32)cc1 ZINC000530992757 384302548 /nfs/dbraw/zinc/30/25/48/384302548.db2.gz IJQMZPLCUQTPOZ-CABCVRRESA-N 1 1 247.407 3.547 20 0 BHADMO c1ccc(C[N@H+]2CCS[C@H]3CCCC[C@@H]32)cc1 ZINC000530992758 384302217 /nfs/dbraw/zinc/30/22/17/384302217.db2.gz IJQMZPLCUQTPOZ-GJZGRUSLSA-N 1 1 247.407 3.547 20 0 BHADMO c1ccc(C[N@H+]2CCS[C@@H]3CCCC[C@H]32)cc1 ZINC000530992759 384302761 /nfs/dbraw/zinc/30/27/61/384302761.db2.gz IJQMZPLCUQTPOZ-HUUCEWRRSA-N 1 1 247.407 3.547 20 0 BHADMO c1ccc(C[N@H+]2CCS[C@@H]3CCCC[C@@H]32)cc1 ZINC000530992760 384302120 /nfs/dbraw/zinc/30/21/20/384302120.db2.gz IJQMZPLCUQTPOZ-LSDHHAIUSA-N 1 1 247.407 3.547 20 0 BHADMO CCCC[N@@H+](CCc1ccc(OC)cc1)C1CC1 ZINC000531104085 384948309 /nfs/dbraw/zinc/94/83/09/384948309.db2.gz BZMNYTFLLAZBEG-UHFFFAOYSA-N 1 1 247.382 3.502 20 0 BHADMO CC(C)C[N@H+]1CC[C@@H](C)[C@H]1c1cccc(F)c1 ZINC000531104518 344480331 /nfs/dbraw/zinc/48/03/31/344480331.db2.gz GQYDRDNLSUZQBQ-DOMZBBRYSA-N 1 1 235.346 3.865 20 0 BHADMO CC(C)C[N@H+]1CC[C@@H](C)[C@@H]1c1cccc(F)c1 ZINC000531104531 344480104 /nfs/dbraw/zinc/48/01/04/344480104.db2.gz GQYDRDNLSUZQBQ-IUODEOHRSA-N 1 1 235.346 3.865 20 0 BHADMO CC(C)C[N@H+]1CC[C@H](C)[C@@H]1c1cccc(F)c1 ZINC000531104532 344480207 /nfs/dbraw/zinc/48/02/07/344480207.db2.gz GQYDRDNLSUZQBQ-SWLSCSKDSA-N 1 1 235.346 3.865 20 0 BHADMO CC(C)C[N@H+]1CC[C@H](C)[C@H]1c1cccc(F)c1 ZINC000531104533 344480046 /nfs/dbraw/zinc/48/00/46/344480046.db2.gz GQYDRDNLSUZQBQ-WFASDCNBSA-N 1 1 235.346 3.865 20 0 BHADMO Cn1cccc1[C@@H]1CCCC[N@H+]1CC1CCCC1 ZINC000531104599 344480341 /nfs/dbraw/zinc/48/03/41/344480341.db2.gz KSPFTMYQDOIHOJ-INIZCTEOSA-N 1 1 246.398 3.742 20 0 BHADMO Cn1cccc1[C@H]1CCCC[N@H+]1CC1CCCC1 ZINC000531104601 344480148 /nfs/dbraw/zinc/48/01/48/344480148.db2.gz KSPFTMYQDOIHOJ-MRXNPFEDSA-N 1 1 246.398 3.742 20 0 BHADMO CCC(C)(C)CC[N@@H+](C)Cc1cccc(O)c1 ZINC000531140001 323047698 /nfs/dbraw/zinc/04/76/98/323047698.db2.gz RIKJZQYSMXRHDJ-UHFFFAOYSA-N 1 1 235.371 3.650 20 0 BHADMO CC(C)=CC[N@H+]1CCc2ccccc2[C@H]1C ZINC000531140045 323048023 /nfs/dbraw/zinc/04/80/23/323048023.db2.gz ZHKMIKDOEOGSHG-CYBMUJFWSA-N 1 1 215.340 3.572 20 0 BHADMO CC(C)=CC[N@H+]1CCc2ccccc2[C@@H]1C ZINC000531140046 323048050 /nfs/dbraw/zinc/04/80/50/323048050.db2.gz ZHKMIKDOEOGSHG-ZDUSSCGKSA-N 1 1 215.340 3.572 20 0 BHADMO CC(C)(C)CC[N@H+]1CC[C@H]1c1ccccc1 ZINC000531140198 323049311 /nfs/dbraw/zinc/04/93/11/323049311.db2.gz YWQAKWKBIJGUQX-AWEZNQCLSA-N 1 1 217.356 3.870 20 0 BHADMO CC(C)(C)CC[N@H+]1CC[C@@H]1c1ccccc1 ZINC000531140203 323049260 /nfs/dbraw/zinc/04/92/60/323049260.db2.gz YWQAKWKBIJGUQX-CQSZACIVSA-N 1 1 217.356 3.870 20 0 BHADMO CCC1CCC([N@@H+](C)CCCOC(C)C)CC1 ZINC000531142978 323069518 /nfs/dbraw/zinc/06/95/18/323069518.db2.gz RHOXIEPMVZEYAL-UHFFFAOYSA-N 1 1 241.419 3.702 20 0 BHADMO C[C@@H](N(C)c1cc[nH+]cc1Cl)C(C)(C)C ZINC000531170997 566336836 /nfs/dbraw/zinc/33/68/36/566336836.db2.gz JWXPPULRVHAOKN-SECBINFHSA-N 1 1 226.751 3.606 20 0 BHADMO C[C@H](N(C)c1cc[nH+]cc1Cl)C(C)(C)C ZINC000531171005 566336745 /nfs/dbraw/zinc/33/67/45/566336745.db2.gz JWXPPULRVHAOKN-VIFPVBQESA-N 1 1 226.751 3.606 20 0 BHADMO CC(C)(C)CC[N@H+]1CCC[C@H]1c1ccccn1 ZINC000531201383 323085296 /nfs/dbraw/zinc/08/52/96/323085296.db2.gz LWSNMQWBIQFRMP-AWEZNQCLSA-N 1 1 232.371 3.655 20 0 BHADMO CC(C)(C)CC[N@H+]1CCC[C@@H]1c1ccccn1 ZINC000531201384 323085175 /nfs/dbraw/zinc/08/51/75/323085175.db2.gz LWSNMQWBIQFRMP-CQSZACIVSA-N 1 1 232.371 3.655 20 0 BHADMO CC(C)C[N@H+]1CC[C@@H](c2ccccc2)[C@@H]1C ZINC000531202493 323085173 /nfs/dbraw/zinc/08/51/73/323085173.db2.gz FQUARRMDEVQJKT-DZGCQCFKSA-N 1 1 217.356 3.520 20 0 BHADMO CC(C)C[N@H+]1CC[C@H](c2ccccc2)[C@H]1C ZINC000531202494 323085164 /nfs/dbraw/zinc/08/51/64/323085164.db2.gz FQUARRMDEVQJKT-HIFRSBDPSA-N 1 1 217.356 3.520 20 0 BHADMO CC(C)C[N@H+]1CC[C@@H](c2ccccc2)[C@H]1C ZINC000531202495 323085187 /nfs/dbraw/zinc/08/51/87/323085187.db2.gz FQUARRMDEVQJKT-UKRRQHHQSA-N 1 1 217.356 3.520 20 0 BHADMO CC(C)C[N@H+]1CC[C@H](c2ccccc2)[C@@H]1C ZINC000531202496 323085214 /nfs/dbraw/zinc/08/52/14/323085214.db2.gz FQUARRMDEVQJKT-ZFWWWQNUSA-N 1 1 217.356 3.520 20 0 BHADMO CC(C)Oc1ccccc1C[N@H+]1C[C@H](C)[C@H](C)C1 ZINC000531210214 347784135 /nfs/dbraw/zinc/78/41/35/347784135.db2.gz AVWLPLGFXPLZKT-OKILXGFUSA-N 1 1 247.382 3.562 20 0 BHADMO 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YROLUWMQVIFDOJ-RBSFLKMASA-N 1 1 231.383 3.738 20 0 BHADMO CC[C@H](c1ccc(F)cc1)[N@H+]1CC[C@@H](C)C1 ZINC000531231101 323086073 /nfs/dbraw/zinc/08/60/73/323086073.db2.gz LZCNPDKZWXIRIK-BXUZGUMPSA-N 1 1 221.319 3.619 20 0 BHADMO CC[C@@H](c1ccc(F)cc1)[N@H+]1CC[C@H](C)C1 ZINC000531231104 323086041 /nfs/dbraw/zinc/08/60/41/323086041.db2.gz LZCNPDKZWXIRIK-FZMZJTMJSA-N 1 1 221.319 3.619 20 0 BHADMO CC[C@@H](c1ccc(F)cc1)[N@H+]1CC[C@@H](C)C1 ZINC000531231106 323086013 /nfs/dbraw/zinc/08/60/13/323086013.db2.gz LZCNPDKZWXIRIK-RISCZKNCSA-N 1 1 221.319 3.619 20 0 BHADMO CC[C@H](c1ccc(F)cc1)[N@H+]1CC[C@H](C)C1 ZINC000531231107 323086079 /nfs/dbraw/zinc/08/60/79/323086079.db2.gz LZCNPDKZWXIRIK-SMDDNHRTSA-N 1 1 221.319 3.619 20 0 BHADMO CC[C@H]1C[C@H](C)C[N@H+]1Cc1cc(F)ccc1F ZINC000531233134 323086172 /nfs/dbraw/zinc/08/61/72/323086172.db2.gz FBBCHOAVJJJTSJ-GWCFXTLKSA-N 1 1 239.309 3.585 20 0 BHADMO CC[C@@H]1C[C@H](C)C[N@H+]1Cc1cc(F)ccc1F ZINC000531233143 323086191 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323088953 /nfs/dbraw/zinc/08/89/53/323088953.db2.gz MFYYUNXSMLXBES-BMFZPTHFSA-N 1 1 229.367 3.870 20 0 BHADMO C[C@@H](c1ccccc1)[N@@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC000531417073 323089044 /nfs/dbraw/zinc/08/90/44/323089044.db2.gz MFYYUNXSMLXBES-CWRNSKLLSA-N 1 1 229.367 3.870 20 0 BHADMO CC1(C)C[N@@H+](C/C=C/c2ccccc2)CCS1 ZINC000531441180 323089907 /nfs/dbraw/zinc/08/99/07/323089907.db2.gz RIBDXPDAHLEKFV-RMKNXTFCSA-N 1 1 247.407 3.527 20 0 BHADMO CC1(C)C[N@@H+](C/C=C\c2ccccc2)CCS1 ZINC000531441187 323089880 /nfs/dbraw/zinc/08/98/80/323089880.db2.gz RIBDXPDAHLEKFV-TWGQIWQCSA-N 1 1 247.407 3.527 20 0 BHADMO CC[N@@H+](Cc1cc(F)ccc1F)C1CCCC1 ZINC000531441498 323089996 /nfs/dbraw/zinc/08/99/96/323089996.db2.gz VTNVVZYZZZVHPF-UHFFFAOYSA-N 1 1 239.309 3.729 20 0 BHADMO C[C@@H]1CC[N@@H+](Cc2ccc(Cl)cc2)[C@@H]1C ZINC000531452989 323091403 /nfs/dbraw/zinc/09/14/03/323091403.db2.gz JRMZNXFGYHTOSS-GHMZBOCLSA-N 1 1 223.747 3.570 20 0 BHADMO C[C@@H]1CC[N@@H+](Cc2ccc(Cl)cc2)[C@H]1C ZINC000531452990 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ZINC000531470129 323097877 /nfs/dbraw/zinc/09/78/77/323097877.db2.gz LJYYTCXHQRRPHH-YHAOYDPOSA-N 1 1 229.367 3.820 20 0 BHADMO C[C@@H]1CC[N@@H+](CCCc2ccc(Cl)cc2)C1 ZINC000531470251 323097786 /nfs/dbraw/zinc/09/77/86/323097786.db2.gz PGKMNRPXXIIKJB-GFCCVEGCSA-N 1 1 237.774 3.614 20 0 BHADMO C[C@H]1CC[N@@H+](CCCc2ccc(Cl)cc2)C1 ZINC000531470252 323097791 /nfs/dbraw/zinc/09/77/91/323097791.db2.gz PGKMNRPXXIIKJB-LBPRGKRZSA-N 1 1 237.774 3.614 20 0 BHADMO CC[C@@H](c1ccc(F)cc1F)[N@H+]1CC[C@H](C)C1 ZINC000531470280 323097808 /nfs/dbraw/zinc/09/78/08/323097808.db2.gz ZKIKPRZJERAMDO-HZMBPMFUSA-N 1 1 239.309 3.758 20 0 BHADMO CC[C@H](c1ccc(F)cc1F)[N@H+]1CC[C@H](C)C1 ZINC000531470281 323097829 /nfs/dbraw/zinc/09/78/29/323097829.db2.gz ZKIKPRZJERAMDO-IINYFYTJSA-N 1 1 239.309 3.758 20 0 BHADMO CC[C@H](c1ccc(F)cc1F)[N@H+]1CC[C@@H](C)C1 ZINC000531470282 323097833 /nfs/dbraw/zinc/09/78/33/323097833.db2.gz ZKIKPRZJERAMDO-QMTHXVAHSA-N 1 1 239.309 3.758 20 0 BHADMO CC[C@@H](c1ccc(F)cc1F)[N@H+]1CC[C@@H](C)C1 ZINC000531470283 323097820 /nfs/dbraw/zinc/09/78/20/323097820.db2.gz ZKIKPRZJERAMDO-YGRLFVJLSA-N 1 1 239.309 3.758 20 0 BHADMO C[C@@H]([N@@H+](C)CC1CCCCC1)C1(C)CC1 ZINC000531470389 323097796 /nfs/dbraw/zinc/09/77/96/323097796.db2.gz OVNPCXOSLVRTPZ-GFCCVEGCSA-N 1 1 209.377 3.687 20 0 BHADMO C[C@H]([N@@H+](C)CC1CCCCC1)C1(C)CC1 ZINC000531470390 323097836 /nfs/dbraw/zinc/09/78/36/323097836.db2.gz OVNPCXOSLVRTPZ-LBPRGKRZSA-N 1 1 209.377 3.687 20 0 BHADMO CCCC[N@@H+](Cc1cc(F)ccc1F)C1CC1 ZINC000531472197 323097886 /nfs/dbraw/zinc/09/78/86/323097886.db2.gz MQQKYCQJNJLNSQ-UHFFFAOYSA-N 1 1 239.309 3.729 20 0 BHADMO CC[C@@H]1CC[N@@H+](Cc2ccccc2Cl)C1 ZINC000531528279 323109449 /nfs/dbraw/zinc/10/94/49/323109449.db2.gz HOSFXLNKSYYHBI-LLVKDONJSA-N 1 1 223.747 3.572 20 0 BHADMO CC[C@H]1CC[N@@H+](Cc2ccccc2Cl)C1 ZINC000531528287 323109537 /nfs/dbraw/zinc/10/95/37/323109537.db2.gz HOSFXLNKSYYHBI-NSHDSACASA-N 1 1 223.747 3.572 20 0 BHADMO C[N@@H+](CCOCc1ccccc1)CCC(C)(C)C ZINC000531547816 323109296 /nfs/dbraw/zinc/10/92/96/323109296.db2.gz KLBIYKNWTXMPGL-UHFFFAOYSA-N 1 1 249.398 3.571 20 0 BHADMO C/C(=C\c1ccccc1)CNc1ccc(C)c[nH+]1 ZINC000531548746 323109455 /nfs/dbraw/zinc/10/94/55/323109455.db2.gz PIWLPAXHTQBDER-GXDHUFHOSA-N 1 1 238.334 3.905 20 0 BHADMO C/C(=C/c1ccccc1)CNc1ccc(C)c[nH+]1 ZINC000531548753 323109474 /nfs/dbraw/zinc/10/94/74/323109474.db2.gz PIWLPAXHTQBDER-UVTDQMKNSA-N 1 1 238.334 3.905 20 0 BHADMO Cn1cc(Cl)cc1C[N@@H+](C)CCC(C)(C)C ZINC000531562003 323109983 /nfs/dbraw/zinc/10/99/83/323109983.db2.gz OZBOSQDUXVBLDY-UHFFFAOYSA-N 1 1 242.794 3.547 20 0 BHADMO CC(C)Oc1ccccc1C[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000531562157 323110032 /nfs/dbraw/zinc/11/00/32/323110032.db2.gz HLFLLUBPZBIETC-OKILXGFUSA-N 1 1 247.382 3.847 20 0 BHADMO CC[C@@]1(C)CC[N@@H+](Cc2ccc(F)c(F)c2)C1 ZINC000531579787 323109694 /nfs/dbraw/zinc/10/96/94/323109694.db2.gz RYSASVMBWNBRFR-AWEZNQCLSA-N 1 1 239.309 3.587 20 0 BHADMO CC[C@]1(C)CC[N@@H+](Cc2ccc(F)c(F)c2)C1 ZINC000531579789 323109721 /nfs/dbraw/zinc/10/97/21/323109721.db2.gz RYSASVMBWNBRFR-CQSZACIVSA-N 1 1 239.309 3.587 20 0 BHADMO CCCC[N@@H+](C)[C@H](C)c1cccc(F)c1 ZINC000531614751 323110451 /nfs/dbraw/zinc/11/04/51/323110451.db2.gz VOYZNFGYVOPZJO-LLVKDONJSA-N 1 1 209.308 3.619 20 0 BHADMO CCCC[N@@H+](C)[C@@H](C)c1cccc(F)c1 ZINC000531614752 323110428 /nfs/dbraw/zinc/11/04/28/323110428.db2.gz VOYZNFGYVOPZJO-NSHDSACASA-N 1 1 209.308 3.619 20 0 BHADMO C[C@H]1SCC[N@@H+](CC2CC2)[C@@H]1c1ccccc1 ZINC000531657992 323111115 /nfs/dbraw/zinc/11/11/15/323111115.db2.gz QRTPSZKFBVEKLL-DOMZBBRYSA-N 1 1 247.407 3.575 20 0 BHADMO C[C@H]1SCC[N@@H+](CC2CC2)[C@H]1c1ccccc1 ZINC000531657993 323111161 /nfs/dbraw/zinc/11/11/61/323111161.db2.gz QRTPSZKFBVEKLL-IUODEOHRSA-N 1 1 247.407 3.575 20 0 BHADMO C[C@@H]1SCC[N@@H+](CC2CC2)[C@H]1c1ccccc1 ZINC000531657994 323111120 /nfs/dbraw/zinc/11/11/20/323111120.db2.gz QRTPSZKFBVEKLL-SWLSCSKDSA-N 1 1 247.407 3.575 20 0 BHADMO C[C@@H]1SCC[N@@H+](CC2CC2)[C@@H]1c1ccccc1 ZINC000531657995 323111212 /nfs/dbraw/zinc/11/12/12/323111212.db2.gz QRTPSZKFBVEKLL-WFASDCNBSA-N 1 1 247.407 3.575 20 0 BHADMO C[C@@H]1C[C@@H](c2cccc(F)c2)[N@@H+](CC2CC2)C1 ZINC000531658019 323111158 /nfs/dbraw/zinc/11/11/58/323111158.db2.gz XBEZMIXGEDSKAP-ABAIWWIYSA-N 1 1 233.330 3.619 20 0 BHADMO C[C@@H]1C[C@H](c2cccc(F)c2)[N@@H+](CC2CC2)C1 ZINC000531658020 323111208 /nfs/dbraw/zinc/11/12/08/323111208.db2.gz XBEZMIXGEDSKAP-IAQYHMDHSA-N 1 1 233.330 3.619 20 0 BHADMO C[C@H]1C[C@@H](c2cccc(F)c2)[N@@H+](CC2CC2)C1 ZINC000531658021 323111174 /nfs/dbraw/zinc/11/11/74/323111174.db2.gz XBEZMIXGEDSKAP-NHYWBVRUSA-N 1 1 233.330 3.619 20 0 BHADMO C[C@H]1C[C@H](c2cccc(F)c2)[N@@H+](CC2CC2)C1 ZINC000531658022 323111131 /nfs/dbraw/zinc/11/11/31/323111131.db2.gz XBEZMIXGEDSKAP-XHDPSFHLSA-N 1 1 233.330 3.619 20 0 BHADMO Cc1ccc([C@@H]2CCCCC[N@H+]2CC2CC2)o1 ZINC000531658229 323111316 /nfs/dbraw/zinc/11/13/16/323111316.db2.gz UXDOFPMIMWIZGZ-AWEZNQCLSA-N 1 1 233.355 3.915 20 0 BHADMO Cc1ccc([C@H]2CCCCC[N@H+]2CC2CC2)o1 ZINC000531658232 323111289 /nfs/dbraw/zinc/11/12/89/323111289.db2.gz UXDOFPMIMWIZGZ-CQSZACIVSA-N 1 1 233.355 3.915 20 0 BHADMO Cc1ccc(C(C)(C)C[N@@H+](C)CC2CC2)cc1 ZINC000531658280 323111231 /nfs/dbraw/zinc/11/12/31/323111231.db2.gz NLEJSXDHSKLSDA-UHFFFAOYSA-N 1 1 231.383 3.614 20 0 BHADMO CC(C)[C@@H](c1ccccc1)[N@@H+](C)CC1CC1 ZINC000531658368 323111297 /nfs/dbraw/zinc/11/12/97/323111297.db2.gz XOPWXCILXZETJJ-HNNXBMFYSA-N 1 1 217.356 3.726 20 0 BHADMO CC(C)[C@H](c1ccccc1)[N@@H+](C)CC1CC1 ZINC000531658369 323111218 /nfs/dbraw/zinc/11/12/18/323111218.db2.gz XOPWXCILXZETJJ-OAHLLOKOSA-N 1 1 217.356 3.726 20 0 BHADMO Cc1ccccc1[C@@H]1C[C@H](C)[N@H+](CC2CC2)C1 ZINC000531658815 323111308 /nfs/dbraw/zinc/11/13/08/323111308.db2.gz PYKFJGHSOOBXPC-DZGCQCFKSA-N 1 1 229.367 3.583 20 0 BHADMO Cc1ccccc1[C@H]1C[C@@H](C)[N@H+](CC2CC2)C1 ZINC000531658816 323111341 /nfs/dbraw/zinc/11/13/41/323111341.db2.gz PYKFJGHSOOBXPC-HIFRSBDPSA-N 1 1 229.367 3.583 20 0 BHADMO Cc1ccccc1[C@@H]1C[C@@H](C)[N@H+](CC2CC2)C1 ZINC000531658817 323111318 /nfs/dbraw/zinc/11/13/18/323111318.db2.gz PYKFJGHSOOBXPC-UKRRQHHQSA-N 1 1 229.367 3.583 20 0 BHADMO Cc1ccccc1[C@H]1C[C@H](C)[N@H+](CC2CC2)C1 ZINC000531658818 323111285 /nfs/dbraw/zinc/11/12/85/323111285.db2.gz PYKFJGHSOOBXPC-ZFWWWQNUSA-N 1 1 229.367 3.583 20 0 BHADMO C[C@H]([NH2+]Cc1ccc([C@@H]2C[C@@H]2C)o1)c1ccoc1 ZINC000531700702 323111866 /nfs/dbraw/zinc/11/18/66/323111866.db2.gz PQSHDUOFMRHUSJ-COPLHBTASA-N 1 1 245.322 3.847 20 0 BHADMO C[C@H]([NH2+]Cc1ccc([C@H]2C[C@@H]2C)o1)c1ccoc1 ZINC000531700703 323111871 /nfs/dbraw/zinc/11/18/71/323111871.db2.gz PQSHDUOFMRHUSJ-MJVIPROJSA-N 1 1 245.322 3.847 20 0 BHADMO C[C@H]([NH2+]Cc1ccc([C@H]2C[C@H]2C)o1)c1ccoc1 ZINC000531700704 323111769 /nfs/dbraw/zinc/11/17/69/323111769.db2.gz PQSHDUOFMRHUSJ-SUNKGSAMSA-N 1 1 245.322 3.847 20 0 BHADMO C[C@H]([NH2+]Cc1ccc([C@@H]2C[C@H]2C)o1)c1ccoc1 ZINC000531700705 323111837 /nfs/dbraw/zinc/11/18/37/323111837.db2.gz PQSHDUOFMRHUSJ-UHIISALHSA-N 1 1 245.322 3.847 20 0 BHADMO CCC[N@@H+](CCCF)Cc1ccc(C)cc1 ZINC000531731709 323112613 /nfs/dbraw/zinc/11/26/13/323112613.db2.gz AQUGRFJYAJQYQF-UHFFFAOYSA-N 1 1 223.335 3.567 20 0 BHADMO CC[C@@H]1CC[N@@H+](Cc2cc3ccccc3o2)C1 ZINC000531756907 323112869 /nfs/dbraw/zinc/11/28/69/323112869.db2.gz YQTGQHDAJOOWGZ-GFCCVEGCSA-N 1 1 229.323 3.665 20 0 BHADMO CC[C@H]1CC[N@@H+](Cc2cc3ccccc3o2)C1 ZINC000531756908 323112867 /nfs/dbraw/zinc/11/28/67/323112867.db2.gz YQTGQHDAJOOWGZ-LBPRGKRZSA-N 1 1 229.323 3.665 20 0 BHADMO CCC[C@@H](C)[C@H]1CCC[N@H+]1CCC(F)(F)F ZINC000531756909 323112873 /nfs/dbraw/zinc/11/28/73/323112873.db2.gz YTEVTCYGUSXBER-GHMZBOCLSA-N 1 1 237.309 3.839 20 0 BHADMO CCC[C@@H](C)[C@@H]1CCC[N@H+]1CCC(F)(F)F ZINC000531756910 323112857 /nfs/dbraw/zinc/11/28/57/323112857.db2.gz YTEVTCYGUSXBER-MNOVXSKESA-N 1 1 237.309 3.839 20 0 BHADMO CCC[C@H](C)[C@@H]1CCC[N@H+]1CCC(F)(F)F ZINC000531756911 323112917 /nfs/dbraw/zinc/11/29/17/323112917.db2.gz YTEVTCYGUSXBER-QWRGUYRKSA-N 1 1 237.309 3.839 20 0 BHADMO CCC[C@H](C)[C@H]1CCC[N@H+]1CCC(F)(F)F ZINC000531756912 323112905 /nfs/dbraw/zinc/11/29/05/323112905.db2.gz YTEVTCYGUSXBER-WDEREUQCSA-N 1 1 237.309 3.839 20 0 BHADMO CCCCC[C@H]1CCC[N@H+]1CCc1ccncc1 ZINC000531757090 323112850 /nfs/dbraw/zinc/11/28/50/323112850.db2.gz MGWFONHCIYKCPB-INIZCTEOSA-N 1 1 246.398 3.669 20 0 BHADMO CCCCC[C@@H]1CCC[N@H+]1CCc1ccncc1 ZINC000531757091 323112840 /nfs/dbraw/zinc/11/28/40/323112840.db2.gz MGWFONHCIYKCPB-MRXNPFEDSA-N 1 1 246.398 3.669 20 0 BHADMO CC[N@H+](Cc1cc2ccccc2o1)CC1CC1 ZINC000531757125 323112825 /nfs/dbraw/zinc/11/28/25/323112825.db2.gz FZSUYQNOLHTBFU-UHFFFAOYSA-N 1 1 229.323 3.665 20 0 BHADMO CCC[C@H](C)[C@@H]1CCC[N@H+]1CCOC(C)(C)C ZINC000531757126 323112890 /nfs/dbraw/zinc/11/28/90/323112890.db2.gz IFJBZOSVTRTQGK-KBPBESRZSA-N 1 1 241.419 3.702 20 0 BHADMO CCC[C@@H](C)[C@@H]1CCC[N@H+]1CCOC(C)(C)C ZINC000531757127 323112836 /nfs/dbraw/zinc/11/28/36/323112836.db2.gz IFJBZOSVTRTQGK-KGLIPLIRSA-N 1 1 241.419 3.702 20 0 BHADMO CCC[C@H](C)[C@H]1CCC[N@H+]1CCOC(C)(C)C ZINC000531757128 323112945 /nfs/dbraw/zinc/11/29/45/323112945.db2.gz IFJBZOSVTRTQGK-UONOGXRCSA-N 1 1 241.419 3.702 20 0 BHADMO CCC[C@@H](C)[C@H]1CCC[N@H+]1CCOC(C)(C)C ZINC000531757129 323112902 /nfs/dbraw/zinc/11/29/02/323112902.db2.gz IFJBZOSVTRTQGK-ZIAGYGMSSA-N 1 1 241.419 3.702 20 0 BHADMO C[C@@H]1C[C@H](C)[N@@H+](Cc2cc3ccccc3o2)C1 ZINC000531757142 323112865 /nfs/dbraw/zinc/11/28/65/323112865.db2.gz LTINFMJXLWXXCA-NEPJUHHUSA-N 1 1 229.323 3.663 20 0 BHADMO C[C@@H]1C[C@H](C)C[N@@H+]1Cc1cc2ccccc2o1 ZINC000531757143 323112943 /nfs/dbraw/zinc/11/29/43/323112943.db2.gz LTINFMJXLWXXCA-NWDGAFQWSA-N 1 1 229.323 3.663 20 0 BHADMO C[C@H]1C[C@H](C)[N@@H+](Cc2cc3ccccc3o2)C1 ZINC000531757144 323112933 /nfs/dbraw/zinc/11/29/33/323112933.db2.gz LTINFMJXLWXXCA-RYUDHWBXSA-N 1 1 229.323 3.663 20 0 BHADMO C[C@@H]1C[C@@H](C)[N@@H+](Cc2cc3ccccc3o2)C1 ZINC000531757145 323112898 /nfs/dbraw/zinc/11/28/98/323112898.db2.gz LTINFMJXLWXXCA-VXGBXAGGSA-N 1 1 229.323 3.663 20 0 BHADMO CC(C)CC[C@@H]1CCC[N@H+]1CCOC(C)(C)C ZINC000531757166 323112893 /nfs/dbraw/zinc/11/28/93/323112893.db2.gz SDXDJTKVRUZBID-AWEZNQCLSA-N 1 1 241.419 3.702 20 0 BHADMO CC(C)CC[C@H]1CCC[N@H+]1CCOC(C)(C)C ZINC000531757167 323112881 /nfs/dbraw/zinc/11/28/81/323112881.db2.gz SDXDJTKVRUZBID-CQSZACIVSA-N 1 1 241.419 3.702 20 0 BHADMO CCCCC[C@@H]1CCC[N@H+]1Cc1cc(C)no1 ZINC000531757239 323112884 /nfs/dbraw/zinc/11/28/84/323112884.db2.gz DHJRXUNCKLQRQP-CYBMUJFWSA-N 1 1 236.359 3.528 20 0 BHADMO CCCCC[C@H]1CCC[N@H+]1Cc1cc(C)no1 ZINC000531757240 323112911 /nfs/dbraw/zinc/11/29/11/323112911.db2.gz DHJRXUNCKLQRQP-ZDUSSCGKSA-N 1 1 236.359 3.528 20 0 BHADMO c1c2ccccc2oc1C[N@H+]1C[C@@H]2CCC[C@@H]2C1 ZINC000531757344 323112938 /nfs/dbraw/zinc/11/29/38/323112938.db2.gz MHEBZFCSAJZRLL-OKILXGFUSA-N 1 1 241.334 3.665 20 0 BHADMO CCC(CC)[N@@H+](CC(C)C)C[C@@H]1CCCOC1 ZINC000531765038 323112786 /nfs/dbraw/zinc/11/27/86/323112786.db2.gz XWLKLAZFKMKRSC-AWEZNQCLSA-N 1 1 241.419 3.560 20 0 BHADMO CCC(CC)[N@@H+](CC(C)C)C[C@H]1CCCOC1 ZINC000531765039 323112812 /nfs/dbraw/zinc/11/28/12/323112812.db2.gz XWLKLAZFKMKRSC-CQSZACIVSA-N 1 1 241.419 3.560 20 0 BHADMO CCC(CC)[N@@H+](Cc1nc(C)cs1)C1CC1 ZINC000531779671 323113150 /nfs/dbraw/zinc/11/31/50/323113150.db2.gz UBEMKABSOHIJLX-UHFFFAOYSA-N 1 1 238.400 3.605 20 0 BHADMO Clc1cccc(C[N@H+]2C[C@@H]3CCC[C@@H]3C2)c1 ZINC000531801013 323113942 /nfs/dbraw/zinc/11/39/42/323113942.db2.gz FIYRRTSRQVIKLO-BETUJISGSA-N 1 1 235.758 3.572 20 0 BHADMO CC[C@@]1(C)CC[N@@H+](Cc2cccc(F)c2F)C1 ZINC000531833385 323114872 /nfs/dbraw/zinc/11/48/72/323114872.db2.gz JVPCPWNEHJUPBU-AWEZNQCLSA-N 1 1 239.309 3.587 20 0 BHADMO CC[C@]1(C)CC[N@@H+](Cc2cccc(F)c2F)C1 ZINC000531833386 323114891 /nfs/dbraw/zinc/11/48/91/323114891.db2.gz JVPCPWNEHJUPBU-CQSZACIVSA-N 1 1 239.309 3.587 20 0 BHADMO CC(C)C[N@H+]1CCc2c(F)cc(F)cc2[C@@H]1C ZINC000531833433 323114908 /nfs/dbraw/zinc/11/49/08/323114908.db2.gz KQHWDOQJWPSGFM-JTQLQIEISA-N 1 1 239.309 3.540 20 0 BHADMO CC(C)C[N@H+]1CCc2c(F)cc(F)cc2[C@H]1C ZINC000531833434 323114895 /nfs/dbraw/zinc/11/48/95/323114895.db2.gz KQHWDOQJWPSGFM-SNVBAGLBSA-N 1 1 239.309 3.540 20 0 BHADMO CC[C@@]1(C)CC[N@@H+](Cc2ccc(F)cc2F)C1 ZINC000531833443 323114951 /nfs/dbraw/zinc/11/49/51/323114951.db2.gz NDCTWNSQAQJTQP-AWEZNQCLSA-N 1 1 239.309 3.587 20 0 BHADMO CC[C@]1(C)CC[N@@H+](Cc2ccc(F)cc2F)C1 ZINC000531833444 323114930 /nfs/dbraw/zinc/11/49/30/323114930.db2.gz NDCTWNSQAQJTQP-CQSZACIVSA-N 1 1 239.309 3.587 20 0 BHADMO Clc1ccc(C[N@@H+](CC2CC2)C2CC2)cc1 ZINC000531911033 352587480 /nfs/dbraw/zinc/58/74/80/352587480.db2.gz JRBXXJXNWWISRL-UHFFFAOYSA-N 1 1 235.758 3.714 20 0 BHADMO Cc1cccc([C@@H]2CCC[N@H+]2CC2CC2)c1C ZINC000531912445 323153500 /nfs/dbraw/zinc/15/35/00/323153500.db2.gz YXVSGATVWVMEDK-INIZCTEOSA-N 1 1 229.367 3.850 20 0 BHADMO Cc1cccc([C@H]2CCC[N@H+]2CC2CC2)c1C ZINC000531912446 323153541 /nfs/dbraw/zinc/15/35/41/323153541.db2.gz YXVSGATVWVMEDK-MRXNPFEDSA-N 1 1 229.367 3.850 20 0 BHADMO C[C@H](Cc1ccc(Cl)cc1)[N@@H+](C)CC1CC1 ZINC000531912702 323154162 /nfs/dbraw/zinc/15/41/62/323154162.db2.gz GNOCYAQZKUTIKT-LLVKDONJSA-N 1 1 237.774 3.613 20 0 BHADMO C[C@@H](Cc1ccc(Cl)cc1)[N@@H+](C)CC1CC1 ZINC000531912703 323154126 /nfs/dbraw/zinc/15/41/26/323154126.db2.gz GNOCYAQZKUTIKT-NSHDSACASA-N 1 1 237.774 3.613 20 0 BHADMO CC(C)[C@H](Cc1ccc(F)cc1)[N@@H+](C)CC1CC1 ZINC000531913024 352587867 /nfs/dbraw/zinc/58/78/67/352587867.db2.gz VVLLOBRKIXXLJI-INIZCTEOSA-N 1 1 249.373 3.735 20 0 BHADMO CC(C)[C@@H](Cc1ccc(F)cc1)[N@@H+](C)CC1CC1 ZINC000531913025 352587871 /nfs/dbraw/zinc/58/78/71/352587871.db2.gz VVLLOBRKIXXLJI-MRXNPFEDSA-N 1 1 249.373 3.735 20 0 BHADMO C[N@@H+](CCCC1CCCC1)Cc1cccc(O)c1 ZINC000531969282 323159950 /nfs/dbraw/zinc/15/99/50/323159950.db2.gz RBHRCSZAIPBTQX-UHFFFAOYSA-N 1 1 247.382 3.794 20 0 BHADMO CC1(C)[C@@H]2C[N@H+](Cc3cc4ccccc4o3)C[C@@H]21 ZINC000532014067 323167316 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ZINC000532058679 323170854 /nfs/dbraw/zinc/17/08/54/323170854.db2.gz AWKDBUIVPYYFHU-BFHYXJOUSA-N 1 1 241.444 3.640 20 0 BHADMO CSCCC[N@H+]1CC[C@H](C)[C@@H]2CCCC[C@@H]21 ZINC000532058680 323170829 /nfs/dbraw/zinc/17/08/29/323170829.db2.gz AWKDBUIVPYYFHU-IHRRRGAJSA-N 1 1 241.444 3.640 20 0 BHADMO CSCCC[N@H+]1CC[C@H](C)[C@@H]2CCCC[C@H]21 ZINC000532058681 323170806 /nfs/dbraw/zinc/17/08/06/323170806.db2.gz AWKDBUIVPYYFHU-MELADBBJSA-N 1 1 241.444 3.640 20 0 BHADMO CSCCC[N@H+]1CC[C@H](C)[C@H]2CCCC[C@@H]21 ZINC000532058682 323170743 /nfs/dbraw/zinc/17/07/43/323170743.db2.gz AWKDBUIVPYYFHU-MJBXVCDLSA-N 1 1 241.444 3.640 20 0 BHADMO Cc1ccc(C)c(C[N@H+]2C[C@@H]3CCC[C@@H]3C2)c1 ZINC000532059167 323170852 /nfs/dbraw/zinc/17/08/52/323170852.db2.gz FQCQSOAMUYWMBY-GASCZTMLSA-N 1 1 229.367 3.535 20 0 BHADMO C[C@@H]1CC[C@H](C)[N@@H+]1C/C=C\c1ccccc1 ZINC000532072611 323171529 /nfs/dbraw/zinc/17/15/29/323171529.db2.gz JKQPFGQZUVWBOT-JDPNTUOHSA-N 1 1 215.340 3.573 20 0 BHADMO C[C@@H]1CC[C@H](C)[N@@H+]1C/C=C/c1ccccc1 ZINC000532072614 323171670 /nfs/dbraw/zinc/17/16/70/323171670.db2.gz JKQPFGQZUVWBOT-YLXGSJGQSA-N 1 1 215.340 3.573 20 0 BHADMO CC(C)Oc1cccc(C[N@@H+]2[C@H](C)CC[C@@H]2C)c1 ZINC000532072919 323171603 /nfs/dbraw/zinc/17/16/03/323171603.db2.gz GYDWFVTUYIIVNY-OKILXGFUSA-N 1 1 247.382 3.847 20 0 BHADMO CC(C)C[C@H]1CCC[N@@H+](CCC(F)(F)F)C1 ZINC000532091657 323196541 /nfs/dbraw/zinc/19/65/41/323196541.db2.gz ZCYQDUYTNMOTHY-LLVKDONJSA-N 1 1 237.309 3.697 20 0 BHADMO CC(C)C[C@@H]1CCC[N@@H+](CCC(F)(F)F)C1 ZINC000532091658 323196561 /nfs/dbraw/zinc/19/65/61/323196561.db2.gz ZCYQDUYTNMOTHY-NSHDSACASA-N 1 1 237.309 3.697 20 0 BHADMO Cc1ccc2c(c1)CC[C@@H]2Nc1cc(C)cc[nH+]1 ZINC000532098792 323206144 /nfs/dbraw/zinc/20/61/44/323206144.db2.gz KEEFAISWDHLVHR-HNNXBMFYSA-N 1 1 238.334 3.798 20 0 BHADMO Cc1ccc2c(c1)CC[C@H]2Nc1cc(C)cc[nH+]1 ZINC000532098793 323206159 /nfs/dbraw/zinc/20/61/59/323206159.db2.gz KEEFAISWDHLVHR-OAHLLOKOSA-N 1 1 238.334 3.798 20 0 BHADMO 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Fc1ccc([C@@H]2CCCC[N@H+]2CC2CC2)cc1 ZINC000532168271 323208431 /nfs/dbraw/zinc/20/84/31/323208431.db2.gz HQKQCLKJTOUPEH-HNNXBMFYSA-N 1 1 233.330 3.763 20 0 BHADMO Fc1ccc([C@H]2CCCC[N@H+]2CC2CC2)cc1 ZINC000532168272 323208366 /nfs/dbraw/zinc/20/83/66/323208366.db2.gz HQKQCLKJTOUPEH-OAHLLOKOSA-N 1 1 233.330 3.763 20 0 BHADMO C[C@@H]1C[C@@H](c2ccccc2F)[N@@H+](CC2CC2)C1 ZINC000532224734 323211702 /nfs/dbraw/zinc/21/17/02/323211702.db2.gz XQRODBYPRXEJPN-ABAIWWIYSA-N 1 1 233.330 3.619 20 0 BHADMO C[C@@H]1C[C@H](c2ccccc2F)[N@@H+](CC2CC2)C1 ZINC000532224739 323211655 /nfs/dbraw/zinc/21/16/55/323211655.db2.gz XQRODBYPRXEJPN-IAQYHMDHSA-N 1 1 233.330 3.619 20 0 BHADMO C[C@H]1C[C@@H](c2ccccc2F)[N@@H+](CC2CC2)C1 ZINC000532224740 323211763 /nfs/dbraw/zinc/21/17/63/323211763.db2.gz XQRODBYPRXEJPN-NHYWBVRUSA-N 1 1 233.330 3.619 20 0 BHADMO C[C@H]1C[C@H](c2ccccc2F)[N@@H+](CC2CC2)C1 ZINC000532224741 323211696 /nfs/dbraw/zinc/21/16/96/323211696.db2.gz XQRODBYPRXEJPN-XHDPSFHLSA-N 1 1 233.330 3.619 20 0 BHADMO CCCCC[C@H]1CCCN1c1cc(C)[nH+]c(C)n1 ZINC000532261177 487601956 /nfs/dbraw/zinc/60/19/56/487601956.db2.gz CYXZBCSAWCRINM-AWEZNQCLSA-N 1 1 247.386 3.643 20 0 BHADMO CCCCC[C@@H]1CCCN1c1cc(C)[nH+]c(C)n1 ZINC000532261178 487601623 /nfs/dbraw/zinc/60/16/23/487601623.db2.gz CYXZBCSAWCRINM-CQSZACIVSA-N 1 1 247.386 3.643 20 0 BHADMO C[C@H]1C[N@@H+](Cc2cc3ccccc3o2)C[C@H]1C ZINC000532267780 323212836 /nfs/dbraw/zinc/21/28/36/323212836.db2.gz BIJVUMJXNLZDOD-TXEJJXNPSA-N 1 1 229.323 3.521 20 0 BHADMO CC(C)[N@@H+](CC(F)F)CC1CCCCC1 ZINC000532267791 323212656 /nfs/dbraw/zinc/21/26/56/323212656.db2.gz CMLMJFBORVTPSM-UHFFFAOYSA-N 1 1 219.319 3.542 20 0 BHADMO CC(C)[N@H+](CC(F)F)CC1CCCCC1 ZINC000532267791 323212655 /nfs/dbraw/zinc/21/26/55/323212655.db2.gz CMLMJFBORVTPSM-UHFFFAOYSA-N 1 1 219.319 3.542 20 0 BHADMO CC(C)CC[C@H]1CCC[N@H+]1CCC(F)(F)F ZINC000532267953 323212642 /nfs/dbraw/zinc/21/26/42/323212642.db2.gz JKSBRGBRNRQCSZ-LLVKDONJSA-N 1 1 237.309 3.839 20 0 BHADMO 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CC(C)[C@@H]1CC[N@@H+](C/C=C/c2ccccc2)C1 ZINC000532293285 323214036 /nfs/dbraw/zinc/21/40/36/323214036.db2.gz FZRLJOKAMAVDBY-YXMGTMDOSA-N 1 1 229.367 3.678 20 0 BHADMO CC[C@@H]1CC[N@@H+](Cc2ccc(Cl)cc2)C1 ZINC000532293372 323213965 /nfs/dbraw/zinc/21/39/65/323213965.db2.gz XDWRBZUOFNGPHT-LLVKDONJSA-N 1 1 223.747 3.572 20 0 BHADMO CC[C@H]1CC[N@@H+](Cc2ccc(Cl)cc2)C1 ZINC000532293382 323214120 /nfs/dbraw/zinc/21/41/20/323214120.db2.gz XDWRBZUOFNGPHT-NSHDSACASA-N 1 1 223.747 3.572 20 0 BHADMO Clc1ccccc1C[N@H+]1C[C@@H]2CCC[C@@H]2C1 ZINC000532312166 323215384 /nfs/dbraw/zinc/21/53/84/323215384.db2.gz KPGIPTULQBZFIR-TXEJJXNPSA-N 1 1 235.758 3.572 20 0 BHADMO Clc1ccc(C[N@H+]2C[C@@H]3CCC[C@@H]3C2)cc1 ZINC000532312192 323215500 /nfs/dbraw/zinc/21/55/00/323215500.db2.gz SBSOEEIYMUFNIU-BETUJISGSA-N 1 1 235.758 3.572 20 0 BHADMO Cc1cc(C)cc(C[N@H+]2C[C@@H]3CCC[C@@H]3C2)c1 ZINC000532312963 323215858 /nfs/dbraw/zinc/21/58/58/323215858.db2.gz IOQZKSOIUHPSKN-IYBDPMFKSA-N 1 1 229.367 3.535 20 0 BHADMO 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C[C@@H]1C[N@@H+](CC2CC2)CC[C@@H]1c1ccccc1 ZINC000532422350 356420535 /nfs/dbraw/zinc/42/05/35/356420535.db2.gz CZAKZPILCFBILW-CJNGLKHVSA-N 1 1 229.367 3.522 20 0 BHADMO C[C@@H]1C[N@@H+](CC2CC2)CC[C@H]1c1ccccc1 ZINC000532422351 356420573 /nfs/dbraw/zinc/42/05/73/356420573.db2.gz CZAKZPILCFBILW-CZUORRHYSA-N 1 1 229.367 3.522 20 0 BHADMO C[C@H]1C[N@@H+](CC2CC2)CC[C@H]1c1ccccc1 ZINC000532422352 356420584 /nfs/dbraw/zinc/42/05/84/356420584.db2.gz CZAKZPILCFBILW-XJKSGUPXSA-N 1 1 229.367 3.522 20 0 BHADMO C[C@@H]1CC[N@@H+](CC2CC2)[C@@H]1c1cccc(F)c1 ZINC000532422505 323261620 /nfs/dbraw/zinc/26/16/20/323261620.db2.gz IENAMOFMTZXCBT-ABAIWWIYSA-N 1 1 233.330 3.619 20 0 BHADMO C[C@@H]1CC[N@@H+](CC2CC2)[C@H]1c1cccc(F)c1 ZINC000532422514 323262077 /nfs/dbraw/zinc/26/20/77/323262077.db2.gz IENAMOFMTZXCBT-IAQYHMDHSA-N 1 1 233.330 3.619 20 0 BHADMO C[C@H]1CC[N@@H+](CC2CC2)[C@@H]1c1cccc(F)c1 ZINC000532422515 323261747 /nfs/dbraw/zinc/26/17/47/323261747.db2.gz IENAMOFMTZXCBT-NHYWBVRUSA-N 1 1 233.330 3.619 20 0 BHADMO C[C@H]1CC[N@@H+](CC2CC2)[C@H]1c1cccc(F)c1 ZINC000532422516 323262122 /nfs/dbraw/zinc/26/21/22/323262122.db2.gz IENAMOFMTZXCBT-XHDPSFHLSA-N 1 1 233.330 3.619 20 0 BHADMO CC[C@@H](Cc1ccc(C)cc1)[N@@H+](C)CC1CC1 ZINC000532422965 323262087 /nfs/dbraw/zinc/26/20/87/323262087.db2.gz YUVZQIJHGNZIAZ-INIZCTEOSA-N 1 1 231.383 3.658 20 0 BHADMO CC[C@H](Cc1ccc(C)cc1)[N@@H+](C)CC1CC1 ZINC000532422966 323262020 /nfs/dbraw/zinc/26/20/20/323262020.db2.gz YUVZQIJHGNZIAZ-MRXNPFEDSA-N 1 1 231.383 3.658 20 0 BHADMO CC[C@@H](c1ccccc1)[N@@H+](C)C[C@H]1CCCCO1 ZINC000532486294 323270790 /nfs/dbraw/zinc/27/07/90/323270790.db2.gz QRKUSNOBWKBNKB-CVEARBPZSA-N 1 1 247.382 3.639 20 0 BHADMO CC[C@@H](c1ccccc1)[N@@H+](C)C[C@@H]1CCCCO1 ZINC000532486295 323270677 /nfs/dbraw/zinc/27/06/77/323270677.db2.gz QRKUSNOBWKBNKB-HOTGVXAUSA-N 1 1 247.382 3.639 20 0 BHADMO CC[C@H](c1ccccc1)[N@@H+](C)C[C@H]1CCCCO1 ZINC000532486297 323270696 /nfs/dbraw/zinc/27/06/96/323270696.db2.gz QRKUSNOBWKBNKB-HZPDHXFCSA-N 1 1 247.382 3.639 20 0 BHADMO CC[C@H](c1ccccc1)[N@@H+](C)C[C@@H]1CCCCO1 ZINC000532486396 323270942 /nfs/dbraw/zinc/27/09/42/323270942.db2.gz QRKUSNOBWKBNKB-JKSUJKDBSA-N 1 1 247.382 3.639 20 0 BHADMO Cc1ccc(CC[N@H+](C)[C@@H](C)C(C)C)cc1 ZINC000532487977 323270824 /nfs/dbraw/zinc/27/08/24/323270824.db2.gz UQCSLGFMTFBPSJ-AWEZNQCLSA-N 1 1 219.372 3.514 20 0 BHADMO Cc1ccc(CC[N@H+](C)[C@H](C)C(C)C)cc1 ZINC000532487978 323270537 /nfs/dbraw/zinc/27/05/37/323270537.db2.gz UQCSLGFMTFBPSJ-CQSZACIVSA-N 1 1 219.372 3.514 20 0 BHADMO C[C@H]([N@@H+](C)Cc1ccc(F)c(F)c1)C(C)(C)C ZINC000532490014 323268308 /nfs/dbraw/zinc/26/83/08/323268308.db2.gz HDZPTIRIQFULIR-JTQLQIEISA-N 1 1 241.325 3.831 20 0 BHADMO C[C@@H]([N@@H+](C)Cc1ccc(F)c(F)c1)C(C)(C)C ZINC000532490029 323268936 /nfs/dbraw/zinc/26/89/36/323268936.db2.gz HDZPTIRIQFULIR-SNVBAGLBSA-N 1 1 241.325 3.831 20 0 BHADMO CCc1ccc(C[N@@H+](C)Cc2ccccc2)s1 ZINC000532496847 323269871 /nfs/dbraw/zinc/26/98/71/323269871.db2.gz IPEITZVJINFANQ-UHFFFAOYSA-N 1 1 245.391 3.943 20 0 BHADMO C[C@H]([NH2+][C@H]1CSc2ccccc21)c1ccoc1 ZINC000532500546 323271021 /nfs/dbraw/zinc/27/10/21/323271021.db2.gz PBQIJKAGZATUGH-GWCFXTLKSA-N 1 1 245.347 3.777 20 0 BHADMO C[C@H]([NH2+][C@@H]1CSc2ccccc21)c1ccoc1 ZINC000532500547 323270854 /nfs/dbraw/zinc/27/08/54/323270854.db2.gz PBQIJKAGZATUGH-GXFFZTMASA-N 1 1 245.347 3.777 20 0 BHADMO C[C@@H]([NH2+][C@H]1CSc2ccccc21)c1ccoc1 ZINC000532500548 323270971 /nfs/dbraw/zinc/27/09/71/323270971.db2.gz PBQIJKAGZATUGH-MFKMUULPSA-N 1 1 245.347 3.777 20 0 BHADMO C[C@@H]([NH2+][C@@H]1CSc2ccccc21)c1ccoc1 ZINC000532500549 323270817 /nfs/dbraw/zinc/27/08/17/323270817.db2.gz PBQIJKAGZATUGH-ZWNOBZJWSA-N 1 1 245.347 3.777 20 0 BHADMO CCC[N@@H+](CC)Cc1ccc(OC(C)C)cc1 ZINC000532502162 323271729 /nfs/dbraw/zinc/27/17/29/323271729.db2.gz GXDLJOAZGZERPL-UHFFFAOYSA-N 1 1 235.371 3.706 20 0 BHADMO CC(C)C[N@@H+](C)[C@@H](C)CCc1ccccc1 ZINC000532503148 323271764 /nfs/dbraw/zinc/27/17/64/323271764.db2.gz CFEOHZWNYKNWBS-AWEZNQCLSA-N 1 1 219.372 3.596 20 0 BHADMO CC(C)C[N@@H+](C)[C@H](C)CCc1ccccc1 ZINC000532503149 323271692 /nfs/dbraw/zinc/27/16/92/323271692.db2.gz CFEOHZWNYKNWBS-CQSZACIVSA-N 1 1 219.372 3.596 20 0 BHADMO Cc1ccccc1[C@@H](C)[N@@H+]1C[C@@H](C)S[C@@H](C)C1 ZINC000532504196 323271382 /nfs/dbraw/zinc/27/13/82/323271382.db2.gz GKKHBYGAYQDDTN-HZSPNIEDSA-N 1 1 249.423 3.882 20 0 BHADMO Cc1ccccc1[C@H](C)[N@@H+]1C[C@@H](C)S[C@@H](C)C1 ZINC000532504201 323271553 /nfs/dbraw/zinc/27/15/53/323271553.db2.gz GKKHBYGAYQDDTN-MJBXVCDLSA-N 1 1 249.423 3.882 20 0 BHADMO CCC[N@@H+](C)[C@H](C)c1ccc(F)c(Cl)c1 ZINC000532513844 323272469 /nfs/dbraw/zinc/27/24/69/323272469.db2.gz ZYIBAKYIQYPSQB-SECBINFHSA-N 1 1 229.726 3.882 20 0 BHADMO CCC[N@@H+](C)[C@@H](C)c1ccc(F)c(Cl)c1 ZINC000532513845 323272216 /nfs/dbraw/zinc/27/22/16/323272216.db2.gz ZYIBAKYIQYPSQB-VIFPVBQESA-N 1 1 229.726 3.882 20 0 BHADMO CCc1ccc(C[N@@H+](C)CC2CCC2)s1 ZINC000532518060 323273260 /nfs/dbraw/zinc/27/32/60/323273260.db2.gz CNNAALVUBRLQOE-UHFFFAOYSA-N 1 1 223.385 3.542 20 0 BHADMO C[C@H](c1ccc(F)cc1)[N@@H+](C)CC(C)(C)C ZINC000532549071 323276229 /nfs/dbraw/zinc/27/62/29/323276229.db2.gz JRSCEJGLTOGTFO-LLVKDONJSA-N 1 1 223.335 3.865 20 0 BHADMO C[C@@H](c1ccc(F)cc1)[N@@H+](C)CC(C)(C)C ZINC000532549072 323276475 /nfs/dbraw/zinc/27/64/75/323276475.db2.gz JRSCEJGLTOGTFO-NSHDSACASA-N 1 1 223.335 3.865 20 0 BHADMO C[C@@H](c1ccc(F)cc1F)[N@@H+](C)CC1CCC1 ZINC000532583923 323278148 /nfs/dbraw/zinc/27/81/48/323278148.db2.gz YUDNHGZMKSAKFU-JTQLQIEISA-N 1 1 239.309 3.758 20 0 BHADMO C[C@H](c1ccc(F)cc1F)[N@@H+](C)CC1CCC1 ZINC000532584010 323278254 /nfs/dbraw/zinc/27/82/54/323278254.db2.gz YUDNHGZMKSAKFU-SNVBAGLBSA-N 1 1 239.309 3.758 20 0 BHADMO CCc1ccc(C[N@H+]2CCC[C@H]2CSC)cc1 ZINC000532624114 323279550 /nfs/dbraw/zinc/27/95/50/323279550.db2.gz JSRFFPPTBQOIPU-HNNXBMFYSA-N 1 1 249.423 3.576 20 0 BHADMO CCc1ccc(C[N@H+]2CCC[C@@H]2CSC)cc1 ZINC000532624115 323279573 /nfs/dbraw/zinc/27/95/73/323279573.db2.gz JSRFFPPTBQOIPU-OAHLLOKOSA-N 1 1 249.423 3.576 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1ccc(C(F)(F)F)cc1 ZINC000532687222 323290576 /nfs/dbraw/zinc/29/05/76/323290576.db2.gz ABHMLZSZPLZFCE-JTQLQIEISA-N 1 1 245.288 3.936 20 0 BHADMO CC[C@@H](C)[N@@H+](C)Cc1ccc(C(F)(F)F)cc1 ZINC000532687223 323290655 /nfs/dbraw/zinc/29/06/55/323290655.db2.gz ABHMLZSZPLZFCE-SNVBAGLBSA-N 1 1 245.288 3.936 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1ccccc1C(F)(F)F ZINC000532687455 323290748 /nfs/dbraw/zinc/29/07/48/323290748.db2.gz WAOUESQAMVVSJE-JTQLQIEISA-N 1 1 245.288 3.936 20 0 BHADMO CC[C@@H](C)[N@@H+](C)Cc1ccccc1C(F)(F)F ZINC000532687457 323290773 /nfs/dbraw/zinc/29/07/73/323290773.db2.gz WAOUESQAMVVSJE-SNVBAGLBSA-N 1 1 245.288 3.936 20 0 BHADMO CC(C)[N@@H+](Cc1ccccc1)C1CCCC1 ZINC000532687494 323290740 /nfs/dbraw/zinc/29/07/40/323290740.db2.gz WSNXYOIZULAZFQ-UHFFFAOYSA-N 1 1 217.356 3.840 20 0 BHADMO CC(C)[N@@H+](Cc1cccc(F)c1)C1CCCC1 ZINC000532688429 323290374 /nfs/dbraw/zinc/29/03/74/323290374.db2.gz VLBKRNRMIXKJLH-UHFFFAOYSA-N 1 1 235.346 3.979 20 0 BHADMO COc1cccc(C[N@@H+](C(C)C)C2CCCC2)c1 ZINC000532688690 323290383 /nfs/dbraw/zinc/29/03/83/323290383.db2.gz LBRXTWWYLUKPDD-UHFFFAOYSA-N 1 1 247.382 3.848 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1cccc(Cl)c1 ZINC000532688863 323290246 /nfs/dbraw/zinc/29/02/46/323290246.db2.gz BYHKMHPENMUPTM-JTQLQIEISA-N 1 1 211.736 3.570 20 0 BHADMO CC[C@@H](C)[N@@H+](C)Cc1cccc(Cl)c1 ZINC000532688864 323290617 /nfs/dbraw/zinc/29/06/17/323290617.db2.gz BYHKMHPENMUPTM-SNVBAGLBSA-N 1 1 211.736 3.570 20 0 BHADMO CC(C)[N@@H+](CCOC(C)(C)C)C1CCCCC1 ZINC000532692473 323289015 /nfs/dbraw/zinc/28/90/15/323289015.db2.gz WNERXAQFPGSACH-UHFFFAOYSA-N 1 1 241.419 3.845 20 0 BHADMO C[C@H](c1cccc(O)c1)[N@@H+](C)CCC1CCCC1 ZINC000532703969 323290302 /nfs/dbraw/zinc/29/03/02/323290302.db2.gz PYEPWYITMJHQRV-CYBMUJFWSA-N 1 1 247.382 3.965 20 0 BHADMO C[C@@H](c1cccc(O)c1)[N@@H+](C)CCC1CCCC1 ZINC000532703970 323290339 /nfs/dbraw/zinc/29/03/39/323290339.db2.gz PYEPWYITMJHQRV-ZDUSSCGKSA-N 1 1 247.382 3.965 20 0 BHADMO CCSCC[C@@H](C)[N@@H+](C)CC1CCCC1 ZINC000532717783 323292122 /nfs/dbraw/zinc/29/21/22/323292122.db2.gz VVGRPNWURJJVSE-GFCCVEGCSA-N 1 1 229.433 3.640 20 0 BHADMO CCSCC[C@H](C)[N@@H+](C)CC1CCCC1 ZINC000532717784 323292275 /nfs/dbraw/zinc/29/22/75/323292275.db2.gz VVGRPNWURJJVSE-LBPRGKRZSA-N 1 1 229.433 3.640 20 0 BHADMO CC(C)C[C@H]1CCCC[N@H+]1CCC(F)(F)F ZINC000532724126 323292418 /nfs/dbraw/zinc/29/24/18/323292418.db2.gz YEGQZOCNSVXWQQ-LLVKDONJSA-N 1 1 237.309 3.839 20 0 BHADMO CC(C)C[C@@H]1CCCC[N@H+]1CCC(F)(F)F ZINC000532724127 323292312 /nfs/dbraw/zinc/29/23/12/323292312.db2.gz YEGQZOCNSVXWQQ-NSHDSACASA-N 1 1 237.309 3.839 20 0 BHADMO CCCC[N@@H+]1CC=C(c2cccc(OC)c2)CC1 ZINC000532729413 323291267 /nfs/dbraw/zinc/29/12/67/323291267.db2.gz ASJFSSAODOOCGY-UHFFFAOYSA-N 1 1 245.366 3.584 20 0 BHADMO CC(C)[N@@H+](C/C=C/c1ccccc1)C1CCC1 ZINC000532729678 323291453 /nfs/dbraw/zinc/29/14/53/323291453.db2.gz COQIKLHYORDOEM-JXMROGBWSA-N 1 1 229.367 3.963 20 0 BHADMO CC(C)[N@@H+](C/C=C\c1ccccc1)C1CCC1 ZINC000532729679 323291118 /nfs/dbraw/zinc/29/11/18/323291118.db2.gz COQIKLHYORDOEM-YFHOEESVSA-N 1 1 229.367 3.963 20 0 BHADMO Cc1ccc(CC[N@H+](C(C)C)C2CCC2)cc1 ZINC000532734222 323292844 /nfs/dbraw/zinc/29/28/44/323292844.db2.gz PLZSBQWDKJLEJD-UHFFFAOYSA-N 1 1 231.383 3.800 20 0 BHADMO CC(C)[N@@H+](CCCc1ccccc1)C1CCC1 ZINC000532734247 323293252 /nfs/dbraw/zinc/29/32/52/323293252.db2.gz SIIZKUKNIMZZIC-UHFFFAOYSA-N 1 1 231.383 3.882 20 0 BHADMO Cc1ncccc1CNc1cccc2cc[nH+]cc21 ZINC000532735639 323293122 /nfs/dbraw/zinc/29/31/22/323293122.db2.gz ANBYMBZEIBUNFK-UHFFFAOYSA-N 1 1 249.317 3.550 20 0 BHADMO CC[C@H](C)C[N@@H+](CC)Cc1cccc(COC)c1 ZINC000532744796 323293182 /nfs/dbraw/zinc/29/31/82/323293182.db2.gz NXDGHLANUQLEIE-AWEZNQCLSA-N 1 1 249.398 3.701 20 0 BHADMO CC[C@@H](C)C[N@@H+](CC)Cc1cccc(COC)c1 ZINC000532744797 323292976 /nfs/dbraw/zinc/29/29/76/323292976.db2.gz NXDGHLANUQLEIE-CQSZACIVSA-N 1 1 249.398 3.701 20 0 BHADMO CS[C@H]1CCCC[N@@H+](Cc2ccc(C)cc2)C1 ZINC000532745263 323294255 /nfs/dbraw/zinc/29/42/55/323294255.db2.gz DPUZCYVNXJCGRM-HNNXBMFYSA-N 1 1 249.423 3.713 20 0 BHADMO CS[C@@H]1CCCC[N@@H+](Cc2ccc(C)cc2)C1 ZINC000532745264 323294056 /nfs/dbraw/zinc/29/40/56/323294056.db2.gz DPUZCYVNXJCGRM-OAHLLOKOSA-N 1 1 249.423 3.713 20 0 BHADMO CS[C@@H]1CCCC[N@@H+](CCC(C)(C)C)C1 ZINC000532746267 323294168 /nfs/dbraw/zinc/29/41/68/323294168.db2.gz ZDXPVPKOVSTTFC-GFCCVEGCSA-N 1 1 229.433 3.640 20 0 BHADMO CS[C@H]1CCCC[N@@H+](CCC(C)(C)C)C1 ZINC000532746268 323294263 /nfs/dbraw/zinc/29/42/63/323294263.db2.gz ZDXPVPKOVSTTFC-LBPRGKRZSA-N 1 1 229.433 3.640 20 0 BHADMO Cc1cc(C)cc(C[N@@H+](C)CCC2CC2)c1 ZINC000532746556 323294134 /nfs/dbraw/zinc/29/41/34/323294134.db2.gz SYDVVXDQJNBGAT-UHFFFAOYSA-N 1 1 217.356 3.535 20 0 BHADMO CC(C)Oc1cccc(C[N@@H+](C)CCC2CC2)c1 ZINC000532747978 323294177 /nfs/dbraw/zinc/29/41/77/323294177.db2.gz YICOXZXMGVKKJX-UHFFFAOYSA-N 1 1 247.382 3.706 20 0 BHADMO CCC(C)(C)[C@H]1CCC[N@H+]1CCOC(C)(C)C ZINC000532757095 323295242 /nfs/dbraw/zinc/29/52/42/323295242.db2.gz SQDVAAXIKJPYDG-CYBMUJFWSA-N 1 1 241.419 3.702 20 0 BHADMO CCC(C)(C)[C@@H]1CCC[N@H+]1CCOC(C)(C)C ZINC000532757108 323295116 /nfs/dbraw/zinc/29/51/16/323295116.db2.gz SQDVAAXIKJPYDG-ZDUSSCGKSA-N 1 1 241.419 3.702 20 0 BHADMO C/C(=C\c1ccccc1)CNc1cccc(C)[nH+]1 ZINC000532870676 323305556 /nfs/dbraw/zinc/30/55/56/323305556.db2.gz VYVCARYDBZGRRW-ACCUITESSA-N 1 1 238.334 3.905 20 0 BHADMO C/C(=C/c1ccccc1)CNc1cccc(C)[nH+]1 ZINC000532870677 323305314 /nfs/dbraw/zinc/30/53/14/323305314.db2.gz VYVCARYDBZGRRW-QBFSEMIESA-N 1 1 238.334 3.905 20 0 BHADMO CCC1CCC([N@@H+](Cc2ccno2)C2CC2)CC1 ZINC000532919580 357838058 /nfs/dbraw/zinc/83/80/58/357838058.db2.gz SFZWJMJWSYQUMV-UHFFFAOYSA-N 1 1 248.370 3.608 20 0 BHADMO CC[C@@H](c1ccc(F)cc1F)[N@@H+](C)CC1CC1 ZINC000532919671 357838681 /nfs/dbraw/zinc/83/86/81/357838681.db2.gz AHUQLAWQTKTNPE-AWEZNQCLSA-N 1 1 239.309 3.758 20 0 BHADMO CC[C@H](c1ccc(F)cc1F)[N@@H+](C)CC1CC1 ZINC000532919672 357838307 /nfs/dbraw/zinc/83/83/07/357838307.db2.gz AHUQLAWQTKTNPE-CQSZACIVSA-N 1 1 239.309 3.758 20 0 BHADMO Cc1ccc(CC[N@H+](C)Cc2cccs2)cc1 ZINC000532919773 357839719 /nfs/dbraw/zinc/83/97/19/357839719.db2.gz MUHYUFURVANLPA-UHFFFAOYSA-N 1 1 245.391 3.731 20 0 BHADMO Cc1ccc(CC[N@H+](C)[C@@H](C)c2ccco2)cc1 ZINC000532925560 323397124 /nfs/dbraw/zinc/39/71/24/323397124.db2.gz XMMLWAJFCGQTDG-AWEZNQCLSA-N 1 1 243.350 3.824 20 0 BHADMO Cc1ccc(CC[N@H+](C)[C@H](C)c2ccco2)cc1 ZINC000532925561 323397500 /nfs/dbraw/zinc/39/75/00/323397500.db2.gz XMMLWAJFCGQTDG-CQSZACIVSA-N 1 1 243.350 3.824 20 0 BHADMO CC[C@@H](c1ccccc1)[N@@H+](C)CC(C)C ZINC000532926631 323397383 /nfs/dbraw/zinc/39/73/83/323397383.db2.gz YBJFUWOKFYVRGK-AWEZNQCLSA-N 1 1 205.345 3.726 20 0 BHADMO CC[C@H](c1ccccc1)[N@@H+](C)CC(C)C ZINC000532926633 323397228 /nfs/dbraw/zinc/39/72/28/323397228.db2.gz YBJFUWOKFYVRGK-CQSZACIVSA-N 1 1 205.345 3.726 20 0 BHADMO COc1ccc(CC[N@@H+](C)[C@H](C)C(C)(C)C)cc1 ZINC000532927664 323397243 /nfs/dbraw/zinc/39/72/43/323397243.db2.gz ILSFPDBIMVHHEW-CYBMUJFWSA-N 1 1 249.398 3.604 20 0 BHADMO COc1ccc(CC[N@@H+](C)[C@@H](C)C(C)(C)C)cc1 ZINC000532927667 323397488 /nfs/dbraw/zinc/39/74/88/323397488.db2.gz ILSFPDBIMVHHEW-ZDUSSCGKSA-N 1 1 249.398 3.604 20 0 BHADMO C[C@@H]([N@@H+](C)CCc1ccccc1)C(C)(C)C ZINC000532929136 323398089 /nfs/dbraw/zinc/39/80/89/323398089.db2.gz ZSPAEOWINYQVNQ-CYBMUJFWSA-N 1 1 219.372 3.596 20 0 BHADMO C[C@H]([N@@H+](C)CCc1ccccc1)C(C)(C)C ZINC000532929138 323398231 /nfs/dbraw/zinc/39/82/31/323398231.db2.gz ZSPAEOWINYQVNQ-ZDUSSCGKSA-N 1 1 219.372 3.596 20 0 BHADMO Cc1nc(C[N@H+](C)[C@H](C)C(C)(C)C)sc1C ZINC000532929226 323398471 /nfs/dbraw/zinc/39/84/71/323398471.db2.gz HQMWTJLYFJFEJZ-LLVKDONJSA-N 1 1 240.416 3.626 20 0 BHADMO Cc1nc(C[N@H+](C)[C@@H](C)C(C)(C)C)sc1C ZINC000532929227 323397878 /nfs/dbraw/zinc/39/78/78/323397878.db2.gz HQMWTJLYFJFEJZ-NSHDSACASA-N 1 1 240.416 3.626 20 0 BHADMO C[C@H]([N@@H+](C)Cc1ccncc1Cl)C(C)(C)C ZINC000532929655 323398375 /nfs/dbraw/zinc/39/83/75/323398375.db2.gz YJTIVMAVVRJYTL-JTQLQIEISA-N 1 1 240.778 3.601 20 0 BHADMO C[C@@H]([N@@H+](C)Cc1ccncc1Cl)C(C)(C)C ZINC000532929656 323398155 /nfs/dbraw/zinc/39/81/55/323398155.db2.gz YJTIVMAVVRJYTL-SNVBAGLBSA-N 1 1 240.778 3.601 20 0 BHADMO CCC[N@@H+](C)[C@@H](C)c1ccc(OC(F)F)cc1 ZINC000532939123 387301426 /nfs/dbraw/zinc/30/14/26/387301426.db2.gz JINWQIJFSXNTHT-JTQLQIEISA-N 1 1 243.297 3.691 20 0 BHADMO CCC[N@@H+](C)[C@H](C)c1ccc(OC(F)F)cc1 ZINC000532939124 387301682 /nfs/dbraw/zinc/30/16/82/387301682.db2.gz JINWQIJFSXNTHT-SNVBAGLBSA-N 1 1 243.297 3.691 20 0 BHADMO CCC[N@@H+](C)[C@H](CC)c1ccc(F)cc1 ZINC000532939434 387302014 /nfs/dbraw/zinc/30/20/14/387302014.db2.gz NIOGHWVMUYNHFG-CYBMUJFWSA-N 1 1 209.308 3.619 20 0 BHADMO CCC[N@@H+](C)[C@@H](CC)c1ccc(F)cc1 ZINC000532939435 387301258 /nfs/dbraw/zinc/30/12/58/387301258.db2.gz NIOGHWVMUYNHFG-ZDUSSCGKSA-N 1 1 209.308 3.619 20 0 BHADMO CCCOc1ccc(C[N@@H+](C)CC2CCC2)cc1 ZINC000532941723 387585574 /nfs/dbraw/zinc/58/55/74/387585574.db2.gz AJNTVEVINZXWAJ-UHFFFAOYSA-N 1 1 247.382 3.707 20 0 BHADMO C[N@H+](Cc1ccc(Cl)c(F)c1)CC1CCC1 ZINC000532942811 387583092 /nfs/dbraw/zinc/58/30/92/387583092.db2.gz MMOLESOPJBYUAF-UHFFFAOYSA-N 1 1 241.737 3.711 20 0 BHADMO CCCCC[N@@H+](Cc1ccno1)[C@H](C)CCC ZINC000532948505 387914120 /nfs/dbraw/zinc/91/41/20/387914120.db2.gz GZACCLIOJJRDDM-CYBMUJFWSA-N 1 1 238.375 3.855 20 0 BHADMO CCCCC[N@@H+](Cc1ccno1)[C@@H](C)CCC ZINC000532948506 387914059 /nfs/dbraw/zinc/91/40/59/387914059.db2.gz GZACCLIOJJRDDM-ZDUSSCGKSA-N 1 1 238.375 3.855 20 0 BHADMO C[C@H](c1cccc(F)c1)[N@@H+](C)CC(C)(C)C ZINC000532956489 387914089 /nfs/dbraw/zinc/91/40/89/387914089.db2.gz ROSWHFRKEXOKRF-LLVKDONJSA-N 1 1 223.335 3.865 20 0 BHADMO C[C@@H](c1cccc(F)c1)[N@@H+](C)CC(C)(C)C ZINC000532956491 387912883 /nfs/dbraw/zinc/91/28/83/387912883.db2.gz ROSWHFRKEXOKRF-NSHDSACASA-N 1 1 223.335 3.865 20 0 BHADMO c1ccc(CC[N@@H+](C2CC2)C2CCCC2)cc1 ZINC000532959270 387913684 /nfs/dbraw/zinc/91/36/84/387913684.db2.gz AYCPMWKHHBRLTK-UHFFFAOYSA-N 1 1 229.367 3.636 20 0 BHADMO CC(C)[C@H]1CCC[N@H+]([C@H](C)c2cccnc2)CC1 ZINC000532960078 387913985 /nfs/dbraw/zinc/91/39/85/387913985.db2.gz SGFJIJRUGWKDSL-CABCVRRESA-N 1 1 246.398 3.901 20 0 BHADMO CC(C)[C@H]1CCC[N@H+]([C@@H](C)c2cccnc2)CC1 ZINC000532960087 387913942 /nfs/dbraw/zinc/91/39/42/387913942.db2.gz SGFJIJRUGWKDSL-GJZGRUSLSA-N 1 1 246.398 3.901 20 0 BHADMO CC(C)[C@@H]1CCC[N@H+]([C@H](C)c2cccnc2)CC1 ZINC000532960088 387913791 /nfs/dbraw/zinc/91/37/91/387913791.db2.gz SGFJIJRUGWKDSL-HUUCEWRRSA-N 1 1 246.398 3.901 20 0 BHADMO CC(C)[C@@H]1CCC[N@H+]([C@@H](C)c2cccnc2)CC1 ZINC000532960089 387913121 /nfs/dbraw/zinc/91/31/21/387913121.db2.gz SGFJIJRUGWKDSL-LSDHHAIUSA-N 1 1 246.398 3.901 20 0 BHADMO CC(C)[C@H]1CCC[N@H+]([C@H](C)c2ccccn2)CC1 ZINC000532960462 387910719 /nfs/dbraw/zinc/91/07/19/387910719.db2.gz QMBFLOUEEIIUOR-CABCVRRESA-N 1 1 246.398 3.901 20 0 BHADMO CC(C)[C@H]1CCC[N@H+]([C@@H](C)c2ccccn2)CC1 ZINC000532960463 387911814 /nfs/dbraw/zinc/91/18/14/387911814.db2.gz QMBFLOUEEIIUOR-GJZGRUSLSA-N 1 1 246.398 3.901 20 0 BHADMO CC(C)[C@@H]1CCC[N@H+]([C@H](C)c2ccccn2)CC1 ZINC000532960464 387910860 /nfs/dbraw/zinc/91/08/60/387910860.db2.gz QMBFLOUEEIIUOR-HUUCEWRRSA-N 1 1 246.398 3.901 20 0 BHADMO CC(C)[C@@H]1CCC[N@H+]([C@@H](C)c2ccccn2)CC1 ZINC000532960465 387913112 /nfs/dbraw/zinc/91/31/12/387913112.db2.gz QMBFLOUEEIIUOR-LSDHHAIUSA-N 1 1 246.398 3.901 20 0 BHADMO CC[C@@H](C)[C@H]1CCCC[N@H+]1CCc1cccnc1 ZINC000532967963 387915771 /nfs/dbraw/zinc/91/57/71/387915771.db2.gz MJTRBCHCXMHCOS-GDBMZVCRSA-N 1 1 246.398 3.525 20 0 BHADMO CC[C@H](C)[C@H]1CCCC[N@H+]1CCc1cccnc1 ZINC000532967964 387915889 /nfs/dbraw/zinc/91/58/89/387915889.db2.gz MJTRBCHCXMHCOS-GOEBONIOSA-N 1 1 246.398 3.525 20 0 BHADMO CC[C@H](C)[C@@H]1CCCC[N@H+]1CCc1cccnc1 ZINC000532967965 387915485 /nfs/dbraw/zinc/91/54/85/387915485.db2.gz MJTRBCHCXMHCOS-HOCLYGCPSA-N 1 1 246.398 3.525 20 0 BHADMO CC[C@@H](C)[C@@H]1CCCC[N@H+]1CCc1cccnc1 ZINC000532967966 387916292 /nfs/dbraw/zinc/91/62/92/387916292.db2.gz MJTRBCHCXMHCOS-ZBFHGGJFSA-N 1 1 246.398 3.525 20 0 BHADMO CC(C)[C@@H](c1ccccc1)[N@@H+](C)Cc1ccno1 ZINC000532975458 387915905 /nfs/dbraw/zinc/91/59/05/387915905.db2.gz OJPSEIGXDBVAMW-HNNXBMFYSA-N 1 1 244.338 3.504 20 0 BHADMO CC(C)[C@H](c1ccccc1)[N@@H+](C)Cc1ccno1 ZINC000532975460 387915047 /nfs/dbraw/zinc/91/50/47/387915047.db2.gz OJPSEIGXDBVAMW-OAHLLOKOSA-N 1 1 244.338 3.504 20 0 BHADMO CC[N@@H+](Cc1nc2ccccc2s1)C1CCC1 ZINC000532977125 387914977 /nfs/dbraw/zinc/91/49/77/387914977.db2.gz TZXWKBMLYLODJW-UHFFFAOYSA-N 1 1 246.379 3.671 20 0 BHADMO CCC(CC)n1ccc(C[N@@H+](C)C2CCCC2)n1 ZINC000533003169 387921126 /nfs/dbraw/zinc/92/11/26/387921126.db2.gz ZKSSSWRGCHUDJQ-UHFFFAOYSA-N 1 1 249.402 3.619 20 0 BHADMO Cn1cccc1[C@@H]1CCC[N@H+]1CCC(C)(C)C ZINC000533012156 387917362 /nfs/dbraw/zinc/91/73/62/387917362.db2.gz FMKNCHMTWYLSBE-AWEZNQCLSA-N 1 1 234.387 3.598 20 0 BHADMO Cn1cccc1[C@H]1CCC[N@H+]1CCC(C)(C)C ZINC000533012157 387917403 /nfs/dbraw/zinc/91/74/03/387917403.db2.gz FMKNCHMTWYLSBE-CQSZACIVSA-N 1 1 234.387 3.598 20 0 BHADMO c1cc(C[N@@H+]2CCC[C@H]2CCC2CCCC2)on1 ZINC000533025045 387919606 /nfs/dbraw/zinc/91/96/06/387919606.db2.gz ZHGOONOFNPNECI-AWEZNQCLSA-N 1 1 248.370 3.609 20 0 BHADMO c1cc(C[N@@H+]2CCC[C@@H]2CCC2CCCC2)on1 ZINC000533025046 387919846 /nfs/dbraw/zinc/91/98/46/387919846.db2.gz ZHGOONOFNPNECI-CQSZACIVSA-N 1 1 248.370 3.609 20 0 BHADMO Cc1cccc(C)c1C[N@@H+](C)CCC(F)(F)F ZINC000533033599 387918500 /nfs/dbraw/zinc/91/85/00/387918500.db2.gz AGXBHUMRNCTJRJ-UHFFFAOYSA-N 1 1 245.288 3.688 20 0 BHADMO C[C@H](c1cccc(F)c1)[N@@H+](C)CCC(F)(F)F ZINC000533034621 387925386 /nfs/dbraw/zinc/92/53/86/387925386.db2.gz XCRYFMVSDOXLJP-SECBINFHSA-N 1 1 249.251 3.771 20 0 BHADMO C[C@@H](c1cccc(F)c1)[N@@H+](C)CCC(F)(F)F ZINC000533034622 387925096 /nfs/dbraw/zinc/92/50/96/387925096.db2.gz XCRYFMVSDOXLJP-VIFPVBQESA-N 1 1 249.251 3.771 20 0 BHADMO CC(C)[N@H+](Cc1ccc(F)cc1F)CC1CC1 ZINC000533034678 387923939 /nfs/dbraw/zinc/92/39/39/387923939.db2.gz HAHQIEXCYIIUGG-UHFFFAOYSA-N 1 1 239.309 3.585 20 0 BHADMO CC(C)[N@H+](Cc1ccccc1Cl)CC1CC1 ZINC000533035223 387925771 /nfs/dbraw/zinc/92/57/71/387925771.db2.gz XDQLNOYSGCYZNC-UHFFFAOYSA-N 1 1 237.774 3.960 20 0 BHADMO CC(C)[N@@H+](CCCOc1ccccc1)CC1CC1 ZINC000533036796 387925278 /nfs/dbraw/zinc/92/52/78/387925278.db2.gz KQDNBHWDTKTQGM-UHFFFAOYSA-N 1 1 247.382 3.576 20 0 BHADMO CC(C)[N@@H+](C/C=C/c1ccccc1)CC1CC1 ZINC000533037160 387924201 /nfs/dbraw/zinc/92/42/01/387924201.db2.gz WEHHKYXXPDTUCH-RMKNXTFCSA-N 1 1 229.367 3.820 20 0 BHADMO CC(C)[N@@H+](C/C=C\c1ccccc1)CC1CC1 ZINC000533037162 387924151 /nfs/dbraw/zinc/92/41/51/387924151.db2.gz WEHHKYXXPDTUCH-TWGQIWQCSA-N 1 1 229.367 3.820 20 0 BHADMO Cc1cccc(C[N@H+](CC2CC2)C(C)C)c1 ZINC000533037178 387924483 /nfs/dbraw/zinc/92/44/83/387924483.db2.gz ZAYSZICKJNGNFX-UHFFFAOYSA-N 1 1 217.356 3.615 20 0 BHADMO CC(C)[N@@H+](C1CCCC1)[C@@H]1C=CCCC1 ZINC000533045747 387927401 /nfs/dbraw/zinc/92/74/01/387927401.db2.gz OHNKXKKJRCINTD-CYBMUJFWSA-N 1 1 207.361 3.748 20 0 BHADMO CC(C)[N@@H+](C1CCCC1)[C@H]1C=CCCC1 ZINC000533045748 387927044 /nfs/dbraw/zinc/92/70/44/387927044.db2.gz OHNKXKKJRCINTD-ZDUSSCGKSA-N 1 1 207.361 3.748 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1ccc(Cl)cc1 ZINC000533046186 387927444 /nfs/dbraw/zinc/92/74/44/387927444.db2.gz FCKTZGKHECTSEZ-JTQLQIEISA-N 1 1 211.736 3.570 20 0 BHADMO CC[C@@H](C)[N@@H+](C)Cc1ccc(Cl)cc1 ZINC000533046187 387927232 /nfs/dbraw/zinc/92/72/32/387927232.db2.gz FCKTZGKHECTSEZ-SNVBAGLBSA-N 1 1 211.736 3.570 20 0 BHADMO CC(C)[N@@H+](C[C@@H]1CCCCO1)C1CCCCC1 ZINC000533048559 387926289 /nfs/dbraw/zinc/92/62/89/387926289.db2.gz KTRGZIAWOVVHSG-HNNXBMFYSA-N 1 1 239.403 3.599 20 0 BHADMO CC(C)[N@@H+](C[C@H]1CCCCO1)C1CCCCC1 ZINC000533048565 387926649 /nfs/dbraw/zinc/92/66/49/387926649.db2.gz KTRGZIAWOVVHSG-OAHLLOKOSA-N 1 1 239.403 3.599 20 0 BHADMO CCC[C@@H]1[C@H](C)CCC[N@H+]1CCC(F)(F)F ZINC000533067864 387926869 /nfs/dbraw/zinc/92/68/69/387926869.db2.gz YKTVOOMRQWDAJA-GHMZBOCLSA-N 1 1 237.309 3.839 20 0 BHADMO CCC[C@H]1[C@H](C)CCC[N@H+]1CCC(F)(F)F ZINC000533067865 387926700 /nfs/dbraw/zinc/92/67/00/387926700.db2.gz YKTVOOMRQWDAJA-MNOVXSKESA-N 1 1 237.309 3.839 20 0 BHADMO CCC[C@H]1[C@@H](C)CCC[N@H+]1CCC(F)(F)F ZINC000533067866 387927435 /nfs/dbraw/zinc/92/74/35/387927435.db2.gz YKTVOOMRQWDAJA-QWRGUYRKSA-N 1 1 237.309 3.839 20 0 BHADMO CCC[C@@H]1[C@@H](C)CCC[N@H+]1CCC(F)(F)F ZINC000533067867 387927560 /nfs/dbraw/zinc/92/75/60/387927560.db2.gz YKTVOOMRQWDAJA-WDEREUQCSA-N 1 1 237.309 3.839 20 0 BHADMO C[C@H](c1ccco1)[N@@H+](CC1CCCC1)C1CC1 ZINC000533068513 387928240 /nfs/dbraw/zinc/92/82/40/387928240.db2.gz IIKPHOPQOGFMFW-GFCCVEGCSA-N 1 1 233.355 3.995 20 0 BHADMO C[C@@H](c1ccco1)[N@@H+](CC1CCCC1)C1CC1 ZINC000533068514 387929112 /nfs/dbraw/zinc/92/91/12/387929112.db2.gz IIKPHOPQOGFMFW-LBPRGKRZSA-N 1 1 233.355 3.995 20 0 BHADMO CC(C)[N@@H+](CCCOc1ccccc1)C1CCC1 ZINC000533071098 387928488 /nfs/dbraw/zinc/92/84/88/387928488.db2.gz ZNOGWKBQVNTQIU-UHFFFAOYSA-N 1 1 247.382 3.718 20 0 BHADMO COc1ccc(CC[N@@H+](C(C)C)C2CCC2)cc1 ZINC000533072379 387928754 /nfs/dbraw/zinc/92/87/54/387928754.db2.gz KVHIWDMWLSSDIL-UHFFFAOYSA-N 1 1 247.382 3.501 20 0 BHADMO COc1ccc(C)cc1C[N@@H+](C(C)C)C1CCC1 ZINC000533073936 398174513 /nfs/dbraw/zinc/17/45/13/398174513.db2.gz VVOGFESQUBSBFV-UHFFFAOYSA-N 1 1 247.382 3.767 20 0 BHADMO COCc1cccc(C[N@@H+](C)[C@H](C)C(C)(C)C)c1 ZINC000533079464 387939699 /nfs/dbraw/zinc/93/96/99/387939699.db2.gz GLKLSRHUEHVRMY-CYBMUJFWSA-N 1 1 249.398 3.699 20 0 BHADMO COCc1cccc(C[N@@H+](C)[C@@H](C)C(C)(C)C)c1 ZINC000533079465 387939676 /nfs/dbraw/zinc/93/96/76/387939676.db2.gz GLKLSRHUEHVRMY-ZDUSSCGKSA-N 1 1 249.398 3.699 20 0 BHADMO Cc1ccc(C)c(C[N@@H+](C)CCC2CC2)c1 ZINC000533080166 411246872 /nfs/dbraw/zinc/24/68/72/411246872.db2.gz OHMXUVKMWZTPGY-UHFFFAOYSA-N 1 1 217.356 3.535 20 0 BHADMO C[C@@H](CCc1ccccc1)[N@@H+](C)CCC1CC1 ZINC000533080598 411246857 /nfs/dbraw/zinc/24/68/57/411246857.db2.gz ZRMBCPFUBQPLFZ-AWEZNQCLSA-N 1 1 231.383 3.740 20 0 BHADMO C[C@H](CCc1ccccc1)[N@@H+](C)CCC1CC1 ZINC000533080599 411246688 /nfs/dbraw/zinc/24/66/88/411246688.db2.gz ZRMBCPFUBQPLFZ-CQSZACIVSA-N 1 1 231.383 3.740 20 0 BHADMO C[C@@H]([N@@H+](C)Cc1cccc(F)c1)C(C)(C)C ZINC000533249417 388038359 /nfs/dbraw/zinc/03/83/59/388038359.db2.gz RLIACTBGBHWIPK-LLVKDONJSA-N 1 1 223.335 3.692 20 0 BHADMO C[C@H]([N@@H+](C)Cc1cccc(F)c1)C(C)(C)C ZINC000533249418 388038597 /nfs/dbraw/zinc/03/85/97/388038597.db2.gz RLIACTBGBHWIPK-NSHDSACASA-N 1 1 223.335 3.692 20 0 BHADMO C[C@@H]([N@@H+](C)Cc1nc2ccccc2o1)C(C)(C)C ZINC000533249758 388039535 /nfs/dbraw/zinc/03/95/35/388039535.db2.gz SKRMSOZFKLGRDX-LLVKDONJSA-N 1 1 246.354 3.694 20 0 BHADMO C[C@H]([N@@H+](C)Cc1nc2ccccc2o1)C(C)(C)C ZINC000533249759 388038256 /nfs/dbraw/zinc/03/82/56/388038256.db2.gz SKRMSOZFKLGRDX-NSHDSACASA-N 1 1 246.354 3.694 20 0 BHADMO COCCC[N@@H+](C)[C@@H](C)c1c(C)cc(C)cc1C ZINC000533249794 388039530 /nfs/dbraw/zinc/03/95/30/388039530.db2.gz XTODAIVQLAWZBE-HNNXBMFYSA-N 1 1 249.398 3.641 20 0 BHADMO COCCC[N@@H+](C)[C@H](C)c1c(C)cc(C)cc1C ZINC000533249795 388038157 /nfs/dbraw/zinc/03/81/57/388038157.db2.gz XTODAIVQLAWZBE-OAHLLOKOSA-N 1 1 249.398 3.641 20 0 BHADMO C[C@H]([N@@H+](C)Cc1cccc(F)c1F)C(C)(C)C ZINC000533249841 388039264 /nfs/dbraw/zinc/03/92/64/388039264.db2.gz ARYPPRURYLMEKI-JTQLQIEISA-N 1 1 241.325 3.831 20 0 BHADMO C[C@@H]([N@@H+](C)Cc1cccc(F)c1F)C(C)(C)C ZINC000533249842 388038790 /nfs/dbraw/zinc/03/87/90/388038790.db2.gz ARYPPRURYLMEKI-SNVBAGLBSA-N 1 1 241.325 3.831 20 0 BHADMO CCC[N@@H+](CC)Cc1ccc(CC)s1 ZINC000533255561 388035231 /nfs/dbraw/zinc/03/52/31/388035231.db2.gz VZRAGLAEDKFSJW-UHFFFAOYSA-N 1 1 211.374 3.542 20 0 BHADMO Cc1cccc([C@@H](C)[N@H+](C)CC(C)C)c1 ZINC000533256307 388037189 /nfs/dbraw/zinc/03/71/89/388037189.db2.gz RTRHUDRVPDGRCY-CYBMUJFWSA-N 1 1 205.345 3.644 20 0 BHADMO Cc1cccc([C@H](C)[N@H+](C)CC(C)C)c1 ZINC000533256320 388037724 /nfs/dbraw/zinc/03/77/24/388037724.db2.gz RTRHUDRVPDGRCY-ZDUSSCGKSA-N 1 1 205.345 3.644 20 0 BHADMO CC[C@@H](c1ccc(F)cc1)[N@@H+](C)CC(C)C ZINC000533256486 388037754 /nfs/dbraw/zinc/03/77/54/388037754.db2.gz DSSJFTGQKZKPHO-AWEZNQCLSA-N 1 1 223.335 3.865 20 0 BHADMO CC[C@H](c1ccc(F)cc1)[N@@H+](C)CC(C)C ZINC000533256487 388036648 /nfs/dbraw/zinc/03/66/48/388036648.db2.gz DSSJFTGQKZKPHO-CQSZACIVSA-N 1 1 223.335 3.865 20 0 BHADMO c1cc(C[N@@H+]2CCC[C@H]2CC2CCCCC2)on1 ZINC000533256995 388036696 /nfs/dbraw/zinc/03/66/96/388036696.db2.gz LTDISPKBVAHTOY-AWEZNQCLSA-N 1 1 248.370 3.609 20 0 BHADMO c1cc(C[N@@H+]2CCC[C@@H]2CC2CCCCC2)on1 ZINC000533256996 388037762 /nfs/dbraw/zinc/03/77/62/388037762.db2.gz LTDISPKBVAHTOY-CQSZACIVSA-N 1 1 248.370 3.609 20 0 BHADMO CC(C)Oc1ccc(C[N@@H+](C)CC2CCC2)cc1 ZINC000533263210 388043355 /nfs/dbraw/zinc/04/33/55/388043355.db2.gz RUHQDJPDDNNKTG-UHFFFAOYSA-N 1 1 247.382 3.706 20 0 BHADMO CCC(CC)[N@@H+](Cc1nccn1C(C)C)C1CC1 ZINC000533267473 388045008 /nfs/dbraw/zinc/04/50/08/388045008.db2.gz YCFWTIGKNWGPSP-UHFFFAOYSA-N 1 1 249.402 3.617 20 0 BHADMO CC[C@@H](c1ccccc1)[N@@H+](C)CC1CCC1 ZINC000533302575 388047189 /nfs/dbraw/zinc/04/71/89/388047189.db2.gz LOMJFRGHFPXBSD-HNNXBMFYSA-N 1 1 217.356 3.870 20 0 BHADMO CC[C@H](c1ccccc1)[N@@H+](C)CC1CCC1 ZINC000533302579 388047797 /nfs/dbraw/zinc/04/77/97/388047797.db2.gz LOMJFRGHFPXBSD-OAHLLOKOSA-N 1 1 217.356 3.870 20 0 BHADMO Cn1cccc1[C@@H]1CCC[N@H+]1CCC1CCCC1 ZINC000533334718 359800629 /nfs/dbraw/zinc/80/06/29/359800629.db2.gz GJSDEYQYPBANJP-INIZCTEOSA-N 1 1 246.398 3.742 20 0 BHADMO Cn1cccc1[C@H]1CCC[N@H+]1CCC1CCCC1 ZINC000533334719 359800586 /nfs/dbraw/zinc/80/05/86/359800586.db2.gz GJSDEYQYPBANJP-MRXNPFEDSA-N 1 1 246.398 3.742 20 0 BHADMO COc1ccc(C)cc1C[N@@H+](CC1CC1)C(C)C ZINC000533352690 388061156 /nfs/dbraw/zinc/06/11/56/388061156.db2.gz HELIUUAGXPCGPJ-UHFFFAOYSA-N 1 1 247.382 3.624 20 0 BHADMO Cc1ccccc1C[N@H+](CC1CC1)C(C)C ZINC000533356840 388061715 /nfs/dbraw/zinc/06/17/15/388061715.db2.gz IVFOLPIXAQUWOS-UHFFFAOYSA-N 1 1 217.356 3.615 20 0 BHADMO CC(C)[N@H+](Cc1ccc(Cl)cc1)CC1CC1 ZINC000533358429 388062437 /nfs/dbraw/zinc/06/24/37/388062437.db2.gz LXVZVZHTTMQQAO-UHFFFAOYSA-N 1 1 237.774 3.960 20 0 BHADMO Cc1ccc(C[N@H+](CC2CC2)C(C)C)cc1 ZINC000533358616 388061766 /nfs/dbraw/zinc/06/17/66/388061766.db2.gz GBIVDVAVSUPIQP-UHFFFAOYSA-N 1 1 217.356 3.615 20 0 BHADMO CC(C)[N@H+](Cc1cc(F)ccc1F)CC1CC1 ZINC000533359004 388062098 /nfs/dbraw/zinc/06/20/98/388062098.db2.gz SPOBSZBWCJEFRC-UHFFFAOYSA-N 1 1 239.309 3.585 20 0 BHADMO CC[C@@H](C)[N@@H+](C)CCSc1ccccc1F ZINC000533368704 398188683 /nfs/dbraw/zinc/18/86/83/398188683.db2.gz QJSIXFRTSOHSQU-LLVKDONJSA-N 1 1 241.375 3.648 20 0 BHADMO CC[C@H](C)[N@@H+](C)CCSc1ccccc1F ZINC000533368705 398188712 /nfs/dbraw/zinc/18/87/12/398188712.db2.gz QJSIXFRTSOHSQU-NSHDSACASA-N 1 1 241.375 3.648 20 0 BHADMO CC(C)[N@@H+](CCOc1ccccc1)C1CCCC1 ZINC000533368722 398188568 /nfs/dbraw/zinc/18/85/68/398188568.db2.gz UQZBXXQEQYRMID-UHFFFAOYSA-N 1 1 247.382 3.718 20 0 BHADMO CC[C@@H](C)[N@@H+](C)Cc1c(C)cccc1C ZINC000533369181 388065693 /nfs/dbraw/zinc/06/56/93/388065693.db2.gz WBAXBQGYFWBLJB-CYBMUJFWSA-N 1 1 205.345 3.534 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1c(C)cccc1C ZINC000533369182 388065468 /nfs/dbraw/zinc/06/54/68/388065468.db2.gz WBAXBQGYFWBLJB-ZDUSSCGKSA-N 1 1 205.345 3.534 20 0 BHADMO CSCC[C@@H](C)[N@@H+](C)CC1CCCCC1 ZINC000533393073 384261261 /nfs/dbraw/zinc/26/12/61/384261261.db2.gz CBIBXBZZDQXYKI-GFCCVEGCSA-N 1 1 229.433 3.640 20 0 BHADMO CSCC[C@H](C)[N@@H+](C)CC1CCCCC1 ZINC000533393074 384263065 /nfs/dbraw/zinc/26/30/65/384263065.db2.gz CBIBXBZZDQXYKI-LBPRGKRZSA-N 1 1 229.433 3.640 20 0 BHADMO CC(C)[N@@H+](CCC1CCCC1)C1CCC1 ZINC000533393502 384261899 /nfs/dbraw/zinc/26/18/99/384261899.db2.gz BDJIGXLUFGKWRP-UHFFFAOYSA-N 1 1 209.377 3.830 20 0 BHADMO Cc1ccc(CC[N@H+](C)CC(C)(C)C)cc1 ZINC000533415698 384284336 /nfs/dbraw/zinc/28/43/36/384284336.db2.gz NREOQSMWFNRCFX-UHFFFAOYSA-N 1 1 219.372 3.515 20 0 BHADMO C[C@H](c1ccccc1F)[N@@H+](C)CC(C)(C)C ZINC000533416212 384283668 /nfs/dbraw/zinc/28/36/68/384283668.db2.gz OQNLFVXLFUIWCX-LLVKDONJSA-N 1 1 223.335 3.865 20 0 BHADMO C[C@@H](c1ccccc1F)[N@@H+](C)CC(C)(C)C ZINC000533416221 384282812 /nfs/dbraw/zinc/28/28/12/384282812.db2.gz OQNLFVXLFUIWCX-NSHDSACASA-N 1 1 223.335 3.865 20 0 BHADMO C[C@@H]1C[C@@H](C)[N@@H+](Cc2nc3ccccc3s2)C1 ZINC000533433183 384311212 /nfs/dbraw/zinc/31/12/12/384311212.db2.gz MWIQFXDLLLDXOK-GHMZBOCLSA-N 1 1 246.379 3.527 20 0 BHADMO C[C@@H]1C[C@H](C)[N@@H+](Cc2nc3ccccc3s2)C1 ZINC000533433186 384310361 /nfs/dbraw/zinc/31/03/61/384310361.db2.gz MWIQFXDLLLDXOK-MNOVXSKESA-N 1 1 246.379 3.527 20 0 BHADMO C[C@H]1C[C@H](C)[N@@H+](Cc2nc3ccccc3s2)C1 ZINC000533433188 384309216 /nfs/dbraw/zinc/30/92/16/384309216.db2.gz MWIQFXDLLLDXOK-QWRGUYRKSA-N 1 1 246.379 3.527 20 0 BHADMO C[C@@H]1C[C@H](C)C[N@@H+]1Cc1nc2ccccc2s1 ZINC000533433189 384309489 /nfs/dbraw/zinc/30/94/89/384309489.db2.gz MWIQFXDLLLDXOK-WDEREUQCSA-N 1 1 246.379 3.527 20 0 BHADMO CC(C)[N@@H+](CCC1CCCC1)CC1CC1 ZINC000533488397 384368975 /nfs/dbraw/zinc/36/89/75/384368975.db2.gz BJIJWMZZLBHRCP-UHFFFAOYSA-N 1 1 209.377 3.687 20 0 BHADMO CC(C)[N@H+](Cc1cccc(F)c1F)CC1CC1 ZINC000533488577 384367887 /nfs/dbraw/zinc/36/78/87/384367887.db2.gz ZMYQGKSWTLEUBZ-UHFFFAOYSA-N 1 1 239.309 3.585 20 0 BHADMO CC(C)[N@H+](Cc1ccc(F)c(F)c1)CC1CC1 ZINC000533493849 384380039 /nfs/dbraw/zinc/38/00/39/384380039.db2.gz BMFBDYUGXJCSHK-UHFFFAOYSA-N 1 1 239.309 3.585 20 0 BHADMO Cc1cc(C[N@H+](CC2CC2)C(C)C)c(C)s1 ZINC000533493963 384380063 /nfs/dbraw/zinc/38/00/63/384380063.db2.gz CLIBJEOLXFEFFV-UHFFFAOYSA-N 1 1 237.412 3.985 20 0 BHADMO Cc1ccc(CC[N@@H+](CC2CC2)C(C)C)cc1 ZINC000533494755 384381138 /nfs/dbraw/zinc/38/11/38/384381138.db2.gz HNYXJNPARVFKBB-UHFFFAOYSA-N 1 1 231.383 3.658 20 0 BHADMO CC(C)[N@@H+](CCCc1ccccc1)CC1CC1 ZINC000533494841 384385102 /nfs/dbraw/zinc/38/51/02/384385102.db2.gz MDWCGXWKYOVOQI-UHFFFAOYSA-N 1 1 231.383 3.740 20 0 BHADMO CC[C@@H](C)[N@@H+](C)Cc1ccccc1OC(C)C ZINC000533504467 384396503 /nfs/dbraw/zinc/39/65/03/384396503.db2.gz HEOMOKRVKWGRSZ-CYBMUJFWSA-N 1 1 235.371 3.704 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1ccccc1OC(C)C ZINC000533504469 384397107 /nfs/dbraw/zinc/39/71/07/384397107.db2.gz HEOMOKRVKWGRSZ-ZDUSSCGKSA-N 1 1 235.371 3.704 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1ccccc1Cl ZINC000533504831 384397465 /nfs/dbraw/zinc/39/74/65/384397465.db2.gz AXOIBQRYMDBUTF-JTQLQIEISA-N 1 1 211.736 3.570 20 0 BHADMO CC[C@@H](C)[N@@H+](C)Cc1ccccc1Cl ZINC000533504835 384396757 /nfs/dbraw/zinc/39/67/57/384396757.db2.gz AXOIBQRYMDBUTF-SNVBAGLBSA-N 1 1 211.736 3.570 20 0 BHADMO CC[C@H](C)[N@@H+](C)CCc1c(F)cccc1Cl ZINC000533505904 384401212 /nfs/dbraw/zinc/40/12/12/384401212.db2.gz PCJXPPVDJMPYQC-JTQLQIEISA-N 1 1 243.753 3.752 20 0 BHADMO CC[C@@H](C)[N@@H+](C)CCc1c(F)cccc1Cl ZINC000533505905 384401170 /nfs/dbraw/zinc/40/11/70/384401170.db2.gz PCJXPPVDJMPYQC-SNVBAGLBSA-N 1 1 243.753 3.752 20 0 BHADMO CC(C)[N@@H+](CC1CCCC1)C1CCCC1 ZINC000533506002 384397371 /nfs/dbraw/zinc/39/73/71/384397371.db2.gz ZLPHJOGAFMRKLB-UHFFFAOYSA-N 1 1 209.377 3.830 20 0 BHADMO CSCC[C@@H](C)[N@@H+](C)C/C=C\c1ccccc1 ZINC000533529471 384479976 /nfs/dbraw/zinc/47/99/76/384479976.db2.gz JPNOXWVFJUHVFE-JKEYDSJLSA-N 1 1 249.423 3.773 20 0 BHADMO CSCC[C@H](C)[N@@H+](C)C/C=C\c1ccccc1 ZINC000533529472 384479392 /nfs/dbraw/zinc/47/93/92/384479392.db2.gz JPNOXWVFJUHVFE-YHAOYDPOSA-N 1 1 249.423 3.773 20 0 BHADMO Cc1ccc(C[N@H+](C(C)C)C2CCC2)cc1 ZINC000533529656 384482672 /nfs/dbraw/zinc/48/26/72/384482672.db2.gz CGEFLNAJKMYGLI-UHFFFAOYSA-N 1 1 217.356 3.758 20 0 BHADMO Cc1cccc(OCC[N@H+](C(C)C)C2CCC2)c1 ZINC000533532440 409667046 /nfs/dbraw/zinc/66/70/46/409667046.db2.gz GAMXLPIPTLUQPM-UHFFFAOYSA-N 1 1 247.382 3.637 20 0 BHADMO CS[C@H]1CCCC[N@@H+](Cc2ccccc2C)C1 ZINC000533538619 384519137 /nfs/dbraw/zinc/51/91/37/384519137.db2.gz XGUYZRWBUFVDKT-HNNXBMFYSA-N 1 1 249.423 3.713 20 0 BHADMO CS[C@@H]1CCCC[N@@H+](Cc2ccccc2C)C1 ZINC000533538620 384518121 /nfs/dbraw/zinc/51/81/21/384518121.db2.gz XGUYZRWBUFVDKT-OAHLLOKOSA-N 1 1 249.423 3.713 20 0 BHADMO CS[C@@H]1CCCC[N@H+]([C@@H](C)c2ccccc2)C1 ZINC000533538686 384518654 /nfs/dbraw/zinc/51/86/54/384518654.db2.gz JDRYFQKIUVYXKN-DZGCQCFKSA-N 1 1 249.423 3.965 20 0 BHADMO CS[C@H]1CCCC[N@H+]([C@H](C)c2ccccc2)C1 ZINC000533538687 384520272 /nfs/dbraw/zinc/52/02/72/384520272.db2.gz JDRYFQKIUVYXKN-HIFRSBDPSA-N 1 1 249.423 3.965 20 0 BHADMO CS[C@@H]1CCCC[N@H+]([C@H](C)c2ccccc2)C1 ZINC000533538688 384518935 /nfs/dbraw/zinc/51/89/35/384518935.db2.gz JDRYFQKIUVYXKN-UKRRQHHQSA-N 1 1 249.423 3.965 20 0 BHADMO CS[C@H]1CCCC[N@H+]([C@@H](C)c2ccccc2)C1 ZINC000533538689 384518224 /nfs/dbraw/zinc/51/82/24/384518224.db2.gz JDRYFQKIUVYXKN-ZFWWWQNUSA-N 1 1 249.423 3.965 20 0 BHADMO CC(C)Oc1ccccc1C[N@@H+](C)CCC1CC1 ZINC000533539160 384519928 /nfs/dbraw/zinc/51/99/28/384519928.db2.gz CHZPFTWZIAQOHO-UHFFFAOYSA-N 1 1 247.382 3.706 20 0 BHADMO Cc1cccc(C)c1C[N@@H+](C)CCC1CC1 ZINC000533539656 384524713 /nfs/dbraw/zinc/52/47/13/384524713.db2.gz AETNOKXPPGNXFR-UHFFFAOYSA-N 1 1 217.356 3.535 20 0 BHADMO CCC(C)(C)[C@@H]1CCC[N@H+]1CCC(F)(F)F ZINC000533545886 384531491 /nfs/dbraw/zinc/53/14/91/384531491.db2.gz FIFIPAYMCAHLBS-JTQLQIEISA-N 1 1 237.309 3.839 20 0 BHADMO CCC(C)(C)[C@H]1CCC[N@H+]1CCC(F)(F)F ZINC000533545888 384530788 /nfs/dbraw/zinc/53/07/88/384530788.db2.gz FIFIPAYMCAHLBS-SNVBAGLBSA-N 1 1 237.309 3.839 20 0 BHADMO CC(C)[N@@H+](CCCCC(F)(F)F)CC1CC1 ZINC000533558397 384567325 /nfs/dbraw/zinc/56/73/25/384567325.db2.gz MBHMAKJIZXFADC-UHFFFAOYSA-N 1 1 237.309 3.839 20 0 BHADMO Cc1nc(C[N@H+](C)[C@@H](C)C(C)(C)C)c(C)s1 ZINC000533558544 384566470 /nfs/dbraw/zinc/56/64/70/384566470.db2.gz DQSKOXXTBULSRQ-JTQLQIEISA-N 1 1 240.416 3.626 20 0 BHADMO Cc1nc(C[N@H+](C)[C@H](C)C(C)(C)C)c(C)s1 ZINC000533558545 384565697 /nfs/dbraw/zinc/56/56/97/384565697.db2.gz DQSKOXXTBULSRQ-SNVBAGLBSA-N 1 1 240.416 3.626 20 0 BHADMO CC1=CC[N@@H+](CCc2ccccc2Cl)CC1 ZINC000533760625 384181061 /nfs/dbraw/zinc/18/10/61/384181061.db2.gz HSNNMOJZQXZVJU-UHFFFAOYSA-N 1 1 235.758 3.535 20 0 BHADMO CC1=CC[N@H+]([C@H]2CCCc3ccc(F)cc32)CC1 ZINC000533760722 384180197 /nfs/dbraw/zinc/18/01/97/384180197.db2.gz GPOKCUJIOVERGY-INIZCTEOSA-N 1 1 245.341 3.855 20 0 BHADMO CC1=CC[N@H+]([C@@H]2CCCc3ccc(F)cc32)CC1 ZINC000533760743 384179427 /nfs/dbraw/zinc/17/94/27/384179427.db2.gz GPOKCUJIOVERGY-MRXNPFEDSA-N 1 1 245.341 3.855 20 0 BHADMO CC1=CC[N@@H+]([C@H](C)c2ccc(F)cc2)CC1 ZINC000533762600 384182190 /nfs/dbraw/zinc/18/21/90/384182190.db2.gz QVPGNKVEESUHGX-GFCCVEGCSA-N 1 1 219.303 3.539 20 0 BHADMO CC1=CC[N@@H+]([C@@H](C)c2ccc(F)cc2)CC1 ZINC000533762605 384182852 /nfs/dbraw/zinc/18/28/52/384182852.db2.gz QVPGNKVEESUHGX-LBPRGKRZSA-N 1 1 219.303 3.539 20 0 BHADMO CC(C)=CC[N@H+](C)Cc1cccc(OC(C)C)c1 ZINC000533768743 384188416 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3.848 20 0 BHADMO CC(C)Oc1ccc(C[N@H+]2CCCC[C@H]2C)cc1 ZINC000536633694 323199095 /nfs/dbraw/zinc/19/90/95/323199095.db2.gz ZHNKOMWKGKKSFG-CQSZACIVSA-N 1 1 247.382 3.848 20 0 BHADMO CSc1ccc(C[N@@H+](C)[C@H](C)C(C)C)cc1 ZINC000536638515 323199246 /nfs/dbraw/zinc/19/92/46/323199246.db2.gz KJSSXFFHNYNIGF-GFCCVEGCSA-N 1 1 237.412 3.885 20 0 BHADMO CSc1ccc(C[N@@H+](C)[C@@H](C)C(C)C)cc1 ZINC000536638516 323199359 /nfs/dbraw/zinc/19/93/59/323199359.db2.gz KJSSXFFHNYNIGF-LBPRGKRZSA-N 1 1 237.412 3.885 20 0 BHADMO CC(C)[C@@H](C)[N@@H+](C)Cc1ccnc2ccccc12 ZINC000536638707 323199124 /nfs/dbraw/zinc/19/91/24/323199124.db2.gz VFSSZRMSFGJTKA-CYBMUJFWSA-N 1 1 242.366 3.711 20 0 BHADMO CC(C)[C@H](C)[N@@H+](C)Cc1ccnc2ccccc12 ZINC000536638708 323199218 /nfs/dbraw/zinc/19/92/18/323199218.db2.gz VFSSZRMSFGJTKA-ZDUSSCGKSA-N 1 1 242.366 3.711 20 0 BHADMO CC(C)[N@H+](Cc1cc(F)cc(F)c1)CC1CC1 ZINC000536639834 323199109 /nfs/dbraw/zinc/19/91/09/323199109.db2.gz QVDBIRHDROMDDZ-UHFFFAOYSA-N 1 1 239.309 3.585 20 0 BHADMO CCC[C@H](C)[N@@H+](C)Cc1c(F)cccc1F ZINC000536639909 323199283 /nfs/dbraw/zinc/19/92/83/323199283.db2.gz YUSNDNIRNXCJON-JTQLQIEISA-N 1 1 227.298 3.585 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)Cc1c(F)cccc1F ZINC000536639911 323199241 /nfs/dbraw/zinc/19/92/41/323199241.db2.gz YUSNDNIRNXCJON-SNVBAGLBSA-N 1 1 227.298 3.585 20 0 BHADMO Cc1cc(C[N@H+](CC2CC2)C(C)C)ccc1F ZINC000536639994 323199106 /nfs/dbraw/zinc/19/91/06/323199106.db2.gz HTAULBQNXGIGJK-UHFFFAOYSA-N 1 1 235.346 3.755 20 0 BHADMO C[N@@H+](Cc1ccnc2ccccc12)CC(C)(C)C ZINC000536648964 323199615 /nfs/dbraw/zinc/19/96/15/323199615.db2.gz JQWWELDLBVTQDC-UHFFFAOYSA-N 1 1 242.366 3.713 20 0 BHADMO C[N@@H+](Cc1ccnc2ccccc12)C1CCCC1 ZINC000536649917 323199632 /nfs/dbraw/zinc/19/96/32/323199632.db2.gz ZDJYYOLUYRQCOO-UHFFFAOYSA-N 1 1 240.350 3.609 20 0 BHADMO CCc1ccc(C[N@@H+](C)C(C2CC2)C2CC2)s1 ZINC000536653681 323199645 /nfs/dbraw/zinc/19/96/45/323199645.db2.gz KHWJRNGYPCLTJD-UHFFFAOYSA-N 1 1 249.423 3.931 20 0 BHADMO CCCOc1ccc(C[N@@H+](C)CC(C)C)cc1 ZINC000536653875 323199562 /nfs/dbraw/zinc/19/95/62/323199562.db2.gz RSUNIGPYGMTBLE-UHFFFAOYSA-N 1 1 235.371 3.563 20 0 BHADMO Cc1ccsc1C[N@H+](C)[C@H](C)C(C)(C)C ZINC000536655563 323199932 /nfs/dbraw/zinc/19/99/32/323199932.db2.gz FLQGSPMOVZHNPQ-LLVKDONJSA-N 1 1 225.401 3.923 20 0 BHADMO Cc1ccsc1C[N@H+](C)[C@@H](C)C(C)(C)C ZINC000536655564 323199966 /nfs/dbraw/zinc/19/99/66/323199966.db2.gz FLQGSPMOVZHNPQ-NSHDSACASA-N 1 1 225.401 3.923 20 0 BHADMO C[C@H]([N@@H+](C)Cc1c(F)cccc1F)C(C)(C)C ZINC000536655807 323200072 /nfs/dbraw/zinc/20/00/72/323200072.db2.gz YRGCOXXVFSRNAC-JTQLQIEISA-N 1 1 241.325 3.831 20 0 BHADMO C[C@@H]([N@@H+](C)Cc1c(F)cccc1F)C(C)(C)C ZINC000536655808 323200002 /nfs/dbraw/zinc/20/00/02/323200002.db2.gz YRGCOXXVFSRNAC-SNVBAGLBSA-N 1 1 241.325 3.831 20 0 BHADMO CCc1ccc(C[N@@H+](C)[C@H](C)C(C)(C)C)o1 ZINC000536655934 323200075 /nfs/dbraw/zinc/20/00/75/323200075.db2.gz HJRABIGUTSEGRH-LLVKDONJSA-N 1 1 223.360 3.708 20 0 BHADMO CCc1ccc(C[N@@H+](C)[C@@H](C)C(C)(C)C)o1 ZINC000536655935 323200023 /nfs/dbraw/zinc/20/00/23/323200023.db2.gz HJRABIGUTSEGRH-NSHDSACASA-N 1 1 223.360 3.708 20 0 BHADMO Cc1nc(C)c(C[N@H+](C)[C@@H](C)C(C)(C)C)s1 ZINC000536655936 323199968 /nfs/dbraw/zinc/19/99/68/323199968.db2.gz IICDQUPUTCAKFP-JTQLQIEISA-N 1 1 240.416 3.626 20 0 BHADMO Cc1nc(C)c(C[N@H+](C)[C@H](C)C(C)(C)C)s1 ZINC000536655937 323199972 /nfs/dbraw/zinc/19/99/72/323199972.db2.gz IICDQUPUTCAKFP-SNVBAGLBSA-N 1 1 240.416 3.626 20 0 BHADMO C[C@H]([N@@H+](C)Cc1cc(F)cc(F)c1)C(C)(C)C ZINC000536655942 323200009 /nfs/dbraw/zinc/20/00/09/323200009.db2.gz KYGMVWJJGJZCHM-JTQLQIEISA-N 1 1 241.325 3.831 20 0 BHADMO C[C@@H]([N@@H+](C)Cc1cc(F)cc(F)c1)C(C)(C)C ZINC000536655943 323199937 /nfs/dbraw/zinc/19/99/37/323199937.db2.gz KYGMVWJJGJZCHM-SNVBAGLBSA-N 1 1 241.325 3.831 20 0 BHADMO COCc1ccc(C[N@@H+](C)[C@H](C)C(C)(C)C)cc1 ZINC000536655944 323199923 /nfs/dbraw/zinc/19/99/23/323199923.db2.gz MDLQUKKPCSULRP-CYBMUJFWSA-N 1 1 249.398 3.699 20 0 BHADMO COCc1ccc(C[N@@H+](C)[C@@H](C)C(C)(C)C)cc1 ZINC000536655946 323200067 /nfs/dbraw/zinc/20/00/67/323200067.db2.gz MDLQUKKPCSULRP-ZDUSSCGKSA-N 1 1 249.398 3.699 20 0 BHADMO CCc1ccc(C[N@@H+](C(C)C)C2CC2)s1 ZINC000536658596 323199852 /nfs/dbraw/zinc/19/98/52/323199852.db2.gz HDKXPNOQQUSAFQ-UHFFFAOYSA-N 1 1 223.385 3.683 20 0 BHADMO C[C@@H]1C[C@@H](C)[N@@H+](Cc2cc3cc(F)ccc3o2)C1 ZINC000536658891 323199876 /nfs/dbraw/zinc/19/98/76/323199876.db2.gz RTNHCEGCJSRYPR-GHMZBOCLSA-N 1 1 247.313 3.802 20 0 BHADMO C[C@@H]1C[C@H](C)[N@@H+](Cc2cc3cc(F)ccc3o2)C1 ZINC000536658892 323199808 /nfs/dbraw/zinc/19/98/08/323199808.db2.gz RTNHCEGCJSRYPR-MNOVXSKESA-N 1 1 247.313 3.802 20 0 BHADMO C[C@H]1C[C@H](C)[N@@H+](Cc2cc3cc(F)ccc3o2)C1 ZINC000536658893 323199770 /nfs/dbraw/zinc/19/97/70/323199770.db2.gz RTNHCEGCJSRYPR-QWRGUYRKSA-N 1 1 247.313 3.802 20 0 BHADMO C[C@@H]1C[C@H](C)C[N@@H+]1Cc1cc2cc(F)ccc2o1 ZINC000536658894 323199850 /nfs/dbraw/zinc/19/98/50/323199850.db2.gz RTNHCEGCJSRYPR-WDEREUQCSA-N 1 1 247.313 3.802 20 0 BHADMO CCCOc1ccc(C[N@@H+](CC)C2CCC2)cc1 ZINC000536659254 323199720 /nfs/dbraw/zinc/19/97/20/323199720.db2.gz RGKURLLBGWZMAD-UHFFFAOYSA-N 1 1 247.382 3.850 20 0 BHADMO C[C@@H]1C[C@H](C)[N@@H+](Cc2ccc(Cl)s2)C1 ZINC000536659349 323199706 /nfs/dbraw/zinc/19/97/06/323199706.db2.gz XZPUHQPHWJVTFD-BDAKNGLRSA-N 1 1 229.776 3.632 20 0 BHADMO C[C@@H]1C[C@H](C)C[N@@H+]1Cc1ccc(Cl)s1 ZINC000536659350 323199754 /nfs/dbraw/zinc/19/97/54/323199754.db2.gz XZPUHQPHWJVTFD-DTWKUNHWSA-N 1 1 229.776 3.632 20 0 BHADMO C[C@H]1C[C@H](C)[N@@H+](Cc2ccc(Cl)s2)C1 ZINC000536659351 323199898 /nfs/dbraw/zinc/19/98/98/323199898.db2.gz XZPUHQPHWJVTFD-IUCAKERBSA-N 1 1 229.776 3.632 20 0 BHADMO C[C@@H]1C[C@@H](C)[N@@H+](Cc2ccc(Cl)s2)C1 ZINC000536659352 323199824 /nfs/dbraw/zinc/19/98/24/323199824.db2.gz XZPUHQPHWJVTFD-RKDXNWHRSA-N 1 1 229.776 3.632 20 0 BHADMO CC[N@@H+](Cc1cc(C)ccc1C)C1CCC1 ZINC000536659712 323199767 /nfs/dbraw/zinc/19/97/67/323199767.db2.gz RZHWIGSOZCBHMV-UHFFFAOYSA-N 1 1 217.356 3.678 20 0 BHADMO CC[N@@H+](C/C(C)=C\c1ccccc1)C1CCC1 ZINC000536659886 323199722 /nfs/dbraw/zinc/19/97/22/323199722.db2.gz KMQMTYULYMNGSH-OWBHPGMISA-N 1 1 229.367 3.964 20 0 BHADMO CC[N@@H+](C/C(C)=C/c1ccccc1)C1CCC1 ZINC000536659887 323199790 /nfs/dbraw/zinc/19/97/90/323199790.db2.gz KMQMTYULYMNGSH-WYMLVPIESA-N 1 1 229.367 3.964 20 0 BHADMO CO[C@@H](C)C[N@@H+](Cc1ccc(C)cc1C)C(C)C ZINC000536659958 323199843 /nfs/dbraw/zinc/19/98/43/323199843.db2.gz PHZQMSYOEXVWMB-HNNXBMFYSA-N 1 1 249.398 3.549 20 0 BHADMO CO[C@H](C)C[N@@H+](Cc1ccc(C)cc1C)C(C)C ZINC000536659959 323199874 /nfs/dbraw/zinc/19/98/74/323199874.db2.gz PHZQMSYOEXVWMB-OAHLLOKOSA-N 1 1 249.398 3.549 20 0 BHADMO CC[N@@H+](Cc1ccc(C)cc1C)C1CCC1 ZINC000536661071 323199879 /nfs/dbraw/zinc/19/98/79/323199879.db2.gz WGDIHPDMSXXETH-UHFFFAOYSA-N 1 1 217.356 3.678 20 0 BHADMO Cc1cc(C[N@H+](C(C)C)C2CCC2)ccc1F ZINC000536661196 323199813 /nfs/dbraw/zinc/19/98/13/323199813.db2.gz MVWLOBVXPKWRRO-UHFFFAOYSA-N 1 1 235.346 3.897 20 0 BHADMO CC[N@@H+](C/C=C\c1ccc(F)cc1)C1CCC1 ZINC000536661423 323199811 /nfs/dbraw/zinc/19/98/11/323199811.db2.gz PCICZXQFJPRVKO-PLNGDYQASA-N 1 1 233.330 3.713 20 0 BHADMO CC[N@@H+](C/C=C/c1ccc(F)cc1)C1CCC1 ZINC000536661424 323199870 /nfs/dbraw/zinc/19/98/70/323199870.db2.gz PCICZXQFJPRVKO-SNAWJCMRSA-N 1 1 233.330 3.713 20 0 BHADMO Cc1ccc(C[N@H+](C(C)C)C2CCC2)cc1F ZINC000536661450 323199740 /nfs/dbraw/zinc/19/97/40/323199740.db2.gz QDLWUXRUHJDIHF-UHFFFAOYSA-N 1 1 235.346 3.897 20 0 BHADMO C[C@@H]1C[C@@H](C)[N@@H+](C/C=C/c2ccc(F)cc2)C1 ZINC000536661632 323199892 /nfs/dbraw/zinc/19/98/92/323199892.db2.gz YWWAQAUDCDURSJ-CDJBXZAQSA-N 1 1 233.330 3.569 20 0 BHADMO C[C@@H]1C[C@@H](C)[N@@H+](C/C=C\c2ccc(F)cc2)C1 ZINC000536661633 323199757 /nfs/dbraw/zinc/19/97/57/323199757.db2.gz YWWAQAUDCDURSJ-FGTRRKKMSA-N 1 1 233.330 3.569 20 0 BHADMO C[C@@H]1C[C@H](C)[N@@H+](C/C=C/c2ccc(F)cc2)C1 ZINC000536661634 323199709 /nfs/dbraw/zinc/19/97/09/323199709.db2.gz YWWAQAUDCDURSJ-HNFMAKEJSA-N 1 1 233.330 3.569 20 0 BHADMO C[C@@H]1C[C@H](C)[N@@H+](C/C=C\c2ccc(F)cc2)C1 ZINC000536661635 323199763 /nfs/dbraw/zinc/19/97/63/323199763.db2.gz YWWAQAUDCDURSJ-JXLSXLBDSA-N 1 1 233.330 3.569 20 0 BHADMO CC[N@@H+](Cc1cccc(Cl)c1F)C1CCC1 ZINC000536661688 323199889 /nfs/dbraw/zinc/19/98/89/323199889.db2.gz CCGZCBHQECQMMY-UHFFFAOYSA-N 1 1 241.737 3.854 20 0 BHADMO Cc1ccc(F)c(C[N@H+](C(C)C)C2CCC2)c1 ZINC000536661709 323199787 /nfs/dbraw/zinc/19/97/87/323199787.db2.gz CZCXZJJGGLLELQ-UHFFFAOYSA-N 1 1 235.346 3.897 20 0 BHADMO C[C@@H]1C[C@@H]1c1ccc(C[N@H+]2C[C@H](C)C[C@@H]2C)o1 ZINC000536662858 323199827 /nfs/dbraw/zinc/19/98/27/323199827.db2.gz DPFZMWUOLMWJFR-NMKXLXIOSA-N 1 1 233.355 3.633 20 0 BHADMO C[C@@H]1C[C@H]1c1ccc(C[N@H+]2C[C@H](C)C[C@@H]2C)o1 ZINC000536662859 323199881 /nfs/dbraw/zinc/19/98/81/323199881.db2.gz DPFZMWUOLMWJFR-NRWUCQMLSA-N 1 1 233.355 3.633 20 0 BHADMO C[C@H]1C[C@H]1c1ccc(C[N@H+]2C[C@H](C)C[C@@H]2C)o1 ZINC000536662860 323199838 /nfs/dbraw/zinc/19/98/38/323199838.db2.gz DPFZMWUOLMWJFR-OWTLIXCDSA-N 1 1 233.355 3.633 20 0 BHADMO C[C@H]1C[C@@H]1c1ccc(C[N@H+]2C[C@H](C)C[C@@H]2C)o1 ZINC000536662861 323199736 /nfs/dbraw/zinc/19/97/36/323199736.db2.gz DPFZMWUOLMWJFR-UHXUPSOCSA-N 1 1 233.355 3.633 20 0 BHADMO CCc1ccc(C[N@H+](CC)C2CCC2)s1 ZINC000536663111 323199772 /nfs/dbraw/zinc/19/97/72/323199772.db2.gz XAAWJQFQNCXPMW-UHFFFAOYSA-N 1 1 223.385 3.685 20 0 BHADMO Cc1ccoc1C[N@H+]1CCCC12CCCCC2 ZINC000536663525 323199783 /nfs/dbraw/zinc/19/97/83/323199783.db2.gz LNAVBKQSJQPMPI-UHFFFAOYSA-N 1 1 233.355 3.887 20 0 BHADMO Cc1ccc(C[N@H+](CC(C)C)CC(C)(C)C)nc1 ZINC000536664165 323199815 /nfs/dbraw/zinc/19/98/15/323199815.db2.gz GPCDCJDAHBHTTA-UHFFFAOYSA-N 1 1 248.414 3.894 20 0 BHADMO CC(C)C[N@@H+](Cc1cccn1C)CC(C)(C)C ZINC000536664169 323199704 /nfs/dbraw/zinc/19/97/04/323199704.db2.gz GSHXFEHQWSVFSI-UHFFFAOYSA-N 1 1 236.403 3.529 20 0 BHADMO CCC[C@@H]1[C@H](C)CCC[N@H+]1Cc1ccc(C)cn1 ZINC000536665335 323200152 /nfs/dbraw/zinc/20/01/52/323200152.db2.gz DGKDTYDLCCTNCR-GDBMZVCRSA-N 1 1 246.398 3.791 20 0 BHADMO CCC[C@@H]1[C@@H](C)CCC[N@H+]1Cc1ccc(C)cn1 ZINC000536665336 323200136 /nfs/dbraw/zinc/20/01/36/323200136.db2.gz DGKDTYDLCCTNCR-GOEBONIOSA-N 1 1 246.398 3.791 20 0 BHADMO CCC[C@H]1[C@@H](C)CCC[N@H+]1Cc1ccc(C)cn1 ZINC000536665337 323200142 /nfs/dbraw/zinc/20/01/42/323200142.db2.gz DGKDTYDLCCTNCR-HOCLYGCPSA-N 1 1 246.398 3.791 20 0 BHADMO CCC[C@H]1[C@H](C)CCC[N@H+]1Cc1ccc(C)cn1 ZINC000536665338 323200228 /nfs/dbraw/zinc/20/02/28/323200228.db2.gz DGKDTYDLCCTNCR-ZBFHGGJFSA-N 1 1 246.398 3.791 20 0 BHADMO CCC(C)(C)[C@@H]1CCC[N@H+]1Cc1cccc(O)c1 ZINC000536665664 323200167 /nfs/dbraw/zinc/20/01/67/323200167.db2.gz XKGJYVPHCGLRTQ-HNNXBMFYSA-N 1 1 247.382 3.793 20 0 BHADMO CCC(C)(C)[C@H]1CCC[N@H+]1Cc1cccc(O)c1 ZINC000536665665 323200183 /nfs/dbraw/zinc/20/01/83/323200183.db2.gz XKGJYVPHCGLRTQ-OAHLLOKOSA-N 1 1 247.382 3.793 20 0 BHADMO CC(C)CC[C@@H]1CCC[N@H+]1Cc1cccc(O)c1 ZINC000536667943 323200224 /nfs/dbraw/zinc/20/02/24/323200224.db2.gz SHVCDWQRKWVTNF-HNNXBMFYSA-N 1 1 247.382 3.793 20 0 BHADMO CC(C)CC[C@H]1CCC[N@H+]1Cc1cccc(O)c1 ZINC000536667944 323200175 /nfs/dbraw/zinc/20/01/75/323200175.db2.gz SHVCDWQRKWVTNF-OAHLLOKOSA-N 1 1 247.382 3.793 20 0 BHADMO CC[C@H]1C[C@@H](C)C[N@H+]1Cc1cccc2cc[nH]c21 ZINC000536668124 323200234 /nfs/dbraw/zinc/20/02/34/323200234.db2.gz LCKJTNBBJSWGLW-DOMZBBRYSA-N 1 1 242.366 3.788 20 0 BHADMO CC[C@@H]1C[C@@H](C)C[N@H+]1Cc1cccc2cc[nH]c21 ZINC000536668125 323200100 /nfs/dbraw/zinc/20/01/00/323200100.db2.gz LCKJTNBBJSWGLW-IUODEOHRSA-N 1 1 242.366 3.788 20 0 BHADMO CC[C@@H]1C[C@H](C)C[N@H+]1Cc1cccc2cc[nH]c21 ZINC000536668126 323200207 /nfs/dbraw/zinc/20/02/07/323200207.db2.gz LCKJTNBBJSWGLW-SWLSCSKDSA-N 1 1 242.366 3.788 20 0 BHADMO CC[C@H]1C[C@H](C)C[N@H+]1Cc1cccc2cc[nH]c21 ZINC000536668127 323200144 /nfs/dbraw/zinc/20/01/44/323200144.db2.gz LCKJTNBBJSWGLW-WFASDCNBSA-N 1 1 242.366 3.788 20 0 BHADMO C/C(=C\c1ccccc1)C[N@H+]1C[C@@H]2CCC[C@@H]2C1 ZINC000536668252 323200275 /nfs/dbraw/zinc/20/02/75/323200275.db2.gz QOQYEPHXDKSYHR-NAUDGSTISA-N 1 1 241.378 3.822 20 0 BHADMO C/C(=C/c1ccccc1)C[N@H+]1C[C@@H]2CCC[C@@H]2C1 ZINC000536668256 323200277 /nfs/dbraw/zinc/20/02/77/323200277.db2.gz QOQYEPHXDKSYHR-SPTPGQEZSA-N 1 1 241.378 3.822 20 0 BHADMO C[C@H]1C[N@@H+](Cc2cccc3[nH]ccc32)C(C)(C)C1 ZINC000536668516 323200350 /nfs/dbraw/zinc/20/03/50/323200350.db2.gz HSIPBOSEOABEDE-GFCCVEGCSA-N 1 1 242.366 3.788 20 0 BHADMO C[C@@H]1C[N@@H+](Cc2cccc3[nH]ccc32)C(C)(C)C1 ZINC000536668518 323200334 /nfs/dbraw/zinc/20/03/34/323200334.db2.gz HSIPBOSEOABEDE-LBPRGKRZSA-N 1 1 242.366 3.788 20 0 BHADMO CC1=CC[N@@H+](Cc2ccc(Cl)s2)CC1 ZINC000536668954 323200338 /nfs/dbraw/zinc/20/03/38/323200338.db2.gz ULRJVGTXWZYHCP-UHFFFAOYSA-N 1 1 227.760 3.554 20 0 BHADMO CC1=CC[N@H+](Cc2ccc(Cl)s2)CC1 ZINC000536668954 323200337 /nfs/dbraw/zinc/20/03/37/323200337.db2.gz ULRJVGTXWZYHCP-UHFFFAOYSA-N 1 1 227.760 3.554 20 0 BHADMO C/C(=C\c1ccccc1)C[N@@H+]1CC=C(C)CC1 ZINC000536668985 323200331 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323200495 /nfs/dbraw/zinc/20/04/95/323200495.db2.gz UJCPFKUFBIETSR-TXEJJXNPSA-N 1 1 235.396 3.542 20 0 BHADMO Fc1ccc(/C=C\C[N@H+]2C[C@@H]3CCC[C@@H]3C2)cc1 ZINC000536671196 323200592 /nfs/dbraw/zinc/20/05/92/323200592.db2.gz LOZYXEXPPSHHAY-DNBFZZCYSA-N 1 1 245.341 3.571 20 0 BHADMO Fc1ccc(/C=C/C[N@H+]2C[C@@H]3CCC[C@@H]3C2)cc1 ZINC000536671199 323200478 /nfs/dbraw/zinc/20/04/78/323200478.db2.gz LOZYXEXPPSHHAY-WNUVYJMLSA-N 1 1 245.341 3.571 20 0 BHADMO CC[N@@H+](CC1CC1)C[C@H]1C[C@H]1c1ccccc1 ZINC000536672764 323200529 /nfs/dbraw/zinc/20/05/29/323200529.db2.gz LVFSJPDWYSXCGV-CVEARBPZSA-N 1 1 229.367 3.522 20 0 BHADMO CC[N@@H+](CC1CC1)C[C@H]1C[C@@H]1c1ccccc1 ZINC000536672765 323200601 /nfs/dbraw/zinc/20/06/01/323200601.db2.gz LVFSJPDWYSXCGV-HZPDHXFCSA-N 1 1 229.367 3.522 20 0 BHADMO CC[N@@H+](CC1CC1)C[C@@H]1C[C@@H]1c1ccccc1 ZINC000536672766 323200547 /nfs/dbraw/zinc/20/05/47/323200547.db2.gz LVFSJPDWYSXCGV-JKSUJKDBSA-N 1 1 229.367 3.522 20 0 BHADMO CC[N@@H+](C/C=C\c1ccc(F)cc1)CC1CC1 ZINC000536672860 323200522 /nfs/dbraw/zinc/20/05/22/323200522.db2.gz UTTALLQYRIVFKF-ARJAWSKDSA-N 1 1 233.330 3.571 20 0 BHADMO CC[N@@H+](C/C=C/c1ccc(F)cc1)CC1CC1 ZINC000536672861 323200508 /nfs/dbraw/zinc/20/05/08/323200508.db2.gz UTTALLQYRIVFKF-ONEGZZNKSA-N 1 1 233.330 3.571 20 0 BHADMO CC[N@H+](Cc1ccc(C)c(C)c1)CC1CC1 ZINC000536672907 323200463 /nfs/dbraw/zinc/20/04/63/323200463.db2.gz XYJBUSMIMWWUAT-UHFFFAOYSA-N 1 1 217.356 3.535 20 0 BHADMO CCC1(CC)CC[N@@H+](Cc2cccs2)C1 ZINC000536673344 323200633 /nfs/dbraw/zinc/20/06/33/323200633.db2.gz NVNNMGVGKORRMM-UHFFFAOYSA-N 1 1 223.385 3.760 20 0 BHADMO CCCOc1cccc(C[N@@H+](CC)CC2CC2)c1 ZINC000536673749 323200707 /nfs/dbraw/zinc/20/07/07/323200707.db2.gz KBHGITCSNBQQQV-UHFFFAOYSA-N 1 1 247.382 3.707 20 0 BHADMO C[C@@H]1CCC[N@H+]1Cc1cc2ccccc2s1 ZINC000536673905 323200711 /nfs/dbraw/zinc/20/07/11/323200711.db2.gz BICLFPZGSAWOHG-LLVKDONJSA-N 1 1 231.364 3.886 20 0 BHADMO C[C@H]1CCC[N@H+]1Cc1cc2ccccc2s1 ZINC000536673906 323200662 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249.398 3.701 20 0 BHADMO CC[C@@H](C)C[N@@H+](CC)Cc1ccccc1OC ZINC000537660139 324095878 /nfs/dbraw/zinc/09/58/78/324095878.db2.gz ALRKCQKYEVZGQJ-CYBMUJFWSA-N 1 1 235.371 3.563 20 0 BHADMO CC[C@H](C)C[N@@H+](CC)Cc1ccccc1OC ZINC000537660142 324095653 /nfs/dbraw/zinc/09/56/53/324095653.db2.gz ALRKCQKYEVZGQJ-ZDUSSCGKSA-N 1 1 235.371 3.563 20 0 BHADMO CCC[C@@H](C)[C@H]1CCC[N@H+]1Cc1ccc(C)cn1 ZINC000537660389 324095803 /nfs/dbraw/zinc/09/58/03/324095803.db2.gz FISUMZGBEZHRLT-GDBMZVCRSA-N 1 1 246.398 3.791 20 0 BHADMO CCC[C@H](C)[C@H]1CCC[N@H+]1Cc1ccc(C)cn1 ZINC000537660390 324095962 /nfs/dbraw/zinc/09/59/62/324095962.db2.gz FISUMZGBEZHRLT-GOEBONIOSA-N 1 1 246.398 3.791 20 0 BHADMO CCC[C@H](C)[C@@H]1CCC[N@H+]1Cc1ccc(C)cn1 ZINC000537660391 324095945 /nfs/dbraw/zinc/09/59/45/324095945.db2.gz FISUMZGBEZHRLT-HOCLYGCPSA-N 1 1 246.398 3.791 20 0 BHADMO CCC[C@@H](C)[C@@H]1CCC[N@H+]1Cc1ccc(C)cn1 ZINC000537660392 324095967 /nfs/dbraw/zinc/09/59/67/324095967.db2.gz FISUMZGBEZHRLT-ZBFHGGJFSA-N 1 1 246.398 3.791 20 0 BHADMO CCC[N@H+]1[C@H](C)Cc2cc(F)ccc2[C@H]1C ZINC000537683930 324095727 /nfs/dbraw/zinc/09/57/27/324095727.db2.gz NRLFUDXXCGXZAV-GHMZBOCLSA-N 1 1 221.319 3.543 20 0 BHADMO CCC[N@H+]1[C@H](C)Cc2cc(F)ccc2[C@@H]1C ZINC000537683932 324095974 /nfs/dbraw/zinc/09/59/74/324095974.db2.gz NRLFUDXXCGXZAV-MNOVXSKESA-N 1 1 221.319 3.543 20 0 BHADMO CCC[N@H+]1[C@@H](C)Cc2cc(F)ccc2[C@@H]1C ZINC000537683933 324095468 /nfs/dbraw/zinc/09/54/68/324095468.db2.gz NRLFUDXXCGXZAV-QWRGUYRKSA-N 1 1 221.319 3.543 20 0 BHADMO CCC[N@@H+]1[C@H](C)c2ccc(F)cc2C[C@@H]1C ZINC000537683934 324095994 /nfs/dbraw/zinc/09/59/94/324095994.db2.gz NRLFUDXXCGXZAV-WDEREUQCSA-N 1 1 221.319 3.543 20 0 BHADMO CC(C)[C@@H]1CC[N@@H+](Cc2cccc3[nH]ccc32)C1 ZINC000537689454 324096937 /nfs/dbraw/zinc/09/69/37/324096937.db2.gz MWKZGBBGKSBUDJ-CYBMUJFWSA-N 1 1 242.366 3.646 20 0 BHADMO CC(C)[C@H]1CC[N@@H+](Cc2cccc3[nH]ccc32)C1 ZINC000537689456 324096385 /nfs/dbraw/zinc/09/63/85/324096385.db2.gz MWKZGBBGKSBUDJ-ZDUSSCGKSA-N 1 1 242.366 3.646 20 0 BHADMO CCCOc1ccc(C[N@@H+](C)CCC2CC2)cc1 ZINC000537692526 324096854 /nfs/dbraw/zinc/09/68/54/324096854.db2.gz MNONMJIXDFJWKS-UHFFFAOYSA-N 1 1 247.382 3.707 20 0 BHADMO CCCCC[C@H]1CCC[N@H+]1Cc1cccn1C ZINC000537694252 324097379 /nfs/dbraw/zinc/09/73/79/324097379.db2.gz CWXPKCNNLOGWLD-AWEZNQCLSA-N 1 1 234.387 3.570 20 0 BHADMO CCCCC[C@@H]1CCC[N@H+]1Cc1cccn1C ZINC000537694256 324097451 /nfs/dbraw/zinc/09/74/51/324097451.db2.gz CWXPKCNNLOGWLD-CQSZACIVSA-N 1 1 234.387 3.570 20 0 BHADMO CCCCC[C@H]1CCC[N@H+]1Cc1ccc(C)cn1 ZINC000537694286 324097852 /nfs/dbraw/zinc/09/78/52/324097852.db2.gz DWMCQRDQMVPQKZ-INIZCTEOSA-N 1 1 246.398 3.935 20 0 BHADMO CCCCC[C@@H]1CCC[N@H+]1Cc1ccc(C)cn1 ZINC000537694288 324097554 /nfs/dbraw/zinc/09/75/54/324097554.db2.gz DWMCQRDQMVPQKZ-MRXNPFEDSA-N 1 1 246.398 3.935 20 0 BHADMO C[N@@H+](CCC1CC1)Cc1ccc(F)c(Cl)c1 ZINC000537695247 324097581 /nfs/dbraw/zinc/09/75/81/324097581.db2.gz HAPCPLNHVFZJQL-UHFFFAOYSA-N 1 1 241.737 3.711 20 0 BHADMO 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CCC[C@H](C[N@@H+](C)CC)c1ccccc1 ZINC000538306308 388683715 /nfs/dbraw/zinc/68/37/15/388683715.db2.gz OJEIEAHHEWCZQS-CQSZACIVSA-N 1 1 205.345 3.522 20 0 BHADMO CCC[C@@H](C)C[N@@H+](C)Cc1ccc(OC)cc1 ZINC000538307063 388683065 /nfs/dbraw/zinc/68/30/65/388683065.db2.gz RVSKPDPAEPGJEZ-CYBMUJFWSA-N 1 1 235.371 3.563 20 0 BHADMO CCC[C@H](C)C[N@@H+](C)Cc1ccc(OC)cc1 ZINC000538307064 388682810 /nfs/dbraw/zinc/68/28/10/388682810.db2.gz RVSKPDPAEPGJEZ-ZDUSSCGKSA-N 1 1 235.371 3.563 20 0 BHADMO CCC[C@H](C)[N@@H+](C)C[C@H](C)c1ccc(OC)cc1 ZINC000538307309 388683335 /nfs/dbraw/zinc/68/33/35/388683335.db2.gz MVUQJZCANLPLNU-KBPBESRZSA-N 1 1 249.398 3.919 20 0 BHADMO CCC[C@H](C)[N@@H+](C)C[C@@H](C)c1ccc(OC)cc1 ZINC000538307310 388683797 /nfs/dbraw/zinc/68/37/97/388683797.db2.gz MVUQJZCANLPLNU-KGLIPLIRSA-N 1 1 249.398 3.919 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)C[C@H](C)c1ccc(OC)cc1 ZINC000538307311 388683386 /nfs/dbraw/zinc/68/33/86/388683386.db2.gz MVUQJZCANLPLNU-UONOGXRCSA-N 1 1 249.398 3.919 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)C[C@@H](C)c1ccc(OC)cc1 ZINC000538307312 388683085 /nfs/dbraw/zinc/68/30/85/388683085.db2.gz MVUQJZCANLPLNU-ZIAGYGMSSA-N 1 1 249.398 3.919 20 0 BHADMO CCC[C@H](C)C[N@H+]1CCC[C@@H]1c1ccc[nH]1 ZINC000538307488 388683452 /nfs/dbraw/zinc/68/34/52/388683452.db2.gz ZPBWVLPLDIXHEE-GXTWGEPZSA-N 1 1 220.360 3.588 20 0 BHADMO CCC[C@H](C)C[N@H+]1CCC[C@H]1c1ccc[nH]1 ZINC000538307489 388683545 /nfs/dbraw/zinc/68/35/45/388683545.db2.gz ZPBWVLPLDIXHEE-JSGCOSHPSA-N 1 1 220.360 3.588 20 0 BHADMO CCC[C@@H](C)C[N@H+]1CCC[C@H]1c1ccc[nH]1 ZINC000538307490 388683147 /nfs/dbraw/zinc/68/31/47/388683147.db2.gz ZPBWVLPLDIXHEE-OCCSQVGLSA-N 1 1 220.360 3.588 20 0 BHADMO CCC[C@@H](C)C[N@H+]1CCC[C@@H]1c1ccc[nH]1 ZINC000538307491 388683726 /nfs/dbraw/zinc/68/37/26/388683726.db2.gz ZPBWVLPLDIXHEE-TZMCWYRMSA-N 1 1 220.360 3.588 20 0 BHADMO CCC[C@H](C[N@@H+](C)[C@H](C)COC)c1ccccc1 ZINC000538307899 388683390 /nfs/dbraw/zinc/68/33/90/388683390.db2.gz KSDUDJIMPDLUFZ-GDBMZVCRSA-N 1 1 249.398 3.537 20 0 BHADMO CCC[C@H](C[N@@H+](C)[C@@H](C)COC)c1ccccc1 ZINC000538307902 388683631 /nfs/dbraw/zinc/68/36/31/388683631.db2.gz KSDUDJIMPDLUFZ-GOEBONIOSA-N 1 1 249.398 3.537 20 0 BHADMO CCC[C@@H](C[N@@H+](C)[C@@H](C)COC)c1ccccc1 ZINC000538307903 388684017 /nfs/dbraw/zinc/68/40/17/388684017.db2.gz KSDUDJIMPDLUFZ-HOCLYGCPSA-N 1 1 249.398 3.537 20 0 BHADMO CCC[C@@H](C[N@@H+](C)[C@H](C)COC)c1ccccc1 ZINC000538307905 388683998 /nfs/dbraw/zinc/68/39/98/388683998.db2.gz KSDUDJIMPDLUFZ-ZBFHGGJFSA-N 1 1 249.398 3.537 20 0 BHADMO CCC[C@@H](C)C[N@@H+](C)Cc1ccccc1OC ZINC000538308071 388684550 /nfs/dbraw/zinc/68/45/50/388684550.db2.gz PANKIUKNFRLTEP-CYBMUJFWSA-N 1 1 235.371 3.563 20 0 BHADMO CCC[C@H](C)C[N@@H+](C)Cc1ccccc1OC ZINC000538308074 388683928 /nfs/dbraw/zinc/68/39/28/388683928.db2.gz PANKIUKNFRLTEP-ZDUSSCGKSA-N 1 1 235.371 3.563 20 0 BHADMO CCC[C@@H](C)C[N@@H+](C)Cc1ccccc1 ZINC000538308154 388684315 /nfs/dbraw/zinc/68/43/15/388684315.db2.gz NFWRYVRLKOBUHH-CYBMUJFWSA-N 1 1 205.345 3.555 20 0 BHADMO CCC[C@H](C)C[N@@H+](C)Cc1ccccc1 ZINC000538308155 388684193 /nfs/dbraw/zinc/68/41/93/388684193.db2.gz NFWRYVRLKOBUHH-ZDUSSCGKSA-N 1 1 205.345 3.555 20 0 BHADMO CCC[N@@H+](CCCc1cccc(OC)c1)C1CC1 ZINC000538319798 388684434 /nfs/dbraw/zinc/68/44/34/388684434.db2.gz DGHJNAVQMHTANO-UHFFFAOYSA-N 1 1 247.382 3.502 20 0 BHADMO C/C(=C\c1ccccc1)CNc1cc(C)cc[nH+]1 ZINC000538323399 323097860 /nfs/dbraw/zinc/09/78/60/323097860.db2.gz OGDIHPQYIBRIGJ-GXDHUFHOSA-N 1 1 238.334 3.905 20 0 BHADMO C/C(=C/c1ccccc1)CNc1cc(C)cc[nH+]1 ZINC000538323400 323097848 /nfs/dbraw/zinc/09/78/48/323097848.db2.gz OGDIHPQYIBRIGJ-UVTDQMKNSA-N 1 1 238.334 3.905 20 0 BHADMO CCC[N@@H+](C[C@@H](C)c1ccccc1)C1CC1 ZINC000538324217 388683954 /nfs/dbraw/zinc/68/39/54/388683954.db2.gz CHWCATFRDJSMIZ-CYBMUJFWSA-N 1 1 217.356 3.665 20 0 BHADMO CCC[N@@H+](C[C@H](C)c1ccccc1)C1CC1 ZINC000538324218 388684210 /nfs/dbraw/zinc/68/42/10/388684210.db2.gz CHWCATFRDJSMIZ-ZDUSSCGKSA-N 1 1 217.356 3.665 20 0 BHADMO Cc1[nH+]ccn1Cc1c(C)c(C)c(C)c(C)c1C 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324721060 /nfs/dbraw/zinc/72/10/60/324721060.db2.gz XFGIAJSEZANJFG-DGCLKSJQSA-N 1 1 243.354 3.564 20 0 BHADMO CC[C@H]1CCC[C@H]1Nc1ccc2c(c1)[nH+]cn2C ZINC000538641455 388703461 /nfs/dbraw/zinc/70/34/61/388703461.db2.gz XFGIAJSEZANJFG-WCQYABFASA-N 1 1 243.354 3.564 20 0 BHADMO CC[C@@H]1CCC[C@@H]1Nc1ccc2c(c1)[nH+]cn2C ZINC000538641457 324720489 /nfs/dbraw/zinc/72/04/89/324720489.db2.gz XFGIAJSEZANJFG-YPMHNXCESA-N 1 1 243.354 3.564 20 0 BHADMO CCCc1ccc(C[N@@H+](C)[C@H]2CCSC2)cc1 ZINC000538691698 388705918 /nfs/dbraw/zinc/70/59/18/388705918.db2.gz OZHSEABHUUHUBT-HNNXBMFYSA-N 1 1 249.423 3.576 20 0 BHADMO CCCc1ccc(C[N@@H+](C)[C@@H]2CCSC2)cc1 ZINC000538691699 388705255 /nfs/dbraw/zinc/70/52/55/388705255.db2.gz OZHSEABHUUHUBT-OAHLLOKOSA-N 1 1 249.423 3.576 20 0 BHADMO CC(C)[N@@H+](CCCc1cccc(F)c1)CC1CC1 ZINC000538708709 388708106 /nfs/dbraw/zinc/70/81/06/388708106.db2.gz QDCLWPXIXWMWJS-UHFFFAOYSA-N 1 1 249.373 3.879 20 0 BHADMO CCCOc1ccc(C[N@@H+](C(C)C)C2CC2)cc1 ZINC000538716759 388710600 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ZINC000538719946 388710476 /nfs/dbraw/zinc/71/04/76/388710476.db2.gz URNLQPOGTKOAJJ-XJKSGUPXSA-N 1 1 247.382 3.793 20 0 BHADMO CO[C@@H](C)C[N@@H+](Cc1ccc(C)c(C)c1)C(C)C ZINC000538720407 388710197 /nfs/dbraw/zinc/71/01/97/388710197.db2.gz XBGUQKDHWHQFOI-HNNXBMFYSA-N 1 1 249.398 3.549 20 0 BHADMO CO[C@H](C)C[N@@H+](Cc1ccc(C)c(C)c1)C(C)C ZINC000538720408 388710579 /nfs/dbraw/zinc/71/05/79/388710579.db2.gz XBGUQKDHWHQFOI-OAHLLOKOSA-N 1 1 249.398 3.549 20 0 BHADMO CC(C)Oc1ccc(C[N@H+]2C[C@@H](C)C[C@@H]2C)cc1 ZINC000538720957 388711876 /nfs/dbraw/zinc/71/18/76/388711876.db2.gz HJEGBIUZERFGHB-KBPBESRZSA-N 1 1 247.382 3.704 20 0 BHADMO CC(C)Oc1ccc(C[N@H+]2C[C@H](C)C[C@@H]2C)cc1 ZINC000538720958 388711724 /nfs/dbraw/zinc/71/17/24/388711724.db2.gz HJEGBIUZERFGHB-KGLIPLIRSA-N 1 1 247.382 3.704 20 0 BHADMO CC(C)Oc1ccc(C[N@H+]2C[C@@H](C)C[C@H]2C)cc1 ZINC000538720959 388712462 /nfs/dbraw/zinc/71/24/62/388712462.db2.gz HJEGBIUZERFGHB-UONOGXRCSA-N 1 1 247.382 3.704 20 0 BHADMO CC(C)Oc1ccc(C[N@H+]2C[C@H](C)C[C@H]2C)cc1 ZINC000538720960 388711615 /nfs/dbraw/zinc/71/16/15/388711615.db2.gz HJEGBIUZERFGHB-ZIAGYGMSSA-N 1 1 247.382 3.704 20 0 BHADMO Cc1ccoc1C[N@@H+]1C[C@H](C)[C@H]1c1ccccc1 ZINC000538721592 388712026 /nfs/dbraw/zinc/71/20/26/388712026.db2.gz SWVSFEWSWHENQB-BBRMVZONSA-N 1 1 241.334 3.781 20 0 BHADMO Cc1ccoc1C[N@@H+]1C[C@@H](C)[C@H]1c1ccccc1 ZINC000538721593 388712207 /nfs/dbraw/zinc/71/22/07/388712207.db2.gz SWVSFEWSWHENQB-CJNGLKHVSA-N 1 1 241.334 3.781 20 0 BHADMO CC(C)Oc1ccc(C[N@H+]2C[C@H](C)[C@H](C)C2)cc1 ZINC000538725725 388712250 /nfs/dbraw/zinc/71/22/50/388712250.db2.gz SCGWGNQIWNJDGI-OKILXGFUSA-N 1 1 247.382 3.562 20 0 BHADMO CCCOc1cccc(C[N@@H+]2CC=C(C)CC2)c1 ZINC000538727390 388713799 /nfs/dbraw/zinc/71/37/99/388713799.db2.gz NTCSMXBRWYDAJD-UHFFFAOYSA-N 1 1 245.366 3.627 20 0 BHADMO CC[C@@H]1C[C@H](C)C[N@H+]1Cc1ccc(C)s1 ZINC000538727486 388713297 /nfs/dbraw/zinc/71/32/97/388713297.db2.gz UXJXSPVBRMELGX-CMPLNLGQSA-N 1 1 223.385 3.677 20 0 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C[C@@H]1CC[N@@H+](Cc2cccc3cc[nH]c32)C[C@H]1C ZINC000538727862 388713137 /nfs/dbraw/zinc/71/31/37/388713137.db2.gz CMDMMWWSJWWBHT-CHWSQXEVSA-N 1 1 242.366 3.646 20 0 BHADMO C[C@@H]1CC[N@@H+](Cc2cccc3cc[nH]c32)C[C@@H]1C ZINC000538727863 388713244 /nfs/dbraw/zinc/71/32/44/388713244.db2.gz CMDMMWWSJWWBHT-OLZOCXBDSA-N 1 1 242.366 3.646 20 0 BHADMO C[C@H]1CC[N@@H+](Cc2cccc3cc[nH]c32)C[C@H]1C ZINC000538727864 388713189 /nfs/dbraw/zinc/71/31/89/388713189.db2.gz CMDMMWWSJWWBHT-QWHCGFSZSA-N 1 1 242.366 3.646 20 0 BHADMO C[C@H]1C[N@H+](Cc2cccc3cc[nH]c32)CC[C@@H]1C ZINC000538727865 384035518 /nfs/dbraw/zinc/03/55/18/384035518.db2.gz CMDMMWWSJWWBHT-STQMWFEESA-N 1 1 242.366 3.646 20 0 BHADMO CC[C@@H]1C[C@@H](C)C[N@H+]1Cc1c(F)cccc1F ZINC000538728189 388713849 /nfs/dbraw/zinc/71/38/49/388713849.db2.gz CJOIPBUWSBLXTJ-GHMZBOCLSA-N 1 1 239.309 3.585 20 0 BHADMO CC[C@H]1C[C@@H](C)C[N@H+]1Cc1c(F)cccc1F ZINC000538728190 388713030 /nfs/dbraw/zinc/71/30/30/388713030.db2.gz CJOIPBUWSBLXTJ-MNOVXSKESA-N 1 1 239.309 3.585 20 0 BHADMO CC[C@H]1C[C@H](C)C[N@H+]1Cc1c(F)cccc1F ZINC000538728191 388713156 /nfs/dbraw/zinc/71/31/56/388713156.db2.gz CJOIPBUWSBLXTJ-QWRGUYRKSA-N 1 1 239.309 3.585 20 0 BHADMO CC[C@@H]1C[C@H](C)C[N@H+]1Cc1c(F)cccc1F ZINC000538728192 388714043 /nfs/dbraw/zinc/71/40/43/388714043.db2.gz CJOIPBUWSBLXTJ-WDEREUQCSA-N 1 1 239.309 3.585 20 0 BHADMO Cc1ccc([C@H]2CCC[N@H+]2CC(C)(C)C)o1 ZINC000538728194 388713194 /nfs/dbraw/zinc/71/31/94/388713194.db2.gz CNSTYESXMJPZIJ-GFCCVEGCSA-N 1 1 221.344 3.771 20 0 BHADMO Cc1ccc([C@@H]2CCC[N@H+]2CC(C)(C)C)o1 ZINC000538728195 388710237 /nfs/dbraw/zinc/71/02/37/388710237.db2.gz CNSTYESXMJPZIJ-LBPRGKRZSA-N 1 1 221.344 3.771 20 0 BHADMO Cc1ccc(C[N@H+]2C[C@@H]3CCC[C@@H]3C2)cc1C ZINC000538728409 388713044 /nfs/dbraw/zinc/71/30/44/388713044.db2.gz RZLZFJRYKBHUIE-IYBDPMFKSA-N 1 1 229.367 3.535 20 0 BHADMO CC1=CC[N@@H+](Cc2ccc(Cl)c(F)c2)CC1 ZINC000538728585 388713480 /nfs/dbraw/zinc/71/34/80/388713480.db2.gz IRSRARCTGPPRGV-UHFFFAOYSA-N 1 1 239.721 3.631 20 0 BHADMO CC1=CC[N@H+](Cc2ccc(Cl)c(F)c2)CC1 ZINC000538728585 388713478 /nfs/dbraw/zinc/71/34/78/388713478.db2.gz IRSRARCTGPPRGV-UHFFFAOYSA-N 1 1 239.721 3.631 20 0 BHADMO CC[N@H+](Cc1cccc(Cl)c1F)CC1CC1 ZINC000538729992 388713149 /nfs/dbraw/zinc/71/31/49/388713149.db2.gz VDWYCPPGJWARFV-UHFFFAOYSA-N 1 1 241.737 3.711 20 0 BHADMO C[C@@H]1CCC[N@H+]1Cc1ccc(-c2ccccc2)o1 ZINC000538730106 388713130 /nfs/dbraw/zinc/71/31/30/388713130.db2.gz GKDBJTVURXZGQR-CYBMUJFWSA-N 1 1 241.334 3.931 20 0 BHADMO C[C@H]1CCC[N@H+]1Cc1ccc(-c2ccccc2)o1 ZINC000538730107 388713889 /nfs/dbraw/zinc/71/38/89/388713889.db2.gz GKDBJTVURXZGQR-ZDUSSCGKSA-N 1 1 241.334 3.931 20 0 BHADMO CC[N@H+](Cc1ccc(Cl)c(F)c1)CC1CC1 ZINC000538731062 388712932 /nfs/dbraw/zinc/71/29/32/388712932.db2.gz UXTAFHXFVKTCMN-UHFFFAOYSA-N 1 1 241.737 3.711 20 0 BHADMO C[C@@H]1C[C@H]2CCCC[C@@H]2[N@H+]1Cc1ccsc1 ZINC000538732160 388714940 /nfs/dbraw/zinc/71/49/40/388714940.db2.gz ORENTYRLBVBSNP-BNOWGMLFSA-N 1 1 235.396 3.901 20 0 BHADMO C[C@@H]1C[C@@H]2CCCC[C@H]2[N@H+]1Cc1ccsc1 ZINC000538732161 388715198 /nfs/dbraw/zinc/71/51/98/388715198.db2.gz ORENTYRLBVBSNP-KWCYVHTRSA-N 1 1 235.396 3.901 20 0 BHADMO C[C@@H]1C[C@H]2CCCC[C@H]2[N@H+]1Cc1ccsc1 ZINC000538732162 388714484 /nfs/dbraw/zinc/71/44/84/388714484.db2.gz ORENTYRLBVBSNP-MRVWCRGKSA-N 1 1 235.396 3.901 20 0 BHADMO C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@H+]1Cc1ccsc1 ZINC000538732163 388714696 /nfs/dbraw/zinc/71/46/96/388714696.db2.gz ORENTYRLBVBSNP-XBFCOCLRSA-N 1 1 235.396 3.901 20 0 BHADMO FC(F)C[N@@H+](CC1CCCCCC1)C1CC1 ZINC000538733259 388714453 /nfs/dbraw/zinc/71/44/53/388714453.db2.gz DDYITBNDTZIUBU-UHFFFAOYSA-N 1 1 231.330 3.686 20 0 BHADMO FC(F)C[N@H+](CC1CCCCCC1)C1CC1 ZINC000538733259 388714448 /nfs/dbraw/zinc/71/44/48/388714448.db2.gz DDYITBNDTZIUBU-UHFFFAOYSA-N 1 1 231.330 3.686 20 0 BHADMO CC[N@H+](Cc1cccc(C)c1C)CC1CC1 ZINC000538733502 388715320 /nfs/dbraw/zinc/71/53/20/388715320.db2.gz YBXYPDJLVTWQEI-UHFFFAOYSA-N 1 1 217.356 3.535 20 0 BHADMO C/C(=C/c1ccccc1)C[N@H+]1CCC12CCC2 ZINC000538735136 388714963 /nfs/dbraw/zinc/71/49/63/388714963.db2.gz APURSZUMYZZDMA-OWBHPGMISA-N 1 1 227.351 3.718 20 0 BHADMO C/C(=C\c1ccccc1)C[N@H+]1CCC12CCC2 ZINC000538735137 388715252 /nfs/dbraw/zinc/71/52/52/388715252.db2.gz APURSZUMYZZDMA-WYMLVPIESA-N 1 1 227.351 3.718 20 0 BHADMO CC(C)c1ccc(C[N@@H+](C)C2CCC2)cc1 ZINC000538735272 388715185 /nfs/dbraw/zinc/71/51/85/388715185.db2.gz LZYQUFOALSXWGO-UHFFFAOYSA-N 1 1 217.356 3.794 20 0 BHADMO CCCOc1ccc(C[N@H+]2CCC23CCC3)cc1 ZINC000538735425 388714431 /nfs/dbraw/zinc/71/44/31/388714431.db2.gz WMDCGBRTESQQGI-UHFFFAOYSA-N 1 1 245.366 3.604 20 0 BHADMO CC1(C)CC[N@H+]1Cc1ccc(-c2ccccc2)o1 ZINC000538736064 388714880 /nfs/dbraw/zinc/71/48/80/388714880.db2.gz WVQYCEHAVJTTJK-UHFFFAOYSA-N 1 1 241.334 3.931 20 0 BHADMO CC[C@@H]1CCC[N@@H+](Cc2cccs2)CC1 ZINC000538736906 388715735 /nfs/dbraw/zinc/71/57/35/388715735.db2.gz NOQOUKGLCJQSNS-GFCCVEGCSA-N 1 1 223.385 3.760 20 0 BHADMO CC[C@H]1CCC[N@@H+](Cc2cccs2)CC1 ZINC000538736907 388716146 /nfs/dbraw/zinc/71/61/46/388716146.db2.gz NOQOUKGLCJQSNS-LBPRGKRZSA-N 1 1 223.385 3.760 20 0 BHADMO CCc1ccc(C[N@H+]2CCCC2(C)C)s1 ZINC000538737093 388716432 /nfs/dbraw/zinc/71/64/32/388716432.db2.gz CSJWJICWPKZGTM-UHFFFAOYSA-N 1 1 223.385 3.685 20 0 BHADMO CC[C@H](C[N@@H+](C)C1CCC1)c1ccccc1 ZINC000538737150 388715906 /nfs/dbraw/zinc/71/59/06/388715906.db2.gz IPTYPAJMJLJVJM-CYBMUJFWSA-N 1 1 217.356 3.665 20 0 BHADMO CC[C@@H](C[N@@H+](C)C1CCC1)c1ccccc1 ZINC000538737151 388716204 /nfs/dbraw/zinc/71/62/04/388716204.db2.gz IPTYPAJMJLJVJM-ZDUSSCGKSA-N 1 1 217.356 3.665 20 0 BHADMO CC1(C)CC[N@H+]1Cc1cccc2ccccc21 ZINC000538737209 388716286 /nfs/dbraw/zinc/71/62/86/388716286.db2.gz MQBZMDRBMNQIHZ-UHFFFAOYSA-N 1 1 225.335 3.824 20 0 BHADMO CC[C@@H]1CCCCC[N@H+]1Cc1ccsc1 ZINC000538737275 388716526 /nfs/dbraw/zinc/71/65/26/388716526.db2.gz SRAZMHZYNOUZDQ-CYBMUJFWSA-N 1 1 223.385 3.903 20 0 BHADMO CC[C@H]1CCCCC[N@H+]1Cc1ccsc1 ZINC000538737276 388715512 /nfs/dbraw/zinc/71/55/12/388715512.db2.gz SRAZMHZYNOUZDQ-ZDUSSCGKSA-N 1 1 223.385 3.903 20 0 BHADMO CC[C@@H]1CCCCC[N@H+]1Cc1occc1C ZINC000538737310 388716266 /nfs/dbraw/zinc/71/62/66/388716266.db2.gz VGNZZMICUFTQRJ-CYBMUJFWSA-N 1 1 221.344 3.743 20 0 BHADMO CC[C@H]1CCCCC[N@H+]1Cc1occc1C ZINC000538737311 388716381 /nfs/dbraw/zinc/71/63/81/388716381.db2.gz VGNZZMICUFTQRJ-ZDUSSCGKSA-N 1 1 221.344 3.743 20 0 BHADMO Cc1cc(C)c(C[N@H+](C)C2CCC2)cc1C ZINC000538737622 388715761 /nfs/dbraw/zinc/71/57/61/388715761.db2.gz QPIYQXCKMLCFIY-UHFFFAOYSA-N 1 1 217.356 3.596 20 0 BHADMO CCc1ccc(C[N@H+]2C[C@H](C)C[C@H]2C)s1 ZINC000538738154 388716217 /nfs/dbraw/zinc/71/62/17/388716217.db2.gz BWHPRNRLIOELCR-GHMZBOCLSA-N 1 1 223.385 3.541 20 0 BHADMO CCc1ccc(C[N@H+]2C[C@H](C)C[C@@H]2C)s1 ZINC000538738155 388716187 /nfs/dbraw/zinc/71/61/87/388716187.db2.gz BWHPRNRLIOELCR-MNOVXSKESA-N 1 1 223.385 3.541 20 0 BHADMO CCc1ccc(C[N@H+]2C[C@@H](C)C[C@@H]2C)s1 ZINC000538738156 388716198 /nfs/dbraw/zinc/71/61/98/388716198.db2.gz BWHPRNRLIOELCR-QWRGUYRKSA-N 1 1 223.385 3.541 20 0 BHADMO CCc1ccc(C[N@H+]2C[C@@H](C)C[C@H]2C)s1 ZINC000538738157 388716418 /nfs/dbraw/zinc/71/64/18/388716418.db2.gz BWHPRNRLIOELCR-WDEREUQCSA-N 1 1 223.385 3.541 20 0 BHADMO C(C1CCCCCC1)[N@H+]1CCC12CCC2 ZINC000538738207 388716259 /nfs/dbraw/zinc/71/62/59/388716259.db2.gz FPOAOARQGVVCII-UHFFFAOYSA-N 1 1 207.361 3.585 20 0 BHADMO Fc1ccc(C[C@@H]2CCCC[N@H+]2CC2CC2)cc1 ZINC000538739146 388715621 /nfs/dbraw/zinc/71/56/21/388715621.db2.gz PWALSUUJRAEOFM-INIZCTEOSA-N 1 1 247.357 3.633 20 0 BHADMO Fc1ccc(C[C@H]2CCCC[N@H+]2CC2CC2)cc1 ZINC000538739147 388716509 /nfs/dbraw/zinc/71/65/09/388716509.db2.gz PWALSUUJRAEOFM-MRXNPFEDSA-N 1 1 247.357 3.633 20 0 BHADMO Cc1ccc(C[N@H+]2CC[C@H](C3CC3)C2)cc1C ZINC000538749602 388719236 /nfs/dbraw/zinc/71/92/36/388719236.db2.gz WNIWRQLBDLPIRK-INIZCTEOSA-N 1 1 229.367 3.535 20 0 BHADMO Cc1ccc(C[N@H+]2CC[C@@H](C3CC3)C2)cc1C ZINC000538749603 388718961 /nfs/dbraw/zinc/71/89/61/388718961.db2.gz WNIWRQLBDLPIRK-MRXNPFEDSA-N 1 1 229.367 3.535 20 0 BHADMO CC[C@@]1(C)CC[N@@H+](Cc2cc(F)ccc2F)C1 ZINC000538750449 388719102 /nfs/dbraw/zinc/71/91/02/388719102.db2.gz BTTPAAOFNFTECL-AWEZNQCLSA-N 1 1 239.309 3.587 20 0 BHADMO CC[C@]1(C)CC[N@@H+](Cc2cc(F)ccc2F)C1 ZINC000538750450 388719343 /nfs/dbraw/zinc/71/93/43/388719343.db2.gz BTTPAAOFNFTECL-CQSZACIVSA-N 1 1 239.309 3.587 20 0 BHADMO CC[C@@]1(C)CC[N@@H+](Cc2c(F)cccc2F)C1 ZINC000538751045 388718866 /nfs/dbraw/zinc/71/88/66/388718866.db2.gz MYRPDGMSYYPTRQ-AWEZNQCLSA-N 1 1 239.309 3.587 20 0 BHADMO CC[C@]1(C)CC[N@@H+](Cc2c(F)cccc2F)C1 ZINC000538751046 388718689 /nfs/dbraw/zinc/71/86/89/388718689.db2.gz MYRPDGMSYYPTRQ-CQSZACIVSA-N 1 1 239.309 3.587 20 0 BHADMO Cc1ccc(C[N@H+]2CC[C@H](C3CC3)C2)c(C)c1 ZINC000538753087 388718899 /nfs/dbraw/zinc/71/88/99/388718899.db2.gz MKJYSXNOPBBYIF-INIZCTEOSA-N 1 1 229.367 3.535 20 0 BHADMO Cc1ccc(C[N@H+]2CC[C@@H](C3CC3)C2)c(C)c1 ZINC000538753088 388718185 /nfs/dbraw/zinc/71/81/85/388718185.db2.gz MKJYSXNOPBBYIF-MRXNPFEDSA-N 1 1 229.367 3.535 20 0 BHADMO C[N@H+](Cc1ccc[nH]1)C[C@@H]1CCCC(C)(C)C1 ZINC000538761929 388722095 /nfs/dbraw/zinc/72/20/95/388722095.db2.gz LXEDDKCQHNZNAN-CYBMUJFWSA-N 1 1 234.387 3.663 20 0 BHADMO C[N@H+](Cc1ccc[nH]1)C[C@H]1CCCC(C)(C)C1 ZINC000538761930 388721415 /nfs/dbraw/zinc/72/14/15/388721415.db2.gz LXEDDKCQHNZNAN-ZDUSSCGKSA-N 1 1 234.387 3.663 20 0 BHADMO CCC(CC)[N@H+](Cc1cccn1C)CC(C)C ZINC000538763593 388721584 /nfs/dbraw/zinc/72/15/84/388721584.db2.gz LXQLEGLOVUYREQ-UHFFFAOYSA-N 1 1 236.403 3.672 20 0 BHADMO CC[C@H]1CC[N@@H+](Cc2ccc(OC(C)C)cc2)C1 ZINC000538791433 388725769 /nfs/dbraw/zinc/72/57/69/388725769.db2.gz YMDKBIFHRCDNGD-AWEZNQCLSA-N 1 1 247.382 3.706 20 0 BHADMO CC[C@@H]1CC[N@@H+](Cc2ccc(OC(C)C)cc2)C1 ZINC000538791434 388725386 /nfs/dbraw/zinc/72/53/86/388725386.db2.gz YMDKBIFHRCDNGD-CQSZACIVSA-N 1 1 247.382 3.706 20 0 BHADMO CC(C)Oc1ccc(C[N@H+]2CC[C@H](C)[C@@H]2C)cc1 ZINC000538792370 388725254 /nfs/dbraw/zinc/72/52/54/388725254.db2.gz QDSCWWURFLNJQH-KBPBESRZSA-N 1 1 247.382 3.704 20 0 BHADMO CC(C)Oc1ccc(C[N@H+]2CC[C@@H](C)[C@@H]2C)cc1 ZINC000538792371 388725878 /nfs/dbraw/zinc/72/58/78/388725878.db2.gz QDSCWWURFLNJQH-KGLIPLIRSA-N 1 1 247.382 3.704 20 0 BHADMO CC(C)Oc1ccc(C[N@H+]2CC[C@H](C)[C@H]2C)cc1 ZINC000538792372 388725112 /nfs/dbraw/zinc/72/51/12/388725112.db2.gz QDSCWWURFLNJQH-UONOGXRCSA-N 1 1 247.382 3.704 20 0 BHADMO CC(C)Oc1ccc(C[N@H+]2CC[C@@H](C)[C@H]2C)cc1 ZINC000538792373 388726173 /nfs/dbraw/zinc/72/61/73/388726173.db2.gz QDSCWWURFLNJQH-ZIAGYGMSSA-N 1 1 247.382 3.704 20 0 BHADMO CCCOc1cccc(C[N@@H+](C)CCC2CC2)c1 ZINC000538797652 388725715 /nfs/dbraw/zinc/72/57/15/388725715.db2.gz RNLPMOSNFHIPBN-UHFFFAOYSA-N 1 1 247.382 3.707 20 0 BHADMO CC(C)(C)C1=CC[N@@H+](Cc2cccc(O)c2)CC1 ZINC000538799587 388727367 /nfs/dbraw/zinc/72/73/67/388727367.db2.gz NBPDNFZBOOWRPU-UHFFFAOYSA-N 1 1 245.366 3.570 20 0 BHADMO CCCCC[C@@H]1CCC[N@H+]1Cc1ccco1 ZINC000538800104 388727190 /nfs/dbraw/zinc/72/71/90/388727190.db2.gz OSTNYMYZCZCCLV-CYBMUJFWSA-N 1 1 221.344 3.824 20 0 BHADMO CCCCC[C@H]1CCC[N@H+]1Cc1ccco1 ZINC000538800105 388726649 /nfs/dbraw/zinc/72/66/49/388726649.db2.gz OSTNYMYZCZCCLV-ZDUSSCGKSA-N 1 1 221.344 3.824 20 0 BHADMO C[C@@H]1CC[C@H](C)[N@@H+]1Cc1ccc(Cl)s1 ZINC000538807991 388728419 /nfs/dbraw/zinc/72/84/19/388728419.db2.gz POXMAGHSVOCAOC-DTORHVGOSA-N 1 1 229.776 3.774 20 0 BHADMO CC[C@@H]1CC[N@@H+](C/C=C\c2ccc(F)cc2)C1 ZINC000538811642 388728602 /nfs/dbraw/zinc/72/86/02/388728602.db2.gz ZAYUHCGCJMFGED-DHCBQETCSA-N 1 1 233.330 3.571 20 0 BHADMO CC[C@@H]1CC[N@@H+](C/C=C/c2ccc(F)cc2)C1 ZINC000538811643 388729074 /nfs/dbraw/zinc/72/90/74/388729074.db2.gz ZAYUHCGCJMFGED-ITDFMYJTSA-N 1 1 233.330 3.571 20 0 BHADMO CC[C@H]1CC[N@@H+](C/C=C/c2ccc(F)cc2)C1 ZINC000538811644 388728234 /nfs/dbraw/zinc/72/82/34/388728234.db2.gz ZAYUHCGCJMFGED-OOPCZODUSA-N 1 1 233.330 3.571 20 0 BHADMO CC[C@H]1CC[N@@H+](C/C=C\c2ccc(F)cc2)C1 ZINC000538811645 388728797 /nfs/dbraw/zinc/72/87/97/388728797.db2.gz ZAYUHCGCJMFGED-SCOBNMCVSA-N 1 1 233.330 3.571 20 0 BHADMO Cc1ccc(C[N@@H+]2CC[C@@H](C(C)C)C2)s1 ZINC000538812408 388728773 /nfs/dbraw/zinc/72/87/73/388728773.db2.gz NVTMMLCGWZNCFN-GFCCVEGCSA-N 1 1 223.385 3.534 20 0 BHADMO Cc1ccc(C[N@@H+]2CC[C@H](C(C)C)C2)s1 ZINC000538812409 388728135 /nfs/dbraw/zinc/72/81/35/388728135.db2.gz NVTMMLCGWZNCFN-LBPRGKRZSA-N 1 1 223.385 3.534 20 0 BHADMO CC(C)[C@H]1CC[N@@H+](Cc2cccc3cc[nH]c32)C1 ZINC000538812713 388728112 /nfs/dbraw/zinc/72/81/12/388728112.db2.gz CJMYMJVWIIAFRR-AWEZNQCLSA-N 1 1 242.366 3.646 20 0 BHADMO CC(C)[C@@H]1CC[N@@H+](Cc2cccc3cc[nH]c32)C1 ZINC000538812714 388729152 /nfs/dbraw/zinc/72/91/52/388729152.db2.gz CJMYMJVWIIAFRR-CQSZACIVSA-N 1 1 242.366 3.646 20 0 BHADMO C[C@H]([N@@H+](C)C[C@@H]1C[C@@H]1c1ccccc1)C1(C)CC1 ZINC000538812914 388728910 /nfs/dbraw/zinc/72/89/10/388728910.db2.gz PFNUZKLBIGHEAL-CWRNSKLLSA-N 1 1 243.394 3.911 20 0 BHADMO C[C@H]([N@@H+](C)C[C@H]1C[C@H]1c1ccccc1)C1(C)CC1 ZINC000538812915 388728997 /nfs/dbraw/zinc/72/89/97/388728997.db2.gz PFNUZKLBIGHEAL-IMJJTQAJSA-N 1 1 243.394 3.911 20 0 BHADMO C[C@H]([N@@H+](C)C[C@H]1C[C@@H]1c1ccccc1)C1(C)CC1 ZINC000538812916 388728977 /nfs/dbraw/zinc/72/89/77/388728977.db2.gz PFNUZKLBIGHEAL-NUEKZKHPSA-N 1 1 243.394 3.911 20 0 BHADMO CC[C@@H]1CC[N@@H+](C[C@H]2C[C@H]2c2ccccc2)C1 ZINC000538813008 388728928 /nfs/dbraw/zinc/72/89/28/388728928.db2.gz VPBQZHKYHZWUDM-BMFZPTHFSA-N 1 1 229.367 3.522 20 0 BHADMO CC[C@@H]1CC[N@@H+](C[C@H]2C[C@@H]2c2ccccc2)C1 ZINC000538813009 388729171 /nfs/dbraw/zinc/72/91/71/388729171.db2.gz VPBQZHKYHZWUDM-FVQBIDKESA-N 1 1 229.367 3.522 20 0 BHADMO CC[C@@H]1CC[N@@H+](C[C@@H]2C[C@@H]2c2ccccc2)C1 ZINC000538813010 384645323 /nfs/dbraw/zinc/64/53/23/384645323.db2.gz VPBQZHKYHZWUDM-VNQPRFMTSA-N 1 1 229.367 3.522 20 0 BHADMO C[C@@H]([N@@H+](C)C/C=C\c1ccc(F)cc1)C1(C)CC1 ZINC000538813179 388729028 /nfs/dbraw/zinc/72/90/28/388729028.db2.gz FZMOQKMJSISMAZ-DSYXLKISSA-N 1 1 247.357 3.959 20 0 BHADMO C[C@H]([N@@H+](C)C/C=C/c1ccc(F)cc1)C1(C)CC1 ZINC000538813180 388729022 /nfs/dbraw/zinc/72/90/22/388729022.db2.gz FZMOQKMJSISMAZ-IHVVCDCBSA-N 1 1 247.357 3.959 20 0 BHADMO C[C@@H]([N@@H+](C)C/C=C/c1ccc(F)cc1)C1(C)CC1 ZINC000538813181 388728546 /nfs/dbraw/zinc/72/85/46/388728546.db2.gz FZMOQKMJSISMAZ-MUBLQREKSA-N 1 1 247.357 3.959 20 0 BHADMO C[C@H]([N@@H+](C)C/C=C\c1ccc(F)cc1)C1(C)CC1 ZINC000538813182 388728870 /nfs/dbraw/zinc/72/88/70/388728870.db2.gz FZMOQKMJSISMAZ-ZFDPJTLLSA-N 1 1 247.357 3.959 20 0 BHADMO C[C@]1(F)CC[N@@H+](Cc2cc3ccccc3s2)C1 ZINC000538823938 388730107 /nfs/dbraw/zinc/73/01/07/388730107.db2.gz SYDQSHFJKULTBZ-AWEZNQCLSA-N 1 1 249.354 3.835 20 0 BHADMO C[C@@]1(F)CC[N@@H+](Cc2cc3ccccc3s2)C1 ZINC000538823939 388729398 /nfs/dbraw/zinc/72/93/98/388729398.db2.gz SYDQSHFJKULTBZ-CQSZACIVSA-N 1 1 249.354 3.835 20 0 BHADMO C[C@H](C[N@H+]1CC[C@@H](C)C2(CCC2)C1)C(F)(F)F ZINC000538942873 388741758 /nfs/dbraw/zinc/74/17/58/388741758.db2.gz NHAJEEVBWOPTHW-GHMZBOCLSA-N 1 1 249.320 3.697 20 0 BHADMO C[C@@H](C[N@H+]1CC[C@@H](C)C2(CCC2)C1)C(F)(F)F ZINC000538942885 388741858 /nfs/dbraw/zinc/74/18/58/388741858.db2.gz NHAJEEVBWOPTHW-MNOVXSKESA-N 1 1 249.320 3.697 20 0 BHADMO C[C@@H](C[N@H+]1CC[C@H](C)C2(CCC2)C1)C(F)(F)F ZINC000538942886 388742259 /nfs/dbraw/zinc/74/22/59/388742259.db2.gz NHAJEEVBWOPTHW-QWRGUYRKSA-N 1 1 249.320 3.697 20 0 BHADMO C[C@H](C[N@H+]1CC[C@H](C)C2(CCC2)C1)C(F)(F)F ZINC000538942887 388742620 /nfs/dbraw/zinc/74/26/20/388742620.db2.gz NHAJEEVBWOPTHW-WDEREUQCSA-N 1 1 249.320 3.697 20 0 BHADMO C[C@@H]1CCC[C@@H](C[N@@H+](CC(F)F)C2CC2)C1 ZINC000538954310 388741766 /nfs/dbraw/zinc/74/17/66/388741766.db2.gz VDHWMVQPWHXNHF-GHMZBOCLSA-N 1 1 231.330 3.542 20 0 BHADMO C[C@@H]1CCC[C@@H](C[N@H+](CC(F)F)C2CC2)C1 ZINC000538954310 388741763 /nfs/dbraw/zinc/74/17/63/388741763.db2.gz VDHWMVQPWHXNHF-GHMZBOCLSA-N 1 1 231.330 3.542 20 0 BHADMO C[C@@H]1CCC[C@H](C[N@@H+](CC(F)F)C2CC2)C1 ZINC000538954311 388741891 /nfs/dbraw/zinc/74/18/91/388741891.db2.gz VDHWMVQPWHXNHF-MNOVXSKESA-N 1 1 231.330 3.542 20 0 BHADMO C[C@@H]1CCC[C@H](C[N@H+](CC(F)F)C2CC2)C1 ZINC000538954311 388741890 /nfs/dbraw/zinc/74/18/90/388741890.db2.gz VDHWMVQPWHXNHF-MNOVXSKESA-N 1 1 231.330 3.542 20 0 BHADMO C[C@H]1CCC[C@H](C[N@@H+](CC(F)F)C2CC2)C1 ZINC000538954312 388742036 /nfs/dbraw/zinc/74/20/36/388742036.db2.gz VDHWMVQPWHXNHF-QWRGUYRKSA-N 1 1 231.330 3.542 20 0 BHADMO C[C@H]1CCC[C@H](C[N@H+](CC(F)F)C2CC2)C1 ZINC000538954312 388742035 /nfs/dbraw/zinc/74/20/35/388742035.db2.gz VDHWMVQPWHXNHF-QWRGUYRKSA-N 1 1 231.330 3.542 20 0 BHADMO C[C@H]1CCC[C@@H](C[N@@H+](CC(F)F)C2CC2)C1 ZINC000538954314 388742533 /nfs/dbraw/zinc/74/25/33/388742533.db2.gz VDHWMVQPWHXNHF-WDEREUQCSA-N 1 1 231.330 3.542 20 0 BHADMO C[C@H]1CCC[C@@H](C[N@H+](CC(F)F)C2CC2)C1 ZINC000538954314 388742530 /nfs/dbraw/zinc/74/25/30/388742530.db2.gz VDHWMVQPWHXNHF-WDEREUQCSA-N 1 1 231.330 3.542 20 0 BHADMO CC[C@@H]1CC[C@@H](C)[N@H+]1CCCCC(F)(F)F ZINC000538955261 388742416 /nfs/dbraw/zinc/74/24/16/388742416.db2.gz RICJIOKCZOBDGW-GHMZBOCLSA-N 1 1 237.309 3.982 20 0 BHADMO CC[C@H]1CC[C@@H](C)[N@H+]1CCCCC(F)(F)F ZINC000538955264 388742411 /nfs/dbraw/zinc/74/24/11/388742411.db2.gz RICJIOKCZOBDGW-MNOVXSKESA-N 1 1 237.309 3.982 20 0 BHADMO CC[C@H]1CC[C@H](C)[N@H+]1CCCCC(F)(F)F ZINC000538955265 388742664 /nfs/dbraw/zinc/74/26/64/388742664.db2.gz RICJIOKCZOBDGW-QWRGUYRKSA-N 1 1 237.309 3.982 20 0 BHADMO CC[C@@H]1CC[C@H](C)[N@H+]1CCCCC(F)(F)F ZINC000538955266 388742185 /nfs/dbraw/zinc/74/21/85/388742185.db2.gz RICJIOKCZOBDGW-WDEREUQCSA-N 1 1 237.309 3.982 20 0 BHADMO CC[C@@H]1CC[C@H](C)[N@H+]1Cc1ccc(F)c(F)c1 ZINC000538955639 388741863 /nfs/dbraw/zinc/74/18/63/388741863.db2.gz UBNVGVSXRZCABN-CMPLNLGQSA-N 1 1 239.309 3.728 20 0 BHADMO CC[C@H]1CC[C@H](C)[N@H+]1Cc1ccc(F)c(F)c1 ZINC000538955641 388742264 /nfs/dbraw/zinc/74/22/64/388742264.db2.gz UBNVGVSXRZCABN-JQWIXIFHSA-N 1 1 239.309 3.728 20 0 BHADMO CC[C@H]1CC[C@@H](C)[N@H+]1Cc1ccc(F)c(F)c1 ZINC000538955642 388741809 /nfs/dbraw/zinc/74/18/09/388741809.db2.gz UBNVGVSXRZCABN-PWSUYJOCSA-N 1 1 239.309 3.728 20 0 BHADMO CC[C@@H]1CC[C@@H](C)[N@H+]1Cc1ccc(F)c(F)c1 ZINC000538955643 388742626 /nfs/dbraw/zinc/74/26/26/388742626.db2.gz UBNVGVSXRZCABN-ZYHUDNBSSA-N 1 1 239.309 3.728 20 0 BHADMO CC[C@@H]1CC[C@@H](C)[N@H+]1Cc1ccc(F)cc1 ZINC000538955914 388741774 /nfs/dbraw/zinc/74/17/74/388741774.db2.gz LUTAGXCOCAYBPQ-BXUZGUMPSA-N 1 1 221.319 3.589 20 0 BHADMO CC[C@H]1CC[C@H](C)[N@H+]1Cc1ccc(F)cc1 ZINC000538955923 388742580 /nfs/dbraw/zinc/74/25/80/388742580.db2.gz LUTAGXCOCAYBPQ-FZMZJTMJSA-N 1 1 221.319 3.589 20 0 BHADMO CC[C@H]1CC[C@@H](C)[N@H+]1Cc1ccc(F)cc1 ZINC000538955924 388742315 /nfs/dbraw/zinc/74/23/15/388742315.db2.gz LUTAGXCOCAYBPQ-RISCZKNCSA-N 1 1 221.319 3.589 20 0 BHADMO CC[C@@H]1CC[C@H](C)[N@H+]1Cc1ccc(F)cc1 ZINC000538955925 388742396 /nfs/dbraw/zinc/74/23/96/388742396.db2.gz LUTAGXCOCAYBPQ-SMDDNHRTSA-N 1 1 221.319 3.589 20 0 BHADMO CC[N@H+]1CCc2cc(Cl)c(Cl)cc2[C@H]1C ZINC000538957115 388741937 /nfs/dbraw/zinc/74/19/37/388741937.db2.gz NCVIWORZWRRPAL-MRVPVSSYSA-N 1 1 244.165 3.932 20 0 BHADMO CC[N@@H+]1CCc2cc(Cl)c(Cl)cc2[C@H]1C ZINC000538957115 388741936 /nfs/dbraw/zinc/74/19/36/388741936.db2.gz NCVIWORZWRRPAL-MRVPVSSYSA-N 1 1 244.165 3.932 20 0 BHADMO CC[N@H+]1CCc2cc(Cl)c(Cl)cc2[C@@H]1C ZINC000538957116 388742041 /nfs/dbraw/zinc/74/20/41/388742041.db2.gz NCVIWORZWRRPAL-QMMMGPOBSA-N 1 1 244.165 3.932 20 0 BHADMO CC[N@@H+]1CCc2cc(Cl)c(Cl)cc2[C@@H]1C ZINC000538957116 388742040 /nfs/dbraw/zinc/74/20/40/388742040.db2.gz NCVIWORZWRRPAL-QMMMGPOBSA-N 1 1 244.165 3.932 20 0 BHADMO CC[C@H]1CC[C@H](C)[N@H+]1Cc1ccc(F)cc1F ZINC000538957277 388742216 /nfs/dbraw/zinc/74/22/16/388742216.db2.gz USSJPJKUJMULOF-GWCFXTLKSA-N 1 1 239.309 3.728 20 0 BHADMO CC[C@@H]1CC[C@H](C)[N@H+]1Cc1ccc(F)cc1F ZINC000538957278 388741714 /nfs/dbraw/zinc/74/17/14/388741714.db2.gz USSJPJKUJMULOF-GXFFZTMASA-N 1 1 239.309 3.728 20 0 BHADMO CC[C@H]1CC[C@@H](C)[N@H+]1Cc1ccc(F)cc1F ZINC000538957279 388742025 /nfs/dbraw/zinc/74/20/25/388742025.db2.gz USSJPJKUJMULOF-MFKMUULPSA-N 1 1 239.309 3.728 20 0 BHADMO CC[C@@H]1CC[C@@H](C)[N@H+]1Cc1ccc(F)cc1F ZINC000538957280 388742746 /nfs/dbraw/zinc/74/27/46/388742746.db2.gz USSJPJKUJMULOF-ZWNOBZJWSA-N 1 1 239.309 3.728 20 0 BHADMO Cc1cccnc1C[N@H+]1CCCC12CCCCC2 ZINC000538959951 388741842 /nfs/dbraw/zinc/74/18/42/388741842.db2.gz BTJHKSUQNREXOX-UHFFFAOYSA-N 1 1 244.382 3.689 20 0 BHADMO Cc1cccnc1C[N@@H+]1CCC[C@H](C(C)C)CC1 ZINC000538964509 388742695 /nfs/dbraw/zinc/74/26/95/388742695.db2.gz DAXFOLPDXOLHIJ-HNNXBMFYSA-N 1 1 246.398 3.648 20 0 BHADMO Cc1cccnc1C[N@@H+]1CCC[C@@H](C(C)C)CC1 ZINC000538964510 388742343 /nfs/dbraw/zinc/74/23/43/388742343.db2.gz DAXFOLPDXOLHIJ-OAHLLOKOSA-N 1 1 246.398 3.648 20 0 BHADMO Cc1cccnc1C[N@@H+]1CCC[C@@H](CC(C)C)C1 ZINC000538966603 388743837 /nfs/dbraw/zinc/74/38/37/388743837.db2.gz UHQBZDVIJTTZFL-HNNXBMFYSA-N 1 1 246.398 3.648 20 0 BHADMO Cc1cccnc1C[N@@H+]1CCC[C@H](CC(C)C)C1 ZINC000538966604 388743057 /nfs/dbraw/zinc/74/30/57/388743057.db2.gz UHQBZDVIJTTZFL-OAHLLOKOSA-N 1 1 246.398 3.648 20 0 BHADMO Fc1ccc(CC[N@@H+](C2CC2)C2CCCC2)cc1 ZINC000538967325 388743353 /nfs/dbraw/zinc/74/33/53/388743353.db2.gz FHUTYMCJPWMXFH-UHFFFAOYSA-N 1 1 247.357 3.775 20 0 BHADMO CC[C@H](C)[C@@H]1CCCC[N@H+]1Cc1ncccc1C ZINC000538968550 388742961 /nfs/dbraw/zinc/74/29/61/388742961.db2.gz TYABJTZYLUFUBB-BBRMVZONSA-N 1 1 246.398 3.791 20 0 BHADMO CC[C@@H](C)[C@@H]1CCCC[N@H+]1Cc1ncccc1C ZINC000538968562 388743179 /nfs/dbraw/zinc/74/31/79/388743179.db2.gz TYABJTZYLUFUBB-CJNGLKHVSA-N 1 1 246.398 3.791 20 0 BHADMO CC[C@@H](C)[C@H]1CCCC[N@H+]1Cc1ncccc1C ZINC000538968564 388743103 /nfs/dbraw/zinc/74/31/03/388743103.db2.gz TYABJTZYLUFUBB-CZUORRHYSA-N 1 1 246.398 3.791 20 0 BHADMO CC[C@H](C)[C@H]1CCCC[N@H+]1Cc1ncccc1C ZINC000538968566 388743865 /nfs/dbraw/zinc/74/38/65/388743865.db2.gz TYABJTZYLUFUBB-XJKSGUPXSA-N 1 1 246.398 3.791 20 0 BHADMO CCCCC[C@H]1CCC[N@H+]1Cc1ncccc1C ZINC000538968719 388743039 /nfs/dbraw/zinc/74/30/39/388743039.db2.gz VNCDUAUCUAKPNM-HNNXBMFYSA-N 1 1 246.398 3.935 20 0 BHADMO CCCCC[C@@H]1CCC[N@H+]1Cc1ncccc1C ZINC000538968730 388743096 /nfs/dbraw/zinc/74/30/96/388743096.db2.gz VNCDUAUCUAKPNM-OAHLLOKOSA-N 1 1 246.398 3.935 20 0 BHADMO C[C@@H](c1c(F)cccc1F)[N@@H+](C)C1CCCC1 ZINC000538970095 388743421 /nfs/dbraw/zinc/74/34/21/388743421.db2.gz WPMWSBBEZUUOIO-JTQLQIEISA-N 1 1 239.309 3.900 20 0 BHADMO C[C@H](c1c(F)cccc1F)[N@@H+](C)C1CCCC1 ZINC000538970096 388743558 /nfs/dbraw/zinc/74/35/58/388743558.db2.gz WPMWSBBEZUUOIO-SNVBAGLBSA-N 1 1 239.309 3.900 20 0 BHADMO Fc1ccc([C@@H]2CCC[N@H+]2C2CCCC2)cc1 ZINC000538979517 388743855 /nfs/dbraw/zinc/74/38/55/388743855.db2.gz YIEAJJBRKMMEJQ-HNNXBMFYSA-N 1 1 233.330 3.905 20 0 BHADMO Fc1ccc([C@H]2CCC[N@H+]2C2CCCC2)cc1 ZINC000538979523 388743444 /nfs/dbraw/zinc/74/34/44/388743444.db2.gz YIEAJJBRKMMEJQ-OAHLLOKOSA-N 1 1 233.330 3.905 20 0 BHADMO C[N@@H+](C1CCCC1)[C@H]1CCCc2ccccc21 ZINC000538980281 388743725 /nfs/dbraw/zinc/74/37/25/388743725.db2.gz PSBTXBNMXFFFPE-INIZCTEOSA-N 1 1 229.367 3.938 20 0 BHADMO C[N@@H+](C1CCCC1)[C@@H]1CCCc2ccccc21 ZINC000538980284 388743798 /nfs/dbraw/zinc/74/37/98/388743798.db2.gz PSBTXBNMXFFFPE-MRXNPFEDSA-N 1 1 229.367 3.938 20 0 BHADMO CCC[C@H](C)[C@H](CC)[NH2+][C@@H]1CCCc2c[nH]nc21 ZINC000539061112 388746485 /nfs/dbraw/zinc/74/64/85/388746485.db2.gz YTZVYRPKGBAGRJ-FPMFFAJLSA-N 1 1 249.402 3.592 20 0 BHADMO CCC[C@H](C)[C@@H](CC)[NH2+][C@@H]1CCCc2c[nH]nc21 ZINC000539061113 388746341 /nfs/dbraw/zinc/74/63/41/388746341.db2.gz YTZVYRPKGBAGRJ-IACUBPJLSA-N 1 1 249.402 3.592 20 0 BHADMO CCC[C@H](C)[C@H](CC)[NH2+][C@H]1CCCc2c[nH]nc21 ZINC000539061115 384193419 /nfs/dbraw/zinc/19/34/19/384193419.db2.gz YTZVYRPKGBAGRJ-UBHSHLNASA-N 1 1 249.402 3.592 20 0 BHADMO CCC[C@H](C)[C@@H](CC)[NH2+][C@H]1CCCc2c[nH]nc21 ZINC000539061116 384194529 /nfs/dbraw/zinc/19/45/29/384194529.db2.gz YTZVYRPKGBAGRJ-YUTCNCBUSA-N 1 1 249.402 3.592 20 0 BHADMO CC[C@@H](CSC)[N@@H+](C)Cc1cccc(C)c1 ZINC000539098124 388747818 /nfs/dbraw/zinc/74/78/18/388747818.db2.gz FTTMFLJJKSYVCD-AWEZNQCLSA-N 1 1 237.412 3.568 20 0 BHADMO CC[C@H](CSC)[N@@H+](C)Cc1cccc(C)c1 ZINC000539098125 388748286 /nfs/dbraw/zinc/74/82/86/388748286.db2.gz FTTMFLJJKSYVCD-CQSZACIVSA-N 1 1 237.412 3.568 20 0 BHADMO CC[C@@H](CSC)[N@@H+](C)Cc1ccccc1C ZINC000539098469 388747860 /nfs/dbraw/zinc/74/78/60/388747860.db2.gz PGSGMYSUZOISGP-AWEZNQCLSA-N 1 1 237.412 3.568 20 0 BHADMO CC[C@H](CSC)[N@@H+](C)Cc1ccccc1C ZINC000539098470 388748281 /nfs/dbraw/zinc/74/82/81/388748281.db2.gz PGSGMYSUZOISGP-CQSZACIVSA-N 1 1 237.412 3.568 20 0 BHADMO CCCC[N@@H+](CCCO)[C@@H](C)c1cccc(C)c1 ZINC000539324165 388753725 /nfs/dbraw/zinc/75/37/25/388753725.db2.gz HGAMXVONVUURHY-HNNXBMFYSA-N 1 1 249.398 3.541 20 0 BHADMO CCCC[N@@H+](CCCO)[C@H](C)c1cccc(C)c1 ZINC000539324166 388753528 /nfs/dbraw/zinc/75/35/28/388753528.db2.gz HGAMXVONVUURHY-OAHLLOKOSA-N 1 1 249.398 3.541 20 0 BHADMO CCC[N@@H+](Cc1ccc(CC)s1)C1CC1 ZINC000539401116 388756704 /nfs/dbraw/zinc/75/67/04/388756704.db2.gz LPSDCOCABICDCM-UHFFFAOYSA-N 1 1 223.385 3.685 20 0 BHADMO Cc1ccc(C[N@@H+]2CC[C@H]2C(C)C)c(C)c1 ZINC000539401561 388756425 /nfs/dbraw/zinc/75/64/25/388756425.db2.gz XPUIRMUISOAJFR-HNNXBMFYSA-N 1 1 217.356 3.534 20 0 BHADMO Cc1ccc(C[N@@H+]2CC[C@@H]2C(C)C)c(C)c1 ZINC000539401562 388757412 /nfs/dbraw/zinc/75/74/12/388757412.db2.gz XPUIRMUISOAJFR-OAHLLOKOSA-N 1 1 217.356 3.534 20 0 BHADMO CC(C)[C@H]1CC[N@H+]1Cc1ccc(Cl)c(F)c1 ZINC000539401966 388756800 /nfs/dbraw/zinc/75/68/00/388756800.db2.gz HKMXKXZJIBQMPM-CYBMUJFWSA-N 1 1 241.737 3.709 20 0 BHADMO CC(C)[C@@H]1CC[N@H+]1Cc1ccc(Cl)c(F)c1 ZINC000539401967 388757169 /nfs/dbraw/zinc/75/71/69/388757169.db2.gz HKMXKXZJIBQMPM-ZDUSSCGKSA-N 1 1 241.737 3.709 20 0 BHADMO CC(C)[C@H]1CC[N@H+]1C/C=C\c1ccc(F)cc1 ZINC000539402305 388757044 /nfs/dbraw/zinc/75/70/44/388757044.db2.gz GHRYKYRZBZOBRK-ABCZVMIZSA-N 1 1 233.330 3.569 20 0 BHADMO CC(C)[C@@H]1CC[N@H+]1C/C=C/c1ccc(F)cc1 ZINC000539402306 388756652 /nfs/dbraw/zinc/75/66/52/388756652.db2.gz GHRYKYRZBZOBRK-BWPKMQGJSA-N 1 1 233.330 3.569 20 0 BHADMO CC(C)[C@@H]1CC[N@H+]1C/C=C\c1ccc(F)cc1 ZINC000539402307 388757132 /nfs/dbraw/zinc/75/71/32/388757132.db2.gz GHRYKYRZBZOBRK-JZIMQPMSSA-N 1 1 233.330 3.569 20 0 BHADMO CC(C)[C@H]1CC[N@H+]1C/C=C/c1ccc(F)cc1 ZINC000539402308 388757452 /nfs/dbraw/zinc/75/74/52/388757452.db2.gz GHRYKYRZBZOBRK-NHZBNJEXSA-N 1 1 233.330 3.569 20 0 BHADMO CC(C)Oc1cccc(C[N@H+]2CC[C@H]2C(C)C)c1 ZINC000539403131 388757352 /nfs/dbraw/zinc/75/73/52/388757352.db2.gz JKMRMAIOBSMNRY-INIZCTEOSA-N 1 1 247.382 3.704 20 0 BHADMO CC(C)Oc1cccc(C[N@H+]2CC[C@@H]2C(C)C)c1 ZINC000539403132 388756358 /nfs/dbraw/zinc/75/63/58/388756358.db2.gz JKMRMAIOBSMNRY-MRXNPFEDSA-N 1 1 247.382 3.704 20 0 BHADMO CC(C)[C@H]1CC[N@H+]1Cc1cc(Cl)ccc1F ZINC000539403891 388757524 /nfs/dbraw/zinc/75/75/24/388757524.db2.gz YKZYBEMUQFMKFS-CYBMUJFWSA-N 1 1 241.737 3.709 20 0 BHADMO CC(C)[C@H]1CC[N@@H+]1Cc1cc(Cl)ccc1F ZINC000539403891 388757522 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ZINC000539406110 388756095 /nfs/dbraw/zinc/75/60/95/388756095.db2.gz DMXCCAUYDLTLSG-ZDUSSCGKSA-N 1 1 247.382 3.673 20 0 BHADMO CCC[C@@H](C)C[N@@H+](C)Cc1cccc(OC)c1 ZINC000539407484 388756824 /nfs/dbraw/zinc/75/68/24/388756824.db2.gz IBYNEVXWENMCTH-CYBMUJFWSA-N 1 1 235.371 3.563 20 0 BHADMO CCC[C@H](C)C[N@@H+](C)Cc1cccc(OC)c1 ZINC000539407486 388756995 /nfs/dbraw/zinc/75/69/95/388756995.db2.gz IBYNEVXWENMCTH-ZDUSSCGKSA-N 1 1 235.371 3.563 20 0 BHADMO CC(C)COc1cccc(C[N@@H+](C)C(C)C)c1 ZINC000539408999 388758725 /nfs/dbraw/zinc/75/87/25/388758725.db2.gz VPEGNEMFJBNTRD-UHFFFAOYSA-N 1 1 235.371 3.562 20 0 BHADMO COc1ccc([C@@H](C)C[N@H+]2CCCC[C@@H]2C)cc1 ZINC000539409346 388758756 /nfs/dbraw/zinc/75/87/56/388758756.db2.gz SFZQBRBBAXGVIQ-KBPBESRZSA-N 1 1 247.382 3.673 20 0 BHADMO COc1ccc([C@H](C)C[N@H+]2CCCC[C@@H]2C)cc1 ZINC000539409347 388758855 /nfs/dbraw/zinc/75/88/55/388758855.db2.gz SFZQBRBBAXGVIQ-KGLIPLIRSA-N 1 1 247.382 3.673 20 0 BHADMO COc1ccc([C@@H](C)C[N@H+]2CCCC[C@H]2C)cc1 ZINC000539409348 388758845 /nfs/dbraw/zinc/75/88/45/388758845.db2.gz SFZQBRBBAXGVIQ-UONOGXRCSA-N 1 1 247.382 3.673 20 0 BHADMO COc1ccc([C@H](C)C[N@H+]2CCCC[C@H]2C)cc1 ZINC000539409349 388758656 /nfs/dbraw/zinc/75/86/56/388758656.db2.gz SFZQBRBBAXGVIQ-ZIAGYGMSSA-N 1 1 247.382 3.673 20 0 BHADMO CCCC[N@@H+](C)C[C@@H](C)c1ccc(OC)cc1 ZINC000539409484 388757924 /nfs/dbraw/zinc/75/79/24/388757924.db2.gz CGVUCOXVGVPCSV-CYBMUJFWSA-N 1 1 235.371 3.531 20 0 BHADMO CCCC[N@@H+](C)C[C@H](C)c1ccc(OC)cc1 ZINC000539409485 388758620 /nfs/dbraw/zinc/75/86/20/388758620.db2.gz CGVUCOXVGVPCSV-ZDUSSCGKSA-N 1 1 235.371 3.531 20 0 BHADMO CCC[C@@H](C)C[N@@H+](C)Cc1cccs1 ZINC000539409539 388757831 /nfs/dbraw/zinc/75/78/31/388757831.db2.gz JFKYOOGJRQXFQP-LLVKDONJSA-N 1 1 211.374 3.616 20 0 BHADMO CCC[C@H](C)C[N@@H+](C)Cc1cccs1 ZINC000539409540 388759144 /nfs/dbraw/zinc/75/91/44/388759144.db2.gz JFKYOOGJRQXFQP-NSHDSACASA-N 1 1 211.374 3.616 20 0 BHADMO CCC[N@@H+](CCCSCC(C)C)C1CC1 ZINC000539425090 388758560 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/nfs/dbraw/zinc/78/49/45/388784945.db2.gz CJSVESVQAHYQIY-CYBMUJFWSA-N 1 1 223.385 3.679 20 0 BHADMO CC[C@@]1(C)CC[N@@H+](Cc2sccc2C)C1 ZINC000539862056 388785184 /nfs/dbraw/zinc/78/51/84/388785184.db2.gz CJSVESVQAHYQIY-ZDUSSCGKSA-N 1 1 223.385 3.679 20 0 BHADMO CC[C@@H](C)C[N@@H+](CC)Cc1sccc1OC ZINC000539862936 388785993 /nfs/dbraw/zinc/78/59/93/388785993.db2.gz OGWFYTGYZRPMTE-LLVKDONJSA-N 1 1 241.400 3.625 20 0 BHADMO CC[C@H](C)C[N@@H+](CC)Cc1sccc1OC ZINC000539862937 388785482 /nfs/dbraw/zinc/78/54/82/388785482.db2.gz OGWFYTGYZRPMTE-NSHDSACASA-N 1 1 241.400 3.625 20 0 BHADMO CCC[C@H](C)[C@@H]1CCC[N@H+]1Cc1cccc(O)c1 ZINC000539863456 388785446 /nfs/dbraw/zinc/78/54/46/388785446.db2.gz YGYOAENBCDQTAN-BBRMVZONSA-N 1 1 247.382 3.793 20 0 BHADMO CCC[C@@H](C)[C@@H]1CCC[N@H+]1Cc1cccc(O)c1 ZINC000539863457 388784924 /nfs/dbraw/zinc/78/49/24/388784924.db2.gz YGYOAENBCDQTAN-CJNGLKHVSA-N 1 1 247.382 3.793 20 0 BHADMO CCC[C@@H](C)[C@H]1CCC[N@H+]1Cc1cccc(O)c1 ZINC000539863458 388785190 /nfs/dbraw/zinc/78/51/90/388785190.db2.gz YGYOAENBCDQTAN-CZUORRHYSA-N 1 1 247.382 3.793 20 0 BHADMO CCC[C@H](C)[C@H]1CCC[N@H+]1Cc1cccc(O)c1 ZINC000539863459 388784770 /nfs/dbraw/zinc/78/47/70/388784770.db2.gz YGYOAENBCDQTAN-XJKSGUPXSA-N 1 1 247.382 3.793 20 0 BHADMO Cc1cc(C)cc(C2=CC[N@@H+](CC3CC3)CC2)c1 ZINC000539885817 388787009 /nfs/dbraw/zinc/78/70/09/388787009.db2.gz PTKHKZCXTJFWAP-UHFFFAOYSA-N 1 1 241.378 3.803 20 0 BHADMO C[C@@H]1CC[N@@H+](Cc2cccs2)C[C@@H](C)C1 ZINC000539890491 388786798 /nfs/dbraw/zinc/78/67/98/388786798.db2.gz OKEGOZCPKJWIJR-NEPJUHHUSA-N 1 1 223.385 3.616 20 0 BHADMO C[C@H]1CC[N@@H+](Cc2cccs2)C[C@H](C)C1 ZINC000539890492 388787560 /nfs/dbraw/zinc/78/75/60/388787560.db2.gz OKEGOZCPKJWIJR-NWDGAFQWSA-N 1 1 223.385 3.616 20 0 BHADMO C[C@H]1CC[N@@H+](Cc2cccs2)C[C@@H](C)C1 ZINC000539890493 388787763 /nfs/dbraw/zinc/78/77/63/388787763.db2.gz OKEGOZCPKJWIJR-RYUDHWBXSA-N 1 1 223.385 3.616 20 0 BHADMO C[C@@H]1C[C@H](C)CC[N@@H+](Cc2cccs2)C1 ZINC000539890494 388787577 /nfs/dbraw/zinc/78/75/77/388787577.db2.gz OKEGOZCPKJWIJR-VXGBXAGGSA-N 1 1 223.385 3.616 20 0 BHADMO CC(C)(C)C1=CC[N@@H+](Cc2ccsc2)CC1 ZINC000539894294 388787166 /nfs/dbraw/zinc/78/71/66/388787166.db2.gz GYHCKADQMGQZNQ-UHFFFAOYSA-N 1 1 235.396 3.926 20 0 BHADMO CCCCC[C@H]1CCC[N@H+]1Cc1cccnc1C ZINC000539895227 388787494 /nfs/dbraw/zinc/78/74/94/388787494.db2.gz BILCTGDJCJDFAK-INIZCTEOSA-N 1 1 246.398 3.935 20 0 BHADMO CCCCC[C@@H]1CCC[N@H+]1Cc1cccnc1C ZINC000539895234 388786611 /nfs/dbraw/zinc/78/66/11/388786611.db2.gz BILCTGDJCJDFAK-MRXNPFEDSA-N 1 1 246.398 3.935 20 0 BHADMO Cc1ccoc1C[N@@H+]1CC=C(C(C)(C)C)CC1 ZINC000539895845 388788075 /nfs/dbraw/zinc/78/80/75/388788075.db2.gz RASVPQADZZHLMF-UHFFFAOYSA-N 1 1 233.355 3.766 20 0 BHADMO CC(C)(C)C1=CC[N@@H+](Cc2cccs2)CC1 ZINC000539896975 388787632 /nfs/dbraw/zinc/78/76/32/388787632.db2.gz SXMRGBLIZYPIBW-UHFFFAOYSA-N 1 1 235.396 3.926 20 0 BHADMO Cc1ccc(C[N@@H+](C)CCC2CC2)cc1C ZINC000539897930 388786810 /nfs/dbraw/zinc/78/68/10/388786810.db2.gz YXJYKZBIFYMZLD-UHFFFAOYSA-N 1 1 217.356 3.535 20 0 BHADMO C[N@@H+](CCC1CC1)C[C@H]1C[C@H]1c1ccccc1 ZINC000539898727 388787094 /nfs/dbraw/zinc/78/70/94/388787094.db2.gz GFIGIMPRJMNHDQ-CVEARBPZSA-N 1 1 229.367 3.522 20 0 BHADMO CCCCC[C@@H]1CCC[N@H+]1Cc1cncs1 ZINC000539899152 388787077 /nfs/dbraw/zinc/78/70/77/388787077.db2.gz RROHQQWFCVQXRQ-GFCCVEGCSA-N 1 1 238.400 3.688 20 0 BHADMO CCCCC[C@H]1CCC[N@H+]1Cc1cncs1 ZINC000539899153 388786701 /nfs/dbraw/zinc/78/67/01/388786701.db2.gz RROHQQWFCVQXRQ-LBPRGKRZSA-N 1 1 238.400 3.688 20 0 BHADMO CS[C@H]1CCCC[N@@H+](C[C@H]2CC=CCC2)C1 ZINC000539899943 388786737 /nfs/dbraw/zinc/78/67/37/388786737.db2.gz ZOUYIULLYBRJTR-KBPBESRZSA-N 1 1 239.428 3.560 20 0 BHADMO CS[C@H]1CCCC[N@@H+](C[C@@H]2CC=CCC2)C1 ZINC000539899944 388786789 /nfs/dbraw/zinc/78/67/89/388786789.db2.gz ZOUYIULLYBRJTR-KGLIPLIRSA-N 1 1 239.428 3.560 20 0 BHADMO CS[C@@H]1CCCC[N@@H+](C[C@H]2CC=CCC2)C1 ZINC000539899945 388788068 /nfs/dbraw/zinc/78/80/68/388788068.db2.gz ZOUYIULLYBRJTR-UONOGXRCSA-N 1 1 239.428 3.560 20 0 BHADMO CS[C@@H]1CCCC[N@@H+](C[C@@H]2CC=CCC2)C1 ZINC000539899946 388787212 /nfs/dbraw/zinc/78/72/12/388787212.db2.gz ZOUYIULLYBRJTR-ZIAGYGMSSA-N 1 1 239.428 3.560 20 0 BHADMO C/C(=C\c1ccccc1)C[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000539908242 388786959 /nfs/dbraw/zinc/78/69/59/388786959.db2.gz KRHKHWNAUYCLIK-CICKDAIQSA-N 1 1 229.367 3.963 20 0 BHADMO C/C(=C/c1ccccc1)C[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000539908243 388788083 /nfs/dbraw/zinc/78/80/83/388788083.db2.gz KRHKHWNAUYCLIK-CSNLRBTCSA-N 1 1 229.367 3.963 20 0 BHADMO C[C@@H]1CC[C@H](C)[N@@H+]1Cc1ccnc2ccccc12 ZINC000539908322 388787938 /nfs/dbraw/zinc/78/79/38/388787938.db2.gz PJJJIPMGJYFCNK-BETUJISGSA-N 1 1 240.350 3.608 20 0 BHADMO C[C@@H]1CC[C@H](C)[N@@H+]1C/C=C/c1ccc(F)cc1 ZINC000539908408 388787025 /nfs/dbraw/zinc/78/70/25/388787025.db2.gz VHLJVWPXLVMOOV-AYIQIARFSA-N 1 1 233.330 3.712 20 0 BHADMO C[C@@H]1CC[C@H](C)[N@@H+]1C/C=C\c1ccc(F)cc1 ZINC000539908411 388787545 /nfs/dbraw/zinc/78/75/45/388787545.db2.gz VHLJVWPXLVMOOV-LGRKWKCASA-N 1 1 233.330 3.712 20 0 BHADMO CC(C)Oc1ccc(C[N@@H+]2[C@H](C)CC[C@@H]2C)cc1 ZINC000539908444 388787014 /nfs/dbraw/zinc/78/70/14/388787014.db2.gz XYUUVCSNUCJTOJ-OKILXGFUSA-N 1 1 247.382 3.847 20 0 BHADMO C[C@@H]1CC[C@H](C)[N@@H+]1C[C@H]1C[C@H]1c1ccccc1 ZINC000539908759 388786849 /nfs/dbraw/zinc/78/68/49/388786849.db2.gz OCSVFCCMKACAQP-CLWVCHIJSA-N 1 1 229.367 3.663 20 0 BHADMO C[C@@H]1CC[C@H](C)[N@@H+]1C[C@@H]1C[C@@H]1c1ccccc1 ZINC000539908760 388787503 /nfs/dbraw/zinc/78/75/03/388787503.db2.gz OCSVFCCMKACAQP-LQKXBSAESA-N 1 1 229.367 3.663 20 0 BHADMO C[C@@H]1CC[C@H](C)[N@@H+]1C[C@H]1C[C@@H]1c1ccccc1 ZINC000539908761 388787018 /nfs/dbraw/zinc/78/70/18/388787018.db2.gz OCSVFCCMKACAQP-OCVGTWLNSA-N 1 1 229.367 3.663 20 0 BHADMO CCc1ccc(C[N@@H+]2CC[C@@H](CC)C2)s1 ZINC000539911417 388788950 /nfs/dbraw/zinc/78/89/50/388788950.db2.gz NHFNHMYLGIZLPY-LLVKDONJSA-N 1 1 223.385 3.542 20 0 BHADMO CCc1ccc(C[N@@H+]2CC[C@H](CC)C2)s1 ZINC000539911419 388789678 /nfs/dbraw/zinc/78/96/78/388789678.db2.gz NHFNHMYLGIZLPY-NSHDSACASA-N 1 1 223.385 3.542 20 0 BHADMO CC(C)[C@H]1CC[N@@H+](Cc2ccc(Cl)s2)C1 ZINC000539912400 388789803 /nfs/dbraw/zinc/78/98/03/388789803.db2.gz VUNKNMGMENOJJJ-JTQLQIEISA-N 1 1 243.803 3.879 20 0 BHADMO CC(C)[C@@H]1CC[N@@H+](Cc2ccc(Cl)s2)C1 ZINC000539912402 388789414 /nfs/dbraw/zinc/78/94/14/388789414.db2.gz VUNKNMGMENOJJJ-SNVBAGLBSA-N 1 1 243.803 3.879 20 0 BHADMO Cc1ccsc1C[N@@H+]1CC[C@@H](C(C)C)C1 ZINC000539913271 388789604 /nfs/dbraw/zinc/78/96/04/388789604.db2.gz LYCFTVQFKZLKTF-GFCCVEGCSA-N 1 1 223.385 3.534 20 0 BHADMO Cc1ccsc1C[N@@H+]1CC[C@H](C(C)C)C1 ZINC000539913272 388788553 /nfs/dbraw/zinc/78/85/53/388788553.db2.gz LYCFTVQFKZLKTF-LBPRGKRZSA-N 1 1 223.385 3.534 20 0 BHADMO CC[C@@H](C[N@H+]1CC[C@@](C)(F)C1)c1ccccc1 ZINC000539923737 388788976 /nfs/dbraw/zinc/78/89/76/388788976.db2.gz KFXQHGAUNBDBHK-DZGCQCFKSA-N 1 1 235.346 3.614 20 0 BHADMO CC[C@H](C[N@H+]1CC[C@](C)(F)C1)c1ccccc1 ZINC000539923738 388789384 /nfs/dbraw/zinc/78/93/84/388789384.db2.gz KFXQHGAUNBDBHK-HIFRSBDPSA-N 1 1 235.346 3.614 20 0 BHADMO CC[C@H](C[N@H+]1CC[C@@](C)(F)C1)c1ccccc1 ZINC000539923739 388789325 /nfs/dbraw/zinc/78/93/25/388789325.db2.gz KFXQHGAUNBDBHK-UKRRQHHQSA-N 1 1 235.346 3.614 20 0 BHADMO CC[C@@H](C[N@H+]1CC[C@](C)(F)C1)c1ccccc1 ZINC000539923882 388788542 /nfs/dbraw/zinc/78/85/42/388788542.db2.gz KFXQHGAUNBDBHK-ZFWWWQNUSA-N 1 1 235.346 3.614 20 0 BHADMO COC(C)(C)C[N@@H+](C)Cc1ccc(C(C)C)cc1 ZINC000539927332 388790033 /nfs/dbraw/zinc/79/00/33/388790033.db2.gz NGDKUZUSOXZATI-UHFFFAOYSA-N 1 1 249.398 3.667 20 0 BHADMO FC(F)(F)CC[N@@H+](CC1CCCCC1)C1CC1 ZINC000539958024 323077325 /nfs/dbraw/zinc/07/73/25/323077325.db2.gz AEXFMTNUTYQTOJ-UHFFFAOYSA-N 1 1 249.320 3.984 20 0 BHADMO CCC(CC)C[N@@H+](CC)[C@H](C)c1ncc(C)o1 ZINC000540011382 388790997 /nfs/dbraw/zinc/79/09/97/388790997.db2.gz RHRGCFZIEUYUEN-GFCCVEGCSA-N 1 1 238.375 3.802 20 0 BHADMO CCC(CC)C[N@@H+](CC)[C@@H](C)c1ncc(C)o1 ZINC000540011383 388791060 /nfs/dbraw/zinc/79/10/60/388791060.db2.gz RHRGCFZIEUYUEN-LBPRGKRZSA-N 1 1 238.375 3.802 20 0 BHADMO C[C@H]1CC[N@H+]([C@H]2C=CCCC2)CC12CCC2 ZINC000540042683 388793661 /nfs/dbraw/zinc/79/36/61/388793661.db2.gz ISAUXKXKGBFFOK-KBPBESRZSA-N 1 1 219.372 3.607 20 0 BHADMO C[C@@H]1CC[N@H+]([C@H]2C=CCCC2)CC12CCC2 ZINC000540042686 388792740 /nfs/dbraw/zinc/79/27/40/388792740.db2.gz ISAUXKXKGBFFOK-KGLIPLIRSA-N 1 1 219.372 3.607 20 0 BHADMO C[C@H]1CC[N@H+]([C@@H]2C=CCCC2)CC12CCC2 ZINC000540042687 388793021 /nfs/dbraw/zinc/79/30/21/388793021.db2.gz ISAUXKXKGBFFOK-UONOGXRCSA-N 1 1 219.372 3.607 20 0 BHADMO C[C@@H]1CC[N@H+]([C@@H]2C=CCCC2)CC12CCC2 ZINC000540042688 388793180 /nfs/dbraw/zinc/79/31/80/388793180.db2.gz ISAUXKXKGBFFOK-ZIAGYGMSSA-N 1 1 219.372 3.607 20 0 BHADMO CCc1ccc(C2=CC[N@@H+](CCCF)CC2)cc1 ZINC000540059873 388795355 /nfs/dbraw/zinc/79/53/55/388795355.db2.gz VRKUJWVOXFSVAY-UHFFFAOYSA-N 1 1 247.357 3.698 20 0 BHADMO CC[C@@H]1CC[C@H](C)[N@H+]1CCc1ccc(OC)cc1 ZINC000540059944 388794362 /nfs/dbraw/zinc/79/43/62/388794362.db2.gz YUZBHYBBXWRIGX-DZGCQCFKSA-N 1 1 247.382 3.501 20 0 BHADMO CC[C@H]1CC[C@@H](C)[N@H+]1CCc1ccc(OC)cc1 ZINC000540059945 388794508 /nfs/dbraw/zinc/79/45/08/388794508.db2.gz YUZBHYBBXWRIGX-HIFRSBDPSA-N 1 1 247.382 3.501 20 0 BHADMO CC[C@@H]1CC[C@@H](C)[N@H+]1CCc1ccc(OC)cc1 ZINC000540059946 388795231 /nfs/dbraw/zinc/79/52/31/388795231.db2.gz YUZBHYBBXWRIGX-UKRRQHHQSA-N 1 1 247.382 3.501 20 0 BHADMO CC[C@H]1CC[C@H](C)[N@H+]1CCc1ccc(OC)cc1 ZINC000540059947 388794618 /nfs/dbraw/zinc/79/46/18/388794618.db2.gz YUZBHYBBXWRIGX-ZFWWWQNUSA-N 1 1 247.382 3.501 20 0 BHADMO CC(C)(C)C1=CC[N@H+](C2CCCC2)CC1 ZINC000540062279 388795436 /nfs/dbraw/zinc/79/54/36/388795436.db2.gz SGMKLIDSGHBPFJ-UHFFFAOYSA-N 1 1 207.361 3.607 20 0 BHADMO Cc1ccccc1[C@@H](C)[N@@H+](C)C1CCCC1 ZINC000540065363 388794559 /nfs/dbraw/zinc/79/45/59/388794559.db2.gz DWORODNKOMWZMW-CYBMUJFWSA-N 1 1 217.356 3.930 20 0 BHADMO Cc1ccccc1[C@H](C)[N@@H+](C)C1CCCC1 ZINC000540065368 388794307 /nfs/dbraw/zinc/79/43/07/388794307.db2.gz DWORODNKOMWZMW-ZDUSSCGKSA-N 1 1 217.356 3.930 20 0 BHADMO C[C@H]1c2ccsc2CC[N@H+]1C1CCCC1 ZINC000540065966 388795026 /nfs/dbraw/zinc/79/50/26/388795026.db2.gz DNRMVZJPUOVZPI-JTQLQIEISA-N 1 1 221.369 3.610 20 0 BHADMO C[C@@H]1c2ccsc2CC[N@H+]1C1CCCC1 ZINC000540065968 388794062 /nfs/dbraw/zinc/79/40/62/388794062.db2.gz DNRMVZJPUOVZPI-SNVBAGLBSA-N 1 1 221.369 3.610 20 0 BHADMO Cc1ccccc1[C@H]1CC[N@H+](C2CCCC2)C1 ZINC000540066490 388794936 /nfs/dbraw/zinc/79/49/36/388794936.db2.gz FNSZUYSJBJMYKP-AWEZNQCLSA-N 1 1 229.367 3.727 20 0 BHADMO Cc1ccccc1[C@@H]1CC[N@H+](C2CCCC2)C1 ZINC000540066491 388794689 /nfs/dbraw/zinc/79/46/89/388794689.db2.gz FNSZUYSJBJMYKP-CQSZACIVSA-N 1 1 229.367 3.727 20 0 BHADMO C[C@H]1C[C@@H](c2ccccc2)C[N@H+]1C1CCCC1 ZINC000540066933 388794328 /nfs/dbraw/zinc/79/43/28/388794328.db2.gz LECQDRSTQSCYFL-DZGCQCFKSA-N 1 1 229.367 3.807 20 0 BHADMO C[C@@H]1C[C@H](c2ccccc2)C[N@H+]1C1CCCC1 ZINC000540066934 388794414 /nfs/dbraw/zinc/79/44/14/388794414.db2.gz LECQDRSTQSCYFL-HIFRSBDPSA-N 1 1 229.367 3.807 20 0 BHADMO C[C@@H]1C[C@@H](c2ccccc2)C[N@H+]1C1CCCC1 ZINC000540066935 388795197 /nfs/dbraw/zinc/79/51/97/388795197.db2.gz LECQDRSTQSCYFL-UKRRQHHQSA-N 1 1 229.367 3.807 20 0 BHADMO C[C@H]1C[C@H](c2ccccc2)C[N@H+]1C1CCCC1 ZINC000540066936 388795419 /nfs/dbraw/zinc/79/54/19/388795419.db2.gz LECQDRSTQSCYFL-ZFWWWQNUSA-N 1 1 229.367 3.807 20 0 BHADMO Cc1ccc(C[C@H](C)[N@@H+](C)C2CCCC2)cc1 ZINC000540067151 388794757 /nfs/dbraw/zinc/79/47/57/388794757.db2.gz VPZFFPMTUOVBPT-AWEZNQCLSA-N 1 1 231.383 3.800 20 0 BHADMO Cc1ccc(C[C@@H](C)[N@@H+](C)C2CCCC2)cc1 ZINC000540067152 388794920 /nfs/dbraw/zinc/79/49/20/388794920.db2.gz VPZFFPMTUOVBPT-CQSZACIVSA-N 1 1 231.383 3.800 20 0 BHADMO CC(C)(C)C[C@H]1CCC[N@H+]1C1CCCC1 ZINC000540067220 388795088 /nfs/dbraw/zinc/79/50/88/388795088.db2.gz QZESKRSJMUCJGC-CYBMUJFWSA-N 1 1 209.377 3.830 20 0 BHADMO CC(C)(C)C[C@@H]1CCC[N@H+]1C1CCCC1 ZINC000540067222 388795212 /nfs/dbraw/zinc/79/52/12/388795212.db2.gz QZESKRSJMUCJGC-ZDUSSCGKSA-N 1 1 209.377 3.830 20 0 BHADMO CCC[C@@]1(C)CCC[N@@H+](Cc2ncccc2C)C1 ZINC000540068175 388794402 /nfs/dbraw/zinc/79/44/02/388794402.db2.gz ADUKKPKZKIBWND-INIZCTEOSA-N 1 1 246.398 3.792 20 0 BHADMO CCC[C@]1(C)CCC[N@@H+](Cc2ncccc2C)C1 ZINC000540068176 388794445 /nfs/dbraw/zinc/79/44/45/388794445.db2.gz ADUKKPKZKIBWND-MRXNPFEDSA-N 1 1 246.398 3.792 20 0 BHADMO Fc1ccc(C[C@@H]2CCC[N@H+]2C2CCCC2)cc1 ZINC000540077482 388794494 /nfs/dbraw/zinc/79/44/94/388794494.db2.gz SCYCFFWZVWYKSY-INIZCTEOSA-N 1 1 247.357 3.775 20 0 BHADMO Fc1ccc(C[C@H]2CCC[N@H+]2C2CCCC2)cc1 ZINC000540077484 388794387 /nfs/dbraw/zinc/79/43/87/388794387.db2.gz SCYCFFWZVWYKSY-MRXNPFEDSA-N 1 1 247.357 3.775 20 0 BHADMO Fc1ccc(C2=CC[N@H+](C3CCCC3)CC2)cc1 ZINC000540078562 388795276 /nfs/dbraw/zinc/79/52/76/388795276.db2.gz XQKXBGHTCHRTDQ-UHFFFAOYSA-N 1 1 245.341 3.857 20 0 BHADMO CC(C)(C)[C@H]([NH2+]CCF)c1ccc(F)cc1F ZINC000540423415 388805383 /nfs/dbraw/zinc/80/53/83/388805383.db2.gz JAVKAQZTXMIFMQ-GFCCVEGCSA-N 1 1 245.288 3.611 20 0 BHADMO CC(C)(C)[C@@H]([NH2+]CCF)c1ccc(F)cc1F ZINC000540423417 388806454 /nfs/dbraw/zinc/80/64/54/388806454.db2.gz JAVKAQZTXMIFMQ-LBPRGKRZSA-N 1 1 245.288 3.611 20 0 BHADMO C[C@@H](CCc1ccccc1)C[N@@H+](C)CC1CC1 ZINC000540465281 388805936 /nfs/dbraw/zinc/80/59/36/388805936.db2.gz LVIVLSUEWMZTNI-AWEZNQCLSA-N 1 1 231.383 3.597 20 0 BHADMO C[C@H](CCc1ccccc1)C[N@@H+](C)CC1CC1 ZINC000540465285 388805473 /nfs/dbraw/zinc/80/54/73/388805473.db2.gz LVIVLSUEWMZTNI-CQSZACIVSA-N 1 1 231.383 3.597 20 0 BHADMO CCC[C@H](C)C[N@@H+]1CC=C(C(F)(F)F)CC1 ZINC000540481606 388808968 /nfs/dbraw/zinc/80/89/68/388808968.db2.gz XTQSMIMYRDQSPP-JTQLQIEISA-N 1 1 235.293 3.617 20 0 BHADMO CCC[C@@H](C)C[N@@H+]1CC=C(C(F)(F)F)CC1 ZINC000540481607 388807634 /nfs/dbraw/zinc/80/76/34/388807634.db2.gz XTQSMIMYRDQSPP-SNVBAGLBSA-N 1 1 235.293 3.617 20 0 BHADMO CCC[C@@H](C)C[N@@H+](C)CCc1cccs1 ZINC000540481816 388808453 /nfs/dbraw/zinc/80/84/53/388808453.db2.gz MNGSPEPADGGEKW-GFCCVEGCSA-N 1 1 225.401 3.659 20 0 BHADMO CCC[C@H](C)C[N@@H+](C)CCc1cccs1 ZINC000540481817 388805951 /nfs/dbraw/zinc/80/59/51/388805951.db2.gz MNGSPEPADGGEKW-LBPRGKRZSA-N 1 1 225.401 3.659 20 0 BHADMO CC(C)COc1cccc(C[N@H+]2CCC2(C)C)c1 ZINC000540481942 388808169 /nfs/dbraw/zinc/80/81/69/388808169.db2.gz RZWYKQDKDMEXRR-UHFFFAOYSA-N 1 1 247.382 3.706 20 0 BHADMO CCC[C@H](C)C[N@@H+](C)[C@@H](C)Cc1ccc(O)cc1 ZINC000540483777 388808394 /nfs/dbraw/zinc/80/83/94/388808394.db2.gz UZJLXWHBGIVQDV-KBPBESRZSA-N 1 1 249.398 3.691 20 0 BHADMO CCC[C@@H](C)C[N@@H+](C)[C@@H](C)Cc1ccc(O)cc1 ZINC000540483778 388808220 /nfs/dbraw/zinc/80/82/20/388808220.db2.gz UZJLXWHBGIVQDV-KGLIPLIRSA-N 1 1 249.398 3.691 20 0 BHADMO CCC[C@H](C)C[N@@H+](C)[C@H](C)Cc1ccc(O)cc1 ZINC000540483779 388809063 /nfs/dbraw/zinc/80/90/63/388809063.db2.gz UZJLXWHBGIVQDV-UONOGXRCSA-N 1 1 249.398 3.691 20 0 BHADMO CCC[C@@H](C)C[N@@H+](C)[C@H](C)Cc1ccc(O)cc1 ZINC000540483780 388807533 /nfs/dbraw/zinc/80/75/33/388807533.db2.gz UZJLXWHBGIVQDV-ZIAGYGMSSA-N 1 1 249.398 3.691 20 0 BHADMO CC(C)Oc1ccccc1C[N@H+]1CC[C@H]1C(C)C ZINC000540499798 388808118 /nfs/dbraw/zinc/80/81/18/388808118.db2.gz OCQHDLHSAATARH-HNNXBMFYSA-N 1 1 247.382 3.704 20 0 BHADMO CC(C)Oc1ccccc1C[N@H+]1CC[C@@H]1C(C)C ZINC000540499800 388807788 /nfs/dbraw/zinc/80/77/88/388807788.db2.gz OCQHDLHSAATARH-OAHLLOKOSA-N 1 1 247.382 3.704 20 0 BHADMO CC(C)[C@H]1CC[N@H+]1Cc1c(F)cccc1Cl ZINC000540500457 388808045 /nfs/dbraw/zinc/80/80/45/388808045.db2.gz XUFYFKDUCRLWKH-CYBMUJFWSA-N 1 1 241.737 3.709 20 0 BHADMO CC(C)[C@H]1CC[N@@H+]1Cc1c(F)cccc1Cl ZINC000540500457 388808042 /nfs/dbraw/zinc/80/80/42/388808042.db2.gz XUFYFKDUCRLWKH-CYBMUJFWSA-N 1 1 241.737 3.709 20 0 BHADMO CC(C)[C@@H]1CC[N@H+]1Cc1c(F)cccc1Cl ZINC000540500463 388808471 /nfs/dbraw/zinc/80/84/71/388808471.db2.gz XUFYFKDUCRLWKH-ZDUSSCGKSA-N 1 1 241.737 3.709 20 0 BHADMO CC(C)[C@@H]1CC[N@@H+]1Cc1c(F)cccc1Cl ZINC000540500463 388808470 /nfs/dbraw/zinc/80/84/70/388808470.db2.gz XUFYFKDUCRLWKH-ZDUSSCGKSA-N 1 1 241.737 3.709 20 0 BHADMO Cc1cccc(C[N@@H+]2CC[C@H]2C(C)C)c1C ZINC000540500536 388808522 /nfs/dbraw/zinc/80/85/22/388808522.db2.gz HYUWGCHRCYHDSK-HNNXBMFYSA-N 1 1 217.356 3.534 20 0 BHADMO Cc1cccc(C[N@@H+]2CC[C@@H]2C(C)C)c1C ZINC000540500538 388807661 /nfs/dbraw/zinc/80/76/61/388807661.db2.gz HYUWGCHRCYHDSK-OAHLLOKOSA-N 1 1 217.356 3.534 20 0 BHADMO CCC[N@@H+](Cc1ccnc2ccccc12)C1CC1 ZINC000540502676 388809092 /nfs/dbraw/zinc/80/90/92/388809092.db2.gz RBLUTLQZRKJSFN-UHFFFAOYSA-N 1 1 240.350 3.609 20 0 BHADMO Cc1cc(C[N@@H+]2CC[C@@H]2C(C)C)c(C)s1 ZINC000540502914 388808742 /nfs/dbraw/zinc/80/87/42/388808742.db2.gz SUWFILIDXOMYNJ-CYBMUJFWSA-N 1 1 223.385 3.595 20 0 BHADMO Cc1cc(C[N@@H+]2CC[C@H]2C(C)C)c(C)s1 ZINC000540502917 388807475 /nfs/dbraw/zinc/80/74/75/388807475.db2.gz SUWFILIDXOMYNJ-ZDUSSCGKSA-N 1 1 223.385 3.595 20 0 BHADMO COc1ccc([C@H](C)C[N@H+]2CCC(C)(C)C2)cc1 ZINC000540503430 388808503 /nfs/dbraw/zinc/80/85/03/388808503.db2.gz HOSZPVNLYLLSGZ-CYBMUJFWSA-N 1 1 247.382 3.531 20 0 BHADMO COc1ccc([C@@H](C)C[N@H+]2CCC(C)(C)C2)cc1 ZINC000540503431 388808150 /nfs/dbraw/zinc/80/81/50/388808150.db2.gz HOSZPVNLYLLSGZ-ZDUSSCGKSA-N 1 1 247.382 3.531 20 0 BHADMO CC(C)COc1cccc(C[N@@H+](C)C2CCC2)c1 ZINC000540505545 388808111 /nfs/dbraw/zinc/80/81/11/388808111.db2.gz IEAHEGGXURSROI-UHFFFAOYSA-N 1 1 247.382 3.706 20 0 BHADMO CCC[C@H](C)C[N@@H+](Cc1ccccn1)C(C)C ZINC000540506473 388808088 /nfs/dbraw/zinc/80/80/88/388808088.db2.gz JRSWTCTUTFOFGQ-AWEZNQCLSA-N 1 1 234.387 3.728 20 0 BHADMO CCC[C@@H](C)C[N@@H+](Cc1ccccn1)C(C)C ZINC000540506474 388807592 /nfs/dbraw/zinc/80/75/92/388807592.db2.gz JRSWTCTUTFOFGQ-CQSZACIVSA-N 1 1 234.387 3.728 20 0 BHADMO CC[N@@H+](Cc1cccc(OCC(C)C)c1)C1CC1 ZINC000540506507 388808256 /nfs/dbraw/zinc/80/82/56/388808256.db2.gz MTJOEALEECYVPO-UHFFFAOYSA-N 1 1 247.382 3.706 20 0 BHADMO CCC[C@@H](C)C[N@@H+](C)C(C1CC1)C1CC1 ZINC000540506824 388808513 /nfs/dbraw/zinc/80/85/13/388808513.db2.gz UPJGKVOXFSYNLW-LLVKDONJSA-N 1 1 209.377 3.543 20 0 BHADMO CCC[C@H](C)C[N@@H+](C)C(C1CC1)C1CC1 ZINC000540506825 388808317 /nfs/dbraw/zinc/80/83/17/388808317.db2.gz UPJGKVOXFSYNLW-NSHDSACASA-N 1 1 209.377 3.543 20 0 BHADMO CCC[C@H](C)C[N@H+]1CCC[C@@H]1c1ccccn1 ZINC000540506906 388807600 /nfs/dbraw/zinc/80/76/00/388807600.db2.gz AYCGTDMDRNXWFE-DZGCQCFKSA-N 1 1 232.371 3.655 20 0 BHADMO CCC[C@@H](C)C[N@H+]1CCC[C@H]1c1ccccn1 ZINC000540506907 388808200 /nfs/dbraw/zinc/80/82/00/388808200.db2.gz AYCGTDMDRNXWFE-HIFRSBDPSA-N 1 1 232.371 3.655 20 0 BHADMO CCC[C@@H](C)C[N@H+]1CCC[C@@H]1c1ccccn1 ZINC000540506908 388808241 /nfs/dbraw/zinc/80/82/41/388808241.db2.gz AYCGTDMDRNXWFE-UKRRQHHQSA-N 1 1 232.371 3.655 20 0 BHADMO CCC[C@H](C)C[N@H+]1CCC[C@H]1c1ccccn1 ZINC000540506909 388807379 /nfs/dbraw/zinc/80/73/79/388807379.db2.gz AYCGTDMDRNXWFE-ZFWWWQNUSA-N 1 1 232.371 3.655 20 0 BHADMO CCC[N@@H+](C)C[C@@H](C)CCc1ccccc1 ZINC000540507022 388808370 /nfs/dbraw/zinc/80/83/70/388808370.db2.gz JMZCFXZXSYFRDT-AWEZNQCLSA-N 1 1 219.372 3.597 20 0 BHADMO CCC[N@@H+](C)C[C@H](C)CCc1ccccc1 ZINC000540507023 388809105 /nfs/dbraw/zinc/80/91/05/388809105.db2.gz JMZCFXZXSYFRDT-CQSZACIVSA-N 1 1 219.372 3.597 20 0 BHADMO CCC[C@@H](C)C[N@@H+](C)Cc1csc(CC)n1 ZINC000540507269 388807335 /nfs/dbraw/zinc/80/73/35/388807335.db2.gz HPVFYAQXRQZROH-LLVKDONJSA-N 1 1 240.416 3.574 20 0 BHADMO CCC[C@H](C)C[N@@H+](C)Cc1csc(CC)n1 ZINC000540507270 388808342 /nfs/dbraw/zinc/80/83/42/388808342.db2.gz HPVFYAQXRQZROH-NSHDSACASA-N 1 1 240.416 3.574 20 0 BHADMO CCC[C@@H](C)C[N@H+]1CCc2sccc2C1 ZINC000540507864 388808143 /nfs/dbraw/zinc/80/81/43/388808143.db2.gz QOKRBNKJFGPNBX-LLVKDONJSA-N 1 1 223.385 3.542 20 0 BHADMO CCC[C@H](C)C[N@H+]1CCc2sccc2C1 ZINC000540507866 388807968 /nfs/dbraw/zinc/80/79/68/388807968.db2.gz QOKRBNKJFGPNBX-NSHDSACASA-N 1 1 223.385 3.542 20 0 BHADMO CC[N@@H+](CCC(=O)c1ccccc1)[C@@H](C)C(C)C ZINC000540822146 388820742 /nfs/dbraw/zinc/82/07/42/388820742.db2.gz RUYVTDMAPBZLQR-AWEZNQCLSA-N 1 1 247.382 3.626 20 0 BHADMO CC[N@@H+](CCC(=O)c1ccccc1)[C@H](C)C(C)C ZINC000540822147 388820925 /nfs/dbraw/zinc/82/09/25/388820925.db2.gz RUYVTDMAPBZLQR-CQSZACIVSA-N 1 1 247.382 3.626 20 0 BHADMO C[C@@H]([NH2+]C/C=C/c1ccccc1)c1cscn1 ZINC000540918202 388826194 /nfs/dbraw/zinc/82/61/94/388826194.db2.gz NAPVVQGHWBXEDO-FZKGZDJFSA-N 1 1 244.363 3.507 20 0 BHADMO C[C@H]([NH2+]C/C=C\c1ccccc1)c1cscn1 ZINC000540918203 324930855 /nfs/dbraw/zinc/93/08/55/324930855.db2.gz NAPVVQGHWBXEDO-JECSTDCCSA-N 1 1 244.363 3.507 20 0 BHADMO C[C@@H]([NH2+]C/C=C\c1ccccc1)c1cscn1 ZINC000540918204 388826834 /nfs/dbraw/zinc/82/68/34/388826834.db2.gz NAPVVQGHWBXEDO-VVEJJEBESA-N 1 1 244.363 3.507 20 0 BHADMO C[C@H]([NH2+]C/C=C/c1ccccc1)c1cscn1 ZINC000540918205 324930564 /nfs/dbraw/zinc/93/05/64/324930564.db2.gz NAPVVQGHWBXEDO-ZCRIDZFUSA-N 1 1 244.363 3.507 20 0 BHADMO CC(C)c1ccc(C[N@H+]2CCCSCC2)cc1 ZINC000540961948 388831911 /nfs/dbraw/zinc/83/19/11/388831911.db2.gz PRCLUUDICQAAQM-UHFFFAOYSA-N 1 1 249.423 3.749 20 0 BHADMO CCC[N@@H+](C[C@@H](C)OC)[C@H](CC)c1ccccc1 ZINC000541066763 388838105 /nfs/dbraw/zinc/83/81/05/388838105.db2.gz LEAZAKUHDQMRCH-GDBMZVCRSA-N 1 1 249.398 3.885 20 0 BHADMO CCC[N@@H+](C[C@H](C)OC)[C@H](CC)c1ccccc1 ZINC000541066764 388838502 /nfs/dbraw/zinc/83/85/02/388838502.db2.gz LEAZAKUHDQMRCH-GOEBONIOSA-N 1 1 249.398 3.885 20 0 BHADMO CCC[N@@H+](C[C@H](C)OC)[C@@H](CC)c1ccccc1 ZINC000541066765 388837647 /nfs/dbraw/zinc/83/76/47/388837647.db2.gz LEAZAKUHDQMRCH-HOCLYGCPSA-N 1 1 249.398 3.885 20 0 BHADMO CCC[N@@H+](C[C@@H](C)OC)[C@@H](CC)c1ccccc1 ZINC000541066766 388838541 /nfs/dbraw/zinc/83/85/41/388838541.db2.gz LEAZAKUHDQMRCH-ZBFHGGJFSA-N 1 1 249.398 3.885 20 0 BHADMO CCC(CC)(CC)C[N@H+]1CCC[C@H](COC)C1 ZINC000541090664 388839437 /nfs/dbraw/zinc/83/94/37/388839437.db2.gz UEOMTJUDPKXJIB-AWEZNQCLSA-N 1 1 241.419 3.561 20 0 BHADMO CCC(CC)(CC)C[N@H+]1CCC[C@@H](COC)C1 ZINC000541090685 388839705 /nfs/dbraw/zinc/83/97/05/388839705.db2.gz UEOMTJUDPKXJIB-CQSZACIVSA-N 1 1 241.419 3.561 20 0 BHADMO CC[C@@H]1CCC[N@@H+](CCCc2ccsc2)C1 ZINC000541160812 388843241 /nfs/dbraw/zinc/84/32/41/388843241.db2.gz COZWFSSMDBUJJJ-CYBMUJFWSA-N 1 1 237.412 3.803 20 0 BHADMO CC[C@H]1CCC[N@@H+](CCCc2ccsc2)C1 ZINC000541160826 388843084 /nfs/dbraw/zinc/84/30/84/388843084.db2.gz COZWFSSMDBUJJJ-ZDUSSCGKSA-N 1 1 237.412 3.803 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)CCCc1ccsc1 ZINC000541161599 388842974 /nfs/dbraw/zinc/84/29/74/388842974.db2.gz OUMQPOXRVJVFIS-GFCCVEGCSA-N 1 1 225.401 3.801 20 0 BHADMO CCC[C@H](C)[N@@H+](C)CCCc1ccsc1 ZINC000541161603 388842968 /nfs/dbraw/zinc/84/29/68/388842968.db2.gz OUMQPOXRVJVFIS-LBPRGKRZSA-N 1 1 225.401 3.801 20 0 BHADMO CCCC[N@@H+](CCCc1ccsc1)C1CC1 ZINC000541161653 388843382 /nfs/dbraw/zinc/84/33/82/388843382.db2.gz QRNJNIOMMWPFQW-UHFFFAOYSA-N 1 1 237.412 3.945 20 0 BHADMO CC[C@H]1CCCC[N@H+]1CCCc1ccsc1 ZINC000541162271 388843094 /nfs/dbraw/zinc/84/30/94/388843094.db2.gz UKWWTJHNICSAAE-AWEZNQCLSA-N 1 1 237.412 3.945 20 0 BHADMO CC[C@@H]1CCCC[N@H+]1CCCc1ccsc1 ZINC000541162272 388843471 /nfs/dbraw/zinc/84/34/71/388843471.db2.gz UKWWTJHNICSAAE-CQSZACIVSA-N 1 1 237.412 3.945 20 0 BHADMO CC[C@@H]1C[C@H](C)C[N@H+]1CCCc1ccsc1 ZINC000541172559 388842793 /nfs/dbraw/zinc/84/27/93/388842793.db2.gz DRCROCVIXCUERB-GXTWGEPZSA-N 1 1 237.412 3.801 20 0 BHADMO CC[C@H]1C[C@H](C)C[N@H+]1CCCc1ccsc1 ZINC000541172560 388842306 /nfs/dbraw/zinc/84/23/06/388842306.db2.gz DRCROCVIXCUERB-JSGCOSHPSA-N 1 1 237.412 3.801 20 0 BHADMO CC[C@H]1C[C@@H](C)C[N@H+]1CCCc1ccsc1 ZINC000541172562 388843028 /nfs/dbraw/zinc/84/30/28/388843028.db2.gz DRCROCVIXCUERB-OCCSQVGLSA-N 1 1 237.412 3.801 20 0 BHADMO CC[C@@H]1C[C@@H](C)C[N@H+]1CCCc1ccsc1 ZINC000541172563 388843498 /nfs/dbraw/zinc/84/34/98/388843498.db2.gz DRCROCVIXCUERB-TZMCWYRMSA-N 1 1 237.412 3.801 20 0 BHADMO CC[C@@H]1CCC[N@H+]1CCCc1ccsc1 ZINC000541173566 388842956 /nfs/dbraw/zinc/84/29/56/388842956.db2.gz HXRYLACXVKCXAG-CYBMUJFWSA-N 1 1 223.385 3.555 20 0 BHADMO CC[C@H]1CCC[N@H+]1CCCc1ccsc1 ZINC000541173570 388842705 /nfs/dbraw/zinc/84/27/05/388842705.db2.gz HXRYLACXVKCXAG-ZDUSSCGKSA-N 1 1 223.385 3.555 20 0 BHADMO C[C@H]1C[N@@H+](CCCc2ccsc2)C(C)(C)C1 ZINC000541173675 388842828 /nfs/dbraw/zinc/84/28/28/388842828.db2.gz KGGYHTMIIRVDED-GFCCVEGCSA-N 1 1 237.412 3.801 20 0 BHADMO C[C@@H]1C[N@@H+](CCCc2ccsc2)C(C)(C)C1 ZINC000541173678 388843409 /nfs/dbraw/zinc/84/34/09/388843409.db2.gz KGGYHTMIIRVDED-LBPRGKRZSA-N 1 1 237.412 3.801 20 0 BHADMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCCc1ccsc1 ZINC000541173756 388842222 /nfs/dbraw/zinc/84/22/22/388842222.db2.gz YCNBPFVDCDBGMD-BETUJISGSA-N 1 1 237.412 3.944 20 0 BHADMO C[C@H](Cc1ccsc1)[N@@H+](C)Cc1ccccc1 ZINC000541196720 388842424 /nfs/dbraw/zinc/84/24/24/388842424.db2.gz WIFROYKJHNUXDP-CYBMUJFWSA-N 1 1 245.391 3.811 20 0 BHADMO C[C@@H](Cc1ccsc1)[N@@H+](C)Cc1ccccc1 ZINC000541196721 388842554 /nfs/dbraw/zinc/84/25/54/388842554.db2.gz WIFROYKJHNUXDP-ZDUSSCGKSA-N 1 1 245.391 3.811 20 0 BHADMO C[C@H](Cc1ccsc1)[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC000541200173 388843278 /nfs/dbraw/zinc/84/32/78/388843278.db2.gz BOMKOPUKMHLNRJ-FRRDWIJNSA-N 1 1 237.412 3.657 20 0 BHADMO C[C@@H](Cc1ccsc1)[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC000541200176 388842503 /nfs/dbraw/zinc/84/25/03/388842503.db2.gz BOMKOPUKMHLNRJ-XQQFMLRXSA-N 1 1 237.412 3.657 20 0 BHADMO CC(C)C[N@@H+]([C@H](C)Cc1ccsc1)C1CC1 ZINC000541200671 388843273 /nfs/dbraw/zinc/84/32/73/388843273.db2.gz TWMDWSUIILPAGP-GFCCVEGCSA-N 1 1 237.412 3.800 20 0 BHADMO CC(C)C[N@@H+]([C@@H](C)Cc1ccsc1)C1CC1 ZINC000541200672 388843343 /nfs/dbraw/zinc/84/33/43/388843343.db2.gz TWMDWSUIILPAGP-LBPRGKRZSA-N 1 1 237.412 3.800 20 0 BHADMO C[C@H]1c2ccccc2C[N@H+]1[C@@H]1C=CCCC1 ZINC000541203378 388844155 /nfs/dbraw/zinc/84/41/55/388844155.db2.gz VAEVDRPCVNNKQY-GXTWGEPZSA-N 1 1 213.324 3.672 20 0 BHADMO C[C@H]1c2ccccc2C[N@H+]1[C@H]1C=CCCC1 ZINC000541203379 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ZINC000541221328 388844059 /nfs/dbraw/zinc/84/40/59/388844059.db2.gz QKFHWMZGMNDRPO-NSHDSACASA-N 1 1 223.385 3.552 20 0 BHADMO CC[C@H]1CCC[N@H+]1[C@@H](C)Cc1ccsc1 ZINC000541221500 388844853 /nfs/dbraw/zinc/84/48/53/388844853.db2.gz QVDVSTPVHVQWEN-AAEUAGOBSA-N 1 1 223.385 3.554 20 0 BHADMO CC[C@@H]1CCC[N@H+]1[C@H](C)Cc1ccsc1 ZINC000541221501 388845150 /nfs/dbraw/zinc/84/51/50/388845150.db2.gz QVDVSTPVHVQWEN-DGCLKSJQSA-N 1 1 223.385 3.554 20 0 BHADMO CC[C@@H]1CCC[N@H+]1[C@@H](C)Cc1ccsc1 ZINC000541221502 388843313 /nfs/dbraw/zinc/84/33/13/388843313.db2.gz QVDVSTPVHVQWEN-WCQYABFASA-N 1 1 223.385 3.554 20 0 BHADMO CC[C@H]1CCC[N@H+]1[C@H](C)Cc1ccsc1 ZINC000541221503 388843015 /nfs/dbraw/zinc/84/30/15/388843015.db2.gz QVDVSTPVHVQWEN-YPMHNXCESA-N 1 1 223.385 3.554 20 0 BHADMO CC[N@@H+](CC(C)C)[C@H](C)Cc1ccsc1 ZINC000541221522 388843899 /nfs/dbraw/zinc/84/38/99/388843899.db2.gz RPMKAOJYYKIMGT-GFCCVEGCSA-N 1 1 225.401 3.657 20 0 BHADMO CC[N@@H+](CC(C)C)[C@@H](C)Cc1ccsc1 ZINC000541221531 388842645 /nfs/dbraw/zinc/84/26/45/388842645.db2.gz RPMKAOJYYKIMGT-LBPRGKRZSA-N 1 1 225.401 3.657 20 0 BHADMO C[C@H](Cc1ccsc1)[N@H+]1CCC[C@H]1C1CCC1 ZINC000541221566 388845222 /nfs/dbraw/zinc/84/52/22/388845222.db2.gz JHYVEKQBIPUELK-DOMZBBRYSA-N 1 1 249.423 3.944 20 0 BHADMO C[C@H](Cc1ccsc1)[N@H+]1CCC[C@@H]1C1CCC1 ZINC000541221571 388844270 /nfs/dbraw/zinc/84/42/70/388844270.db2.gz JHYVEKQBIPUELK-IUODEOHRSA-N 1 1 249.423 3.944 20 0 BHADMO C[C@@H](Cc1ccsc1)[N@H+]1CCC[C@@H]1C1CCC1 ZINC000541221573 388845390 /nfs/dbraw/zinc/84/53/90/388845390.db2.gz JHYVEKQBIPUELK-SWLSCSKDSA-N 1 1 249.423 3.944 20 0 BHADMO C[C@@H](Cc1ccsc1)[N@H+]1CCC[C@H]1C1CCC1 ZINC000541221574 388844930 /nfs/dbraw/zinc/84/49/30/388844930.db2.gz JHYVEKQBIPUELK-WFASDCNBSA-N 1 1 249.423 3.944 20 0 BHADMO CC[C@@H]1CCC[N@H+]([C@H](C)Cc2ccsc2)C1 ZINC000541224687 388845126 /nfs/dbraw/zinc/84/51/26/388845126.db2.gz FNVSYJXIOLVGTI-CHWSQXEVSA-N 1 1 237.412 3.801 20 0 BHADMO CC[C@H]1CCC[N@H+]([C@H](C)Cc2ccsc2)C1 ZINC000541224688 388845352 /nfs/dbraw/zinc/84/53/52/388845352.db2.gz FNVSYJXIOLVGTI-OLZOCXBDSA-N 1 1 237.412 3.801 20 0 BHADMO CC[C@@H]1CCC[N@H+]([C@@H](C)Cc2ccsc2)C1 ZINC000541224689 388844537 /nfs/dbraw/zinc/84/45/37/388844537.db2.gz FNVSYJXIOLVGTI-QWHCGFSZSA-N 1 1 237.412 3.801 20 0 BHADMO CC[C@H]1CCC[N@H+]([C@@H](C)Cc2ccsc2)C1 ZINC000541224690 388844108 /nfs/dbraw/zinc/84/41/08/388844108.db2.gz FNVSYJXIOLVGTI-STQMWFEESA-N 1 1 237.412 3.801 20 0 BHADMO C[C@@H](Cc1ccsc1)[N@H+]1CCC[C@@H](C)[C@@H]1C ZINC000541224977 388844097 /nfs/dbraw/zinc/84/40/97/388844097.db2.gz JFNJIRBNWYRLEI-AGIUHOORSA-N 1 1 237.412 3.800 20 0 BHADMO C[C@@H](Cc1ccsc1)[N@H+]1CCC[C@@H](C)[C@H]1C ZINC000541224978 388844470 /nfs/dbraw/zinc/84/44/70/388844470.db2.gz JFNJIRBNWYRLEI-FRRDWIJNSA-N 1 1 237.412 3.800 20 0 BHADMO C[C@H](Cc1ccsc1)[N@H+]1CCC[C@@H](C)[C@H]1C ZINC000541224979 388844018 /nfs/dbraw/zinc/84/40/18/388844018.db2.gz JFNJIRBNWYRLEI-JHJVBQTASA-N 1 1 237.412 3.800 20 0 BHADMO C[C@H](Cc1ccsc1)[N@H+]1CCC[C@@H](C)[C@@H]1C ZINC000541224980 388844461 /nfs/dbraw/zinc/84/44/61/388844461.db2.gz JFNJIRBNWYRLEI-UPJWGTAASA-N 1 1 237.412 3.800 20 0 BHADMO CCC(CC)(CC)C[N@@H+](C)C[C@@H]1CCCOC1 ZINC000541228480 388845336 /nfs/dbraw/zinc/84/53/36/388845336.db2.gz DJCLTYZULXAEIX-AWEZNQCLSA-N 1 1 241.419 3.561 20 0 BHADMO CCC(CC)(CC)C[N@@H+](C)C[C@H]1CCCOC1 ZINC000541228482 388845310 /nfs/dbraw/zinc/84/53/10/388845310.db2.gz DJCLTYZULXAEIX-CQSZACIVSA-N 1 1 241.419 3.561 20 0 BHADMO CC[C@@H](C)C[N@@H+](C)[C@@H](C)Cc1ccsc1 ZINC000541236368 388843205 /nfs/dbraw/zinc/84/32/05/388843205.db2.gz GJHOVSCPUAKPJK-NEPJUHHUSA-N 1 1 225.401 3.657 20 0 BHADMO CC[C@H](C)C[N@@H+](C)[C@H](C)Cc1ccsc1 ZINC000541236369 388843482 /nfs/dbraw/zinc/84/34/82/388843482.db2.gz GJHOVSCPUAKPJK-NWDGAFQWSA-N 1 1 225.401 3.657 20 0 BHADMO CC[C@H](C)C[N@@H+](C)[C@@H](C)Cc1ccsc1 ZINC000541236370 388843166 /nfs/dbraw/zinc/84/31/66/388843166.db2.gz GJHOVSCPUAKPJK-RYUDHWBXSA-N 1 1 225.401 3.657 20 0 BHADMO CC[C@@H](C)C[N@@H+](C)[C@H](C)Cc1ccsc1 ZINC000541236371 388842542 /nfs/dbraw/zinc/84/25/42/388842542.db2.gz GJHOVSCPUAKPJK-VXGBXAGGSA-N 1 1 225.401 3.657 20 0 BHADMO CC(C)[N@@H+]([C@H](C)Cc1ccsc1)C1CCC1 ZINC000541236383 388844816 /nfs/dbraw/zinc/84/48/16/388844816.db2.gz HDOWYXRONALNDU-GFCCVEGCSA-N 1 1 237.412 3.942 20 0 BHADMO CC(C)[N@@H+]([C@@H](C)Cc1ccsc1)C1CCC1 ZINC000541236384 388844501 /nfs/dbraw/zinc/84/45/01/388844501.db2.gz HDOWYXRONALNDU-LBPRGKRZSA-N 1 1 237.412 3.942 20 0 BHADMO Cc1ccoc1C[N@@H+]1C[C@H](C)[C@H]2CCCC[C@H]21 ZINC000541254978 388846720 /nfs/dbraw/zinc/84/67/20/388846720.db2.gz DVHMMFMVLLIMIY-BFHYXJOUSA-N 1 1 233.355 3.599 20 0 BHADMO Cc1ccoc1C[N@@H+]1C[C@H](C)[C@@H]2CCCC[C@@H]21 ZINC000541255014 388846356 /nfs/dbraw/zinc/84/63/56/388846356.db2.gz DVHMMFMVLLIMIY-IHRRRGAJSA-N 1 1 233.355 3.599 20 0 BHADMO Cc1ccoc1C[N@@H+]1C[C@H](C)[C@@H]2CCCC[C@H]21 ZINC000541255015 388845890 /nfs/dbraw/zinc/84/58/90/388845890.db2.gz DVHMMFMVLLIMIY-MELADBBJSA-N 1 1 233.355 3.599 20 0 BHADMO Cc1ccoc1C[N@@H+]1C[C@H](C)[C@H]2CCCC[C@@H]21 ZINC000541255016 388846378 /nfs/dbraw/zinc/84/63/78/388846378.db2.gz DVHMMFMVLLIMIY-MJBXVCDLSA-N 1 1 233.355 3.599 20 0 BHADMO C[C@@H]1C[N@@H+](Cc2cccs2)[C@H]2CCCC[C@H]12 ZINC000541255184 388846031 /nfs/dbraw/zinc/84/60/31/388846031.db2.gz MVFBCNOOZXADRR-BNOWGMLFSA-N 1 1 235.396 3.759 20 0 BHADMO C[C@@H]1C[N@@H+](Cc2cccs2)[C@@H]2CCCC[C@H]21 ZINC000541255186 388845851 /nfs/dbraw/zinc/84/58/51/388845851.db2.gz MVFBCNOOZXADRR-KWCYVHTRSA-N 1 1 235.396 3.759 20 0 BHADMO C[C@@H]1C[N@@H+](Cc2cccs2)[C@@H]2CCCC[C@@H]21 ZINC000541255187 388846794 /nfs/dbraw/zinc/84/67/94/388846794.db2.gz MVFBCNOOZXADRR-MRVWCRGKSA-N 1 1 235.396 3.759 20 0 BHADMO C[C@@H]1C[N@@H+](Cc2cccs2)[C@H]2CCCC[C@@H]12 ZINC000541255190 388846613 /nfs/dbraw/zinc/84/66/13/388846613.db2.gz MVFBCNOOZXADRR-XBFCOCLRSA-N 1 1 235.396 3.759 20 0 BHADMO C[C@@H]1C[N@@H+](CC(C)(C)C)[C@H]2CCCC[C@@H]12 ZINC000541255801 388846443 /nfs/dbraw/zinc/84/64/43/388846443.db2.gz WKLMAIIWDARUKM-AGIUHOORSA-N 1 1 209.377 3.543 20 0 BHADMO C[C@@H]1C[N@@H+](CC(C)(C)C)[C@@H]2CCCC[C@H]21 ZINC000541255802 388846171 /nfs/dbraw/zinc/84/61/71/388846171.db2.gz WKLMAIIWDARUKM-FRRDWIJNSA-N 1 1 209.377 3.543 20 0 BHADMO C[C@@H]1C[N@@H+](CC(C)(C)C)[C@@H]2CCCC[C@@H]21 ZINC000541255803 388846460 /nfs/dbraw/zinc/84/64/60/388846460.db2.gz WKLMAIIWDARUKM-JHJVBQTASA-N 1 1 209.377 3.543 20 0 BHADMO C[C@@H]1C[N@@H+](CC(C)(C)C)[C@H]2CCCC[C@H]12 ZINC000541255804 388846023 /nfs/dbraw/zinc/84/60/23/388846023.db2.gz WKLMAIIWDARUKM-UPJWGTAASA-N 1 1 209.377 3.543 20 0 BHADMO Cc1ccc(CCC[N@H+](C)CC(C)C)cc1 ZINC000541270468 388846272 /nfs/dbraw/zinc/84/62/72/388846272.db2.gz YGHFHQNJAJPHIA-UHFFFAOYSA-N 1 1 219.372 3.515 20 0 BHADMO CCC[N@@H+](C)[C@@H]1CCc2ccc(Cl)cc21 ZINC000541271500 388846598 /nfs/dbraw/zinc/84/65/98/388846598.db2.gz GQGKXOUVPOUXEY-CYBMUJFWSA-N 1 1 223.747 3.669 20 0 BHADMO CCC[N@@H+](C)[C@H]1CCc2ccc(Cl)cc21 ZINC000541271501 388846479 /nfs/dbraw/zinc/84/64/79/388846479.db2.gz GQGKXOUVPOUXEY-ZDUSSCGKSA-N 1 1 223.747 3.669 20 0 BHADMO CCC[N@@H+](C)CCCc1ccccc1Cl ZINC000541271826 388846079 /nfs/dbraw/zinc/84/60/79/388846079.db2.gz FXAXODJEWVRVQL-UHFFFAOYSA-N 1 1 225.763 3.614 20 0 BHADMO CC(C)c1ccc([C@H](C)[N@H+]2CCCOCC2)cc1 ZINC000541272060 388845969 /nfs/dbraw/zinc/84/59/69/388845969.db2.gz GSECLGWEJQDUSV-AWEZNQCLSA-N 1 1 247.382 3.593 20 0 BHADMO CC(C)c1ccc([C@@H](C)[N@H+]2CCCOCC2)cc1 ZINC000541272061 388846903 /nfs/dbraw/zinc/84/69/03/388846903.db2.gz GSECLGWEJQDUSV-CQSZACIVSA-N 1 1 247.382 3.593 20 0 BHADMO Cc1ccc(CCC[N@H+](C)Cc2ccco2)cc1 ZINC000541281221 388848084 /nfs/dbraw/zinc/84/80/84/388848084.db2.gz NHJLYLIOFCTIGG-UHFFFAOYSA-N 1 1 243.350 3.653 20 0 BHADMO C[N@@H+](CCCc1ccsc1)C[C@H]1CC=CCC1 ZINC000541313902 388847818 /nfs/dbraw/zinc/84/78/18/388847818.db2.gz UGEZDDKILYLOAK-AWEZNQCLSA-N 1 1 249.423 3.969 20 0 BHADMO C[N@@H+](CCCc1ccsc1)C[C@@H]1CC=CCC1 ZINC000541313903 388848097 /nfs/dbraw/zinc/84/80/97/388848097.db2.gz UGEZDDKILYLOAK-CQSZACIVSA-N 1 1 249.423 3.969 20 0 BHADMO CCCC[N@H+]1C[C@@H](C)C[C@H]1c1cccc(OC)c1 ZINC000541317085 388848028 /nfs/dbraw/zinc/84/80/28/388848028.db2.gz XCOIIFQPOLZZIS-BBRMVZONSA-N 1 1 247.382 3.878 20 0 BHADMO CCCC[N@H+]1C[C@H](C)C[C@H]1c1cccc(OC)c1 ZINC000541317086 388847484 /nfs/dbraw/zinc/84/74/84/388847484.db2.gz XCOIIFQPOLZZIS-CJNGLKHVSA-N 1 1 247.382 3.878 20 0 BHADMO CCCC[N@H+]1C[C@H](C)C[C@@H]1c1cccc(OC)c1 ZINC000541317087 388848698 /nfs/dbraw/zinc/84/86/98/388848698.db2.gz XCOIIFQPOLZZIS-CZUORRHYSA-N 1 1 247.382 3.878 20 0 BHADMO CCCC[N@H+]1C[C@@H](C)C[C@@H]1c1cccc(OC)c1 ZINC000541317088 388848551 /nfs/dbraw/zinc/84/85/51/388848551.db2.gz XCOIIFQPOLZZIS-XJKSGUPXSA-N 1 1 247.382 3.878 20 0 BHADMO CC[N@@H+](CCCO)[C@@H](C)c1ccc(C(C)C)cc1 ZINC000541348006 388850612 /nfs/dbraw/zinc/85/06/12/388850612.db2.gz HBRFGISCTVDKER-AWEZNQCLSA-N 1 1 249.398 3.575 20 0 BHADMO CC[N@@H+](CCCO)[C@H](C)c1ccc(C(C)C)cc1 ZINC000541348007 388849545 /nfs/dbraw/zinc/84/95/45/388849545.db2.gz HBRFGISCTVDKER-CQSZACIVSA-N 1 1 249.398 3.575 20 0 BHADMO C[N@@H+](CCCc1ccccc1Cl)C1CCC1 ZINC000541350262 388850184 /nfs/dbraw/zinc/85/01/84/388850184.db2.gz YVXZAJSYFKZJMD-UHFFFAOYSA-N 1 1 237.774 3.757 20 0 BHADMO CCC[N@H+]1CC[C@H](c2cc(C)cc(C)c2)C1 ZINC000541391226 388849494 /nfs/dbraw/zinc/84/94/94/388849494.db2.gz WUDIRKRPYFDRPL-AWEZNQCLSA-N 1 1 217.356 3.503 20 0 BHADMO CCC[N@H+]1CC[C@@H](c2cc(C)cc(C)c2)C1 ZINC000541391228 388850707 /nfs/dbraw/zinc/85/07/07/388850707.db2.gz WUDIRKRPYFDRPL-CQSZACIVSA-N 1 1 217.356 3.503 20 0 BHADMO Cc1ccc([C@H]2CC[N@H+]([C@@H]3C=CCCC3)C2)cc1 ZINC000541391734 388850551 /nfs/dbraw/zinc/85/05/51/388850551.db2.gz AHVCQUALKQLWHP-DLBZAZTESA-N 1 1 241.378 3.893 20 0 BHADMO Cc1ccc([C@@H]2CC[N@H+]([C@@H]3C=CCCC3)C2)cc1 ZINC000541391742 388850619 /nfs/dbraw/zinc/85/06/19/388850619.db2.gz AHVCQUALKQLWHP-IAGOWNOFSA-N 1 1 241.378 3.893 20 0 BHADMO Cc1ccc([C@H]2CC[N@H+]([C@H]3C=CCCC3)C2)cc1 ZINC000541391743 388849221 /nfs/dbraw/zinc/84/92/21/388849221.db2.gz AHVCQUALKQLWHP-IRXDYDNUSA-N 1 1 241.378 3.893 20 0 BHADMO Cc1ccc([C@@H]2CC[N@H+]([C@H]3C=CCCC3)C2)cc1 ZINC000541391744 388849260 /nfs/dbraw/zinc/84/92/60/388849260.db2.gz AHVCQUALKQLWHP-SJORKVTESA-N 1 1 241.378 3.893 20 0 BHADMO Cc1ccc([C@H]2CC[N@@H+](CCC3CC3)C2)cc1 ZINC000541392596 388849862 /nfs/dbraw/zinc/84/98/62/388849862.db2.gz IQZMDTVYGARGHX-INIZCTEOSA-N 1 1 229.367 3.584 20 0 BHADMO Cc1ccc([C@@H]2CC[N@@H+](CCC3CC3)C2)cc1 ZINC000541392598 388849832 /nfs/dbraw/zinc/84/98/32/388849832.db2.gz IQZMDTVYGARGHX-MRXNPFEDSA-N 1 1 229.367 3.584 20 0 BHADMO CCC(C)(C)CC[N@@H+](C)CCc1ccccc1O ZINC000541393776 388850671 /nfs/dbraw/zinc/85/06/71/388850671.db2.gz ROQDZSVIBOVKRF-UHFFFAOYSA-N 1 1 249.398 3.693 20 0 BHADMO CCSCC[N@H+]1CC[C@H](c2ccc(C)cc2)C1 ZINC000541394442 388850628 /nfs/dbraw/zinc/85/06/28/388850628.db2.gz VCEIHHYJPAZTSB-HNNXBMFYSA-N 1 1 249.423 3.537 20 0 BHADMO CCSCC[N@H+]1CC[C@@H](c2ccc(C)cc2)C1 ZINC000541394443 388850027 /nfs/dbraw/zinc/85/00/27/388850027.db2.gz VCEIHHYJPAZTSB-OAHLLOKOSA-N 1 1 249.423 3.537 20 0 BHADMO CCc1cnc(C[N@@H+](C)[C@@H](C)C(C)(C)C)s1 ZINC000541534650 388854812 /nfs/dbraw/zinc/85/48/12/388854812.db2.gz UHVATBVANLKIIE-JTQLQIEISA-N 1 1 240.416 3.572 20 0 BHADMO CCc1cnc(C[N@@H+](C)[C@H](C)C(C)(C)C)s1 ZINC000541534654 388854191 /nfs/dbraw/zinc/85/41/91/388854191.db2.gz UHVATBVANLKIIE-SNVBAGLBSA-N 1 1 240.416 3.572 20 0 BHADMO Cc1cc(C[N@H+]2CCC2(C)C)cc2cccnc12 ZINC000541535348 388855352 /nfs/dbraw/zinc/85/53/52/388855352.db2.gz AVHAZOKHSASUHK-UHFFFAOYSA-N 1 1 240.350 3.528 20 0 BHADMO C[C@H]1CCCC[C@@H]1C[N@@H+](C)Cc1cccc(O)c1 ZINC000541537602 388854717 /nfs/dbraw/zinc/85/47/17/388854717.db2.gz VZDKSHGILPZEQS-DZGCQCFKSA-N 1 1 247.382 3.650 20 0 BHADMO C[C@@H]1CCCC[C@H]1C[N@@H+](C)Cc1cccc(O)c1 ZINC000541537603 388854203 /nfs/dbraw/zinc/85/42/03/388854203.db2.gz VZDKSHGILPZEQS-HIFRSBDPSA-N 1 1 247.382 3.650 20 0 BHADMO C[C@@H]1CCCC[C@@H]1C[N@@H+](C)Cc1cccc(O)c1 ZINC000541537604 388855181 /nfs/dbraw/zinc/85/51/81/388855181.db2.gz VZDKSHGILPZEQS-UKRRQHHQSA-N 1 1 247.382 3.650 20 0 BHADMO C[C@H]1CCCC[C@H]1C[N@@H+](C)Cc1cccc(O)c1 ZINC000541537605 388855561 /nfs/dbraw/zinc/85/55/61/388855561.db2.gz VZDKSHGILPZEQS-ZFWWWQNUSA-N 1 1 247.382 3.650 20 0 BHADMO COc1ccccc1C[N@H+]1CC[C@H](C(C)(C)C)C1 ZINC000541551402 388856098 /nfs/dbraw/zinc/85/60/98/388856098.db2.gz LOGOSFZKMHTGJT-AWEZNQCLSA-N 1 1 247.382 3.563 20 0 BHADMO COc1ccccc1C[N@H+]1CC[C@@H](C(C)(C)C)C1 ZINC000541551403 388856205 /nfs/dbraw/zinc/85/62/05/388856205.db2.gz LOGOSFZKMHTGJT-CQSZACIVSA-N 1 1 247.382 3.563 20 0 BHADMO Cc1cccc([C@H]2CC[N@@H+](Cc3ccco3)C2)c1 ZINC000541553366 388857057 /nfs/dbraw/zinc/85/70/57/388857057.db2.gz FBIGUJCKMANYLA-HNNXBMFYSA-N 1 1 241.334 3.578 20 0 BHADMO Cc1cccc([C@@H]2CC[N@@H+](Cc3ccco3)C2)c1 ZINC000541553367 388856849 /nfs/dbraw/zinc/85/68/49/388856849.db2.gz FBIGUJCKMANYLA-OAHLLOKOSA-N 1 1 241.334 3.578 20 0 BHADMO C[C@@H](Cc1ccsc1)[N@@H+](C)C[C@H]1CC=CCC1 ZINC000541553488 388856695 /nfs/dbraw/zinc/85/66/95/388856695.db2.gz QSQFKBVUJDFHJB-KBPBESRZSA-N 1 1 249.423 3.967 20 0 BHADMO C[C@H](Cc1ccsc1)[N@@H+](C)C[C@H]1CC=CCC1 ZINC000541553489 388857109 /nfs/dbraw/zinc/85/71/09/388857109.db2.gz QSQFKBVUJDFHJB-KGLIPLIRSA-N 1 1 249.423 3.967 20 0 BHADMO C[C@@H](Cc1ccsc1)[N@@H+](C)C[C@@H]1CC=CCC1 ZINC000541553490 388857267 /nfs/dbraw/zinc/85/72/67/388857267.db2.gz QSQFKBVUJDFHJB-UONOGXRCSA-N 1 1 249.423 3.967 20 0 BHADMO C[C@H](Cc1ccsc1)[N@@H+](C)C[C@@H]1CC=CCC1 ZINC000541553491 388856934 /nfs/dbraw/zinc/85/69/34/388856934.db2.gz QSQFKBVUJDFHJB-ZIAGYGMSSA-N 1 1 249.423 3.967 20 0 BHADMO CCc1ccc(C[N@@H+](C)C[C@@H]2CC=CCC2)o1 ZINC000541554287 388856787 /nfs/dbraw/zinc/85/67/87/388856787.db2.gz YMBOENGCKMRSJD-CYBMUJFWSA-N 1 1 233.355 3.630 20 0 BHADMO CCc1ccc(C[N@@H+](C)C[C@H]2CC=CCC2)o1 ZINC000541554352 388855608 /nfs/dbraw/zinc/85/56/08/388855608.db2.gz YMBOENGCKMRSJD-ZDUSSCGKSA-N 1 1 233.355 3.630 20 0 BHADMO C[C@@H](Cc1ccccc1)C[N@@H+](C)CCC1CC1 ZINC000541588199 388858673 /nfs/dbraw/zinc/85/86/73/388858673.db2.gz XTGIUNWDLIMOEL-AWEZNQCLSA-N 1 1 231.383 3.597 20 0 BHADMO C[C@H](Cc1ccccc1)C[N@@H+](C)CCC1CC1 ZINC000541588200 388857934 /nfs/dbraw/zinc/85/79/34/388857934.db2.gz XTGIUNWDLIMOEL-CQSZACIVSA-N 1 1 231.383 3.597 20 0 BHADMO Cc1ccc[nH+]c1NC[C@H](C)Cc1ccccc1 ZINC000541588343 388858268 /nfs/dbraw/zinc/85/82/68/388858268.db2.gz DWGGAIGYSCDNOC-CYBMUJFWSA-N 1 1 240.350 3.681 20 0 BHADMO Cc1ccc[nH+]c1NC[C@@H](C)Cc1ccccc1 ZINC000541588344 324966896 /nfs/dbraw/zinc/96/68/96/324966896.db2.gz DWGGAIGYSCDNOC-ZDUSSCGKSA-N 1 1 240.350 3.681 20 0 BHADMO CCCCC[N@@H+](CC[C@@H]1CCCCO1)C(C)C ZINC000541589661 388857684 /nfs/dbraw/zinc/85/76/84/388857684.db2.gz DPEZQGSZVFXMDS-HNNXBMFYSA-N 1 1 241.419 3.846 20 0 BHADMO CCCCC[N@@H+](CC[C@H]1CCCCO1)C(C)C ZINC000541589662 388858101 /nfs/dbraw/zinc/85/81/01/388858101.db2.gz DPEZQGSZVFXMDS-OAHLLOKOSA-N 1 1 241.419 3.846 20 0 BHADMO C[N@@H+](CC[C@@H]1CCCCO1)C1CCCCCC1 ZINC000541590271 388858202 /nfs/dbraw/zinc/85/82/02/388858202.db2.gz RJWJOHZKDIUXKB-HNNXBMFYSA-N 1 1 239.403 3.600 20 0 BHADMO C[N@@H+](CC[C@H]1CCCCO1)C1CCCCCC1 ZINC000541590272 388858021 /nfs/dbraw/zinc/85/80/21/388858021.db2.gz RJWJOHZKDIUXKB-OAHLLOKOSA-N 1 1 239.403 3.600 20 0 BHADMO C[N@@H+](CCCc1ccncc1)C1CCCCCC1 ZINC000541590753 388860441 /nfs/dbraw/zinc/86/04/41/388860441.db2.gz AWGGLWYSYRJFQG-UHFFFAOYSA-N 1 1 246.398 3.669 20 0 BHADMO CCC(CC)[N@@H+](CC[C@@H]1CCCCO1)C1CC1 ZINC000541591797 388859463 /nfs/dbraw/zinc/85/94/63/388859463.db2.gz ZLLRLFIRDNBXRL-HNNXBMFYSA-N 1 1 239.403 3.599 20 0 BHADMO CCC(CC)[N@@H+](CC[C@H]1CCCCO1)C1CC1 ZINC000541591798 388859686 /nfs/dbraw/zinc/85/96/86/388859686.db2.gz ZLLRLFIRDNBXRL-OAHLLOKOSA-N 1 1 239.403 3.599 20 0 BHADMO CCC[C@H]1CCCC[N@H+]1CCC(F)(F)F ZINC000541694585 388864600 /nfs/dbraw/zinc/86/46/00/388864600.db2.gz DJUMULBZMMNVLW-JTQLQIEISA-N 1 1 223.282 3.593 20 0 BHADMO CCC[C@@H]1CCCC[N@H+]1CCC(F)(F)F ZINC000541694586 388864761 /nfs/dbraw/zinc/86/47/61/388864761.db2.gz DJUMULBZMMNVLW-SNVBAGLBSA-N 1 1 223.282 3.593 20 0 BHADMO CCC(CC)(CC)C[N@H+]1CCCSCC1 ZINC000541761794 388867519 /nfs/dbraw/zinc/86/75/19/388867519.db2.gz YUXUJLSBFOGXDU-UHFFFAOYSA-N 1 1 229.433 3.642 20 0 BHADMO CC[C@@H]1CCC[C@H](C[N@@H+](C)Cc2ccccn2)C1 ZINC000541763838 388867389 /nfs/dbraw/zinc/86/73/89/388867389.db2.gz XPCIBOOHZXKZRG-CABCVRRESA-N 1 1 246.398 3.730 20 0 BHADMO CC[C@H]1CCC[C@H](C[N@@H+](C)Cc2ccccn2)C1 ZINC000541763839 388867703 /nfs/dbraw/zinc/86/77/03/388867703.db2.gz XPCIBOOHZXKZRG-GJZGRUSLSA-N 1 1 246.398 3.730 20 0 BHADMO CC[C@@H]1CCC[C@@H](C[N@@H+](C)Cc2ccccn2)C1 ZINC000541763840 388866789 /nfs/dbraw/zinc/86/67/89/388866789.db2.gz XPCIBOOHZXKZRG-HUUCEWRRSA-N 1 1 246.398 3.730 20 0 BHADMO CC[C@H]1CCC[C@@H](C[N@@H+](C)Cc2ccccn2)C1 ZINC000541763841 388867711 /nfs/dbraw/zinc/86/77/11/388867711.db2.gz XPCIBOOHZXKZRG-LSDHHAIUSA-N 1 1 246.398 3.730 20 0 BHADMO CCCC[N@@H+](C)C/C=C/c1ccc(F)cc1F ZINC000541768773 388867333 /nfs/dbraw/zinc/86/73/33/388867333.db2.gz OGPDGKCWWZYUBT-AATRIKPKSA-N 1 1 239.309 3.710 20 0 BHADMO CCCC[N@@H+](C)C/C=C\c1ccc(F)cc1F ZINC000541768774 388867084 /nfs/dbraw/zinc/86/70/84/388867084.db2.gz OGPDGKCWWZYUBT-WAYWQWQTSA-N 1 1 239.309 3.710 20 0 BHADMO Fc1ccc(/C=C/C[N@H+]2CCC23CCC3)c(F)c1 ZINC000541769568 388866831 /nfs/dbraw/zinc/86/68/31/388866831.db2.gz BEQXYZNTAITJOP-HNQUOIGGSA-N 1 1 249.304 3.606 20 0 BHADMO Fc1ccc(/C=C\C[N@H+]2CCC23CCC3)c(F)c1 ZINC000541769570 388867604 /nfs/dbraw/zinc/86/76/04/388867604.db2.gz BEQXYZNTAITJOP-IWQZZHSRSA-N 1 1 249.304 3.606 20 0 BHADMO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2ccon2)cc1C ZINC000541771191 324979111 /nfs/dbraw/zinc/97/91/11/324979111.db2.gz FCPBLZDIMQXNHZ-CHWSQXEVSA-N 1 1 244.338 3.703 20 0 BHADMO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccon2)cc1C ZINC000541771196 388867581 /nfs/dbraw/zinc/86/75/81/388867581.db2.gz FCPBLZDIMQXNHZ-OLZOCXBDSA-N 1 1 244.338 3.703 20 0 BHADMO Cc1ccc([C@H](C)[NH2+][C@H](C)c2ccon2)cc1C ZINC000541771198 323146536 /nfs/dbraw/zinc/14/65/36/323146536.db2.gz FCPBLZDIMQXNHZ-QWHCGFSZSA-N 1 1 244.338 3.703 20 0 BHADMO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2ccon2)cc1C ZINC000541771201 323146499 /nfs/dbraw/zinc/14/64/99/323146499.db2.gz FCPBLZDIMQXNHZ-STQMWFEESA-N 1 1 244.338 3.703 20 0 BHADMO CCC[N@@H+](CC)C/C=C/c1ccc(F)cc1F ZINC000541771434 388866783 /nfs/dbraw/zinc/86/67/83/388866783.db2.gz IIWHUGHIHJCULQ-AATRIKPKSA-N 1 1 239.309 3.710 20 0 BHADMO CCC[N@@H+](CC)C/C=C\c1ccc(F)cc1F ZINC000541771435 388867541 /nfs/dbraw/zinc/86/75/41/388867541.db2.gz IIWHUGHIHJCULQ-WAYWQWQTSA-N 1 1 239.309 3.710 20 0 BHADMO CCC[C@@H]1CCCC[N@H+]1Cc1ccsc1 ZINC000541778241 388868648 /nfs/dbraw/zinc/86/86/48/388868648.db2.gz RILTXKPBDQEXAO-CYBMUJFWSA-N 1 1 223.385 3.903 20 0 BHADMO CCC[C@H]1CCCC[N@H+]1Cc1ccsc1 ZINC000541778242 388868221 /nfs/dbraw/zinc/86/82/21/388868221.db2.gz RILTXKPBDQEXAO-ZDUSSCGKSA-N 1 1 223.385 3.903 20 0 BHADMO Cc1cc(C[N@H+]2CCC2(C)C)ccc1Cl ZINC000541886497 323160981 /nfs/dbraw/zinc/16/09/81/323160981.db2.gz AYOVYJGVHLJZIH-UHFFFAOYSA-N 1 1 223.747 3.633 20 0 BHADMO CC[C@@H]1C[C@H](C[N@@H+](C)[C@@H](C)C(C)(C)C)CCO1 ZINC000541886880 388873722 /nfs/dbraw/zinc/87/37/22/388873722.db2.gz LASFXLMOYHTYMV-BFHYXJOUSA-N 1 1 241.419 3.558 20 0 BHADMO CC[C@@H]1C[C@@H](C[N@@H+](C)[C@H](C)C(C)(C)C)CCO1 ZINC000541886883 388873508 /nfs/dbraw/zinc/87/35/08/388873508.db2.gz LASFXLMOYHTYMV-HZSPNIEDSA-N 1 1 241.419 3.558 20 0 BHADMO CC[C@@H]1C[C@@H](C[N@@H+](C)[C@@H](C)C(C)(C)C)CCO1 ZINC000541886885 388873565 /nfs/dbraw/zinc/87/35/65/388873565.db2.gz LASFXLMOYHTYMV-MELADBBJSA-N 1 1 241.419 3.558 20 0 BHADMO CC[C@@H]1C[C@H](C[N@@H+](C)[C@H](C)C(C)(C)C)CCO1 ZINC000541886887 388873782 /nfs/dbraw/zinc/87/37/82/388873782.db2.gz LASFXLMOYHTYMV-MGPQQGTHSA-N 1 1 241.419 3.558 20 0 BHADMO CC(C)[N@@H+](C[C@H]1CCc2ccccc2C1)C1CC1 ZINC000541985942 325002312 /nfs/dbraw/zinc/00/23/12/325002312.db2.gz XEESJFNNJJZWEU-AWEZNQCLSA-N 1 1 243.394 3.664 20 0 BHADMO CC(C)[N@@H+](C[C@@H]1CCc2ccccc2C1)C1CC1 ZINC000541985943 325002790 /nfs/dbraw/zinc/00/27/90/325002790.db2.gz XEESJFNNJJZWEU-CQSZACIVSA-N 1 1 243.394 3.664 20 0 BHADMO C[N@@H+](C[C@H]1CCc2ccccc2C1)C1CCCC1 ZINC000541986060 325002382 /nfs/dbraw/zinc/00/23/82/325002382.db2.gz DQIUFNQCPGMCKY-AWEZNQCLSA-N 1 1 243.394 3.666 20 0 BHADMO C[N@@H+](C[C@@H]1CCc2ccccc2C1)C1CCCC1 ZINC000541986061 325002603 /nfs/dbraw/zinc/00/26/03/325002603.db2.gz DQIUFNQCPGMCKY-CQSZACIVSA-N 1 1 243.394 3.666 20 0 BHADMO CO[C@@H](C)C[N@@H+](Cc1ccccc1)CC(C)(C)C ZINC000541994892 325002567 /nfs/dbraw/zinc/00/25/67/325002567.db2.gz JGIWWNVKYVDHEY-AWEZNQCLSA-N 1 1 249.398 3.570 20 0 BHADMO CO[C@H](C)C[N@@H+](Cc1ccccc1)CC(C)(C)C ZINC000541994893 325002732 /nfs/dbraw/zinc/00/27/32/325002732.db2.gz JGIWWNVKYVDHEY-CQSZACIVSA-N 1 1 249.398 3.570 20 0 BHADMO CCC(CC)(CC)C[N@@H+](C)[C@@H]1CCSC1 ZINC000542020025 325004685 /nfs/dbraw/zinc/00/46/85/325004685.db2.gz OHKSDISOXLKMFL-GFCCVEGCSA-N 1 1 229.433 3.640 20 0 BHADMO CCC(CC)(CC)C[N@@H+](C)[C@H]1CCSC1 ZINC000542020030 325004618 /nfs/dbraw/zinc/00/46/18/325004618.db2.gz 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BHADMO C[C@@H]1CCC[N@@H+](CCCc2ccsc2)[C@H]1C ZINC000542104926 325009081 /nfs/dbraw/zinc/00/90/81/325009081.db2.gz WXGMBXJXZWHMNN-OLZOCXBDSA-N 1 1 237.412 3.801 20 0 BHADMO C[C@@H]1[C@@H](C)CCC[N@H+]1CCCc1ccsc1 ZINC000542104927 325008901 /nfs/dbraw/zinc/00/89/01/325008901.db2.gz WXGMBXJXZWHMNN-QWHCGFSZSA-N 1 1 237.412 3.801 20 0 BHADMO C[C@H]1CCC[N@@H+](CCCc2ccsc2)[C@H]1C ZINC000542104929 325009067 /nfs/dbraw/zinc/00/90/67/325009067.db2.gz WXGMBXJXZWHMNN-STQMWFEESA-N 1 1 237.412 3.801 20 0 BHADMO CCC[N@@H+](CC1CC1)[C@H](C)Cc1ccsc1 ZINC000542128718 325009691 /nfs/dbraw/zinc/00/96/91/325009691.db2.gz UKJSFNWYOCMDCX-GFCCVEGCSA-N 1 1 237.412 3.801 20 0 BHADMO CCC[N@@H+](CC1CC1)[C@@H](C)Cc1ccsc1 ZINC000542128719 325009823 /nfs/dbraw/zinc/00/98/23/325009823.db2.gz UKJSFNWYOCMDCX-LBPRGKRZSA-N 1 1 237.412 3.801 20 0 BHADMO CC[C@@H]1CCCC[N@H+]1[C@@H](C)Cc1ccsc1 ZINC000542129867 325010110 /nfs/dbraw/zinc/01/01/10/325010110.db2.gz VPMLMBHQNSJUAV-GXTWGEPZSA-N 1 1 237.412 3.944 20 0 BHADMO 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BHADMO C[C@@H]1CCC[N@H+]1CCCc1ccccc1Cl ZINC000542276986 325018660 /nfs/dbraw/zinc/01/86/60/325018660.db2.gz GAOJNVPEXATWOJ-GFCCVEGCSA-N 1 1 237.774 3.757 20 0 BHADMO C[C@H]1CCC[N@H+]1CCCc1ccccc1Cl ZINC000542276987 325018850 /nfs/dbraw/zinc/01/88/50/325018850.db2.gz GAOJNVPEXATWOJ-LBPRGKRZSA-N 1 1 237.774 3.757 20 0 BHADMO Cc1cccc([C@H]2CC[N@H+](C3CCCC3)C2)c1 ZINC000542315757 325020737 /nfs/dbraw/zinc/02/07/37/325020737.db2.gz JGPNYRCZSVEVKJ-HNNXBMFYSA-N 1 1 229.367 3.727 20 0 BHADMO Cc1cccc([C@@H]2CC[N@H+](C3CCCC3)C2)c1 ZINC000542315758 325021346 /nfs/dbraw/zinc/02/13/46/325021346.db2.gz JGPNYRCZSVEVKJ-OAHLLOKOSA-N 1 1 229.367 3.727 20 0 BHADMO Cc1cccc([C@H]2CC[N@@H+](CC3CCC3)C2)c1 ZINC000542316378 325020807 /nfs/dbraw/zinc/02/08/07/325020807.db2.gz TZRNYOJNLWBZIB-INIZCTEOSA-N 1 1 229.367 3.584 20 0 BHADMO Cc1cccc([C@@H]2CC[N@@H+](CC3CCC3)C2)c1 ZINC000542316379 325020996 /nfs/dbraw/zinc/02/09/96/325020996.db2.gz TZRNYOJNLWBZIB-MRXNPFEDSA-N 1 1 229.367 3.584 20 0 BHADMO CCCC[N@H+]1CC[C@H](c2cccc(C)c2)C1 ZINC000542317035 325020719 /nfs/dbraw/zinc/02/07/19/325020719.db2.gz ORMFOXHIKUCVKB-HNNXBMFYSA-N 1 1 217.356 3.584 20 0 BHADMO CCCC[N@H+]1CC[C@@H](c2cccc(C)c2)C1 ZINC000542317036 325021173 /nfs/dbraw/zinc/02/11/73/325021173.db2.gz ORMFOXHIKUCVKB-OAHLLOKOSA-N 1 1 217.356 3.584 20 0 BHADMO C[C@H](C[N@H+]1CC[C@@H](C(C)(C)C)C1)C(F)(F)F ZINC000542317437 325021149 /nfs/dbraw/zinc/02/11/49/325021149.db2.gz XUARCLBWUKDZAG-NXEZZACHSA-N 1 1 237.309 3.553 20 0 BHADMO C[C@@H](C[N@H+]1CC[C@H](C(C)(C)C)C1)C(F)(F)F ZINC000542317438 325021021 /nfs/dbraw/zinc/02/10/21/325021021.db2.gz XUARCLBWUKDZAG-UWVGGRQHSA-N 1 1 237.309 3.553 20 0 BHADMO C[C@@H](C[N@H+]1CC[C@@H](C(C)(C)C)C1)C(F)(F)F ZINC000542317439 325021265 /nfs/dbraw/zinc/02/12/65/325021265.db2.gz XUARCLBWUKDZAG-VHSXEESVSA-N 1 1 237.309 3.553 20 0 BHADMO C[C@H](C[N@H+]1CC[C@H](C(C)(C)C)C1)C(F)(F)F ZINC000542317440 325021093 /nfs/dbraw/zinc/02/10/93/325021093.db2.gz XUARCLBWUKDZAG-ZJUUUORDSA-N 1 1 237.309 3.553 20 0 BHADMO CSCCC[N@H+]1CC[C@H](c2ccc(C)cc2)C1 ZINC000542317821 325021214 /nfs/dbraw/zinc/02/12/14/325021214.db2.gz IJEIBKCDMPCQGH-HNNXBMFYSA-N 1 1 249.423 3.537 20 0 BHADMO CSCCC[N@H+]1CC[C@@H](c2ccc(C)cc2)C1 ZINC000542317828 325020866 /nfs/dbraw/zinc/02/08/66/325020866.db2.gz IJEIBKCDMPCQGH-OAHLLOKOSA-N 1 1 249.423 3.537 20 0 BHADMO Cc1cc(C)cc([C@H]2CC[N@@H+](CC3CC3)C2)c1 ZINC000542317867 325020880 /nfs/dbraw/zinc/02/08/80/325020880.db2.gz NUWIZYOBPHJHFC-HNNXBMFYSA-N 1 1 229.367 3.503 20 0 BHADMO Cc1cc(C)cc([C@@H]2CC[N@@H+](CC3CC3)C2)c1 ZINC000542317868 325021220 /nfs/dbraw/zinc/02/12/20/325021220.db2.gz NUWIZYOBPHJHFC-OAHLLOKOSA-N 1 1 229.367 3.503 20 0 BHADMO Cc1cccc([C@H]2CC[N@@H+](CCC3CC3)C2)c1 ZINC000542319781 325020819 /nfs/dbraw/zinc/02/08/19/325020819.db2.gz KDYYZEWFSWNVFX-INIZCTEOSA-N 1 1 229.367 3.584 20 0 BHADMO Cc1cccc([C@@H]2CC[N@@H+](CCC3CC3)C2)c1 ZINC000542319782 325021142 /nfs/dbraw/zinc/02/11/42/325021142.db2.gz KDYYZEWFSWNVFX-MRXNPFEDSA-N 1 1 229.367 3.584 20 0 BHADMO Cc1cc(C)cc([C@H]2CC[N@H+](C(C)C)C2)c1 ZINC000542320642 325021167 /nfs/dbraw/zinc/02/11/67/325021167.db2.gz SQEPICJJOLYINX-AWEZNQCLSA-N 1 1 217.356 3.501 20 0 BHADMO Cc1cc(C)cc([C@@H]2CC[N@H+](C(C)C)C2)c1 ZINC000542320643 325020955 /nfs/dbraw/zinc/02/09/55/325020955.db2.gz SQEPICJJOLYINX-CQSZACIVSA-N 1 1 217.356 3.501 20 0 BHADMO COc1cccc(C[N@H+]2CC[C@H](C(C)(C)C)C2)c1 ZINC000542322638 325021316 /nfs/dbraw/zinc/02/13/16/325021316.db2.gz VGKUGNYHFOLIJD-AWEZNQCLSA-N 1 1 247.382 3.563 20 0 BHADMO COc1cccc(C[N@H+]2CC[C@@H](C(C)(C)C)C2)c1 ZINC000542322639 325021293 /nfs/dbraw/zinc/02/12/93/325021293.db2.gz VGKUGNYHFOLIJD-CQSZACIVSA-N 1 1 247.382 3.563 20 0 BHADMO CCSCC[N@H+]1CC[C@H](c2cccc(C)c2)C1 ZINC000542323683 325021684 /nfs/dbraw/zinc/02/16/84/325021684.db2.gz XPSVOGMOJIOERF-HNNXBMFYSA-N 1 1 249.423 3.537 20 0 BHADMO CCSCC[N@H+]1CC[C@@H](c2cccc(C)c2)C1 ZINC000542323684 325021741 /nfs/dbraw/zinc/02/17/41/325021741.db2.gz XPSVOGMOJIOERF-OAHLLOKOSA-N 1 1 249.423 3.537 20 0 BHADMO C[C@@H]1CCCC[C@@H]1C[N@@H+](C)CCC(F)(F)F ZINC000542464742 325029101 /nfs/dbraw/zinc/02/91/01/325029101.db2.gz HGFXNWWLPDNMHH-GHMZBOCLSA-N 1 1 237.309 3.697 20 0 BHADMO C[C@@H]1CCCC[C@H]1C[N@@H+](C)CCC(F)(F)F ZINC000542464743 325029277 /nfs/dbraw/zinc/02/92/77/325029277.db2.gz HGFXNWWLPDNMHH-MNOVXSKESA-N 1 1 237.309 3.697 20 0 BHADMO C[C@H]1CCCC[C@H]1C[N@@H+](C)CCC(F)(F)F ZINC000542464744 325029071 /nfs/dbraw/zinc/02/90/71/325029071.db2.gz HGFXNWWLPDNMHH-QWRGUYRKSA-N 1 1 237.309 3.697 20 0 BHADMO C[C@H]1CCCC[C@@H]1C[N@@H+](C)CCC(F)(F)F ZINC000542464745 325028740 /nfs/dbraw/zinc/02/87/40/325028740.db2.gz HGFXNWWLPDNMHH-WDEREUQCSA-N 1 1 237.309 3.697 20 0 BHADMO CCCC[N@@H+](C)Cc1cc(C)c2ncccc2c1 ZINC000542466416 325029005 /nfs/dbraw/zinc/02/90/05/325029005.db2.gz FLQXIGBUDCCNRX-UHFFFAOYSA-N 1 1 242.366 3.775 20 0 BHADMO CC1CCC(C[N@@H+](C)Cc2cccc(O)c2)CC1 ZINC000542507825 325031558 /nfs/dbraw/zinc/03/15/58/325031558.db2.gz NHBLLOUYJGOTTC-UHFFFAOYSA-N 1 1 247.382 3.650 20 0 BHADMO CC(C)[N@H+](C[C@@H](C)Cc1ccccc1)C1CC1 ZINC000542517547 325032262 /nfs/dbraw/zinc/03/22/62/325032262.db2.gz FQIIGGXDSVWKMZ-AWEZNQCLSA-N 1 1 231.383 3.738 20 0 BHADMO CC(C)[N@H+](C[C@H](C)Cc1ccccc1)C1CC1 ZINC000542517549 325032688 /nfs/dbraw/zinc/03/26/88/325032688.db2.gz FQIIGGXDSVWKMZ-CQSZACIVSA-N 1 1 231.383 3.738 20 0 BHADMO CC[N@@H+](C[C@@H](C)Cc1ccccc1)C(C)C ZINC000542518414 325032374 /nfs/dbraw/zinc/03/23/74/325032374.db2.gz SRNKNMWIFHYRQI-AWEZNQCLSA-N 1 1 219.372 3.596 20 0 BHADMO CC[N@@H+](C[C@H](C)Cc1ccccc1)C(C)C ZINC000542518418 325032756 /nfs/dbraw/zinc/03/27/56/325032756.db2.gz SRNKNMWIFHYRQI-CQSZACIVSA-N 1 1 219.372 3.596 20 0 BHADMO CCC[N@@H+](CC)C[C@@H](C)Cc1ccccc1 ZINC000542518501 325032599 /nfs/dbraw/zinc/03/25/99/325032599.db2.gz SSXIMRUJINXGKF-AWEZNQCLSA-N 1 1 219.372 3.597 20 0 BHADMO CCC[N@@H+](CC)C[C@H](C)Cc1ccccc1 ZINC000542518503 325032577 /nfs/dbraw/zinc/03/25/77/325032577.db2.gz SSXIMRUJINXGKF-CQSZACIVSA-N 1 1 219.372 3.597 20 0 BHADMO CCC[C@H]1CCCCN1c1cc(CC)[nH+]c(C)n1 ZINC000542554549 325034816 /nfs/dbraw/zinc/03/48/16/325034816.db2.gz MAQDHDRYDYOKJN-AWEZNQCLSA-N 1 1 247.386 3.506 20 0 BHADMO CCC[C@@H]1CCCCN1c1cc(CC)[nH+]c(C)n1 ZINC000542554550 325034749 /nfs/dbraw/zinc/03/47/49/325034749.db2.gz MAQDHDRYDYOKJN-CQSZACIVSA-N 1 1 247.386 3.506 20 0 BHADMO CCC(CC)(CC)C[N@@H+](C)CCc1ccncc1 ZINC000542692322 325042167 /nfs/dbraw/zinc/04/21/67/325042167.db2.gz GOPAXGSDFKIJSF-UHFFFAOYSA-N 1 1 248.414 3.772 20 0 BHADMO Cc1cc(C)cc([C@@H](C)[NH2+][C@H](C)c2ccon2)c1 ZINC000542697978 325042639 /nfs/dbraw/zinc/04/26/39/325042639.db2.gz YBTQPTJPQQPBQF-CHWSQXEVSA-N 1 1 244.338 3.703 20 0 BHADMO Cc1cc(C)cc([C@@H](C)[NH2+][C@@H](C)c2ccon2)c1 ZINC000542697979 325042305 /nfs/dbraw/zinc/04/23/05/325042305.db2.gz YBTQPTJPQQPBQF-OLZOCXBDSA-N 1 1 244.338 3.703 20 0 BHADMO Cc1cc(C)cc([C@H](C)[NH2+][C@H](C)c2ccon2)c1 ZINC000542697980 325042006 /nfs/dbraw/zinc/04/20/06/325042006.db2.gz YBTQPTJPQQPBQF-QWHCGFSZSA-N 1 1 244.338 3.703 20 0 BHADMO Cc1cc(C)cc([C@H](C)[NH2+][C@@H](C)c2ccon2)c1 ZINC000542697981 325042273 /nfs/dbraw/zinc/04/22/73/325042273.db2.gz YBTQPTJPQQPBQF-STQMWFEESA-N 1 1 244.338 3.703 20 0 BHADMO CCC[C@@H]1CCCC[N@H+]1Cc1ccc(C)o1 ZINC000542709134 325043269 /nfs/dbraw/zinc/04/32/69/325043269.db2.gz JZDIGGSFMPUNQB-CYBMUJFWSA-N 1 1 221.344 3.743 20 0 BHADMO CCC[C@H]1CCCC[N@H+]1Cc1ccc(C)o1 ZINC000542709139 325043343 /nfs/dbraw/zinc/04/33/43/325043343.db2.gz JZDIGGSFMPUNQB-ZDUSSCGKSA-N 1 1 221.344 3.743 20 0 BHADMO COc1ccc2c(c1)C[C@@H](C)[N@H+](CC(C)C)[C@@H]2C ZINC000542853339 325058003 /nfs/dbraw/zinc/05/80/03/325058003.db2.gz HWROFIPATAYAKV-CHWSQXEVSA-N 1 1 247.382 3.659 20 0 BHADMO COc1ccc2c(c1)C[C@@H](C)[N@H+](CC(C)C)[C@H]2C ZINC000542853358 325057990 /nfs/dbraw/zinc/05/79/90/325057990.db2.gz HWROFIPATAYAKV-OLZOCXBDSA-N 1 1 247.382 3.659 20 0 BHADMO COc1ccc2c(c1)C[C@H](C)[N@H+](CC(C)C)[C@@H]2C ZINC000542853360 325058212 /nfs/dbraw/zinc/05/82/12/325058212.db2.gz HWROFIPATAYAKV-QWHCGFSZSA-N 1 1 247.382 3.659 20 0 BHADMO COc1ccc2c(c1)C[C@H](C)[N@H+](CC(C)C)[C@H]2C ZINC000542853362 325058191 /nfs/dbraw/zinc/05/81/91/325058191.db2.gz HWROFIPATAYAKV-STQMWFEESA-N 1 1 247.382 3.659 20 0 BHADMO C[C@H]1CC[C@@]2(CC[N@@H+](CC(C)(C)C)C2)C1 ZINC000542854406 325058067 /nfs/dbraw/zinc/05/80/67/325058067.db2.gz QZBRZZDZGFNONC-GXTWGEPZSA-N 1 1 209.377 3.545 20 0 BHADMO C[C@H]1CC[C@]2(CC[N@@H+](CC(C)(C)C)C2)C1 ZINC000542854407 325058029 /nfs/dbraw/zinc/05/80/29/325058029.db2.gz QZBRZZDZGFNONC-JSGCOSHPSA-N 1 1 209.377 3.545 20 0 BHADMO C[C@@H]1CC[C@]2(CC[N@@H+](CC(C)(C)C)C2)C1 ZINC000542854408 325057997 /nfs/dbraw/zinc/05/79/97/325057997.db2.gz QZBRZZDZGFNONC-OCCSQVGLSA-N 1 1 209.377 3.545 20 0 BHADMO C[C@@H]1CC[C@@]2(CC[N@@H+](CC(C)(C)C)C2)C1 ZINC000542854409 325058394 /nfs/dbraw/zinc/05/83/94/325058394.db2.gz QZBRZZDZGFNONC-TZMCWYRMSA-N 1 1 209.377 3.545 20 0 BHADMO CC[N@@H+](C[C@H]1CCc2ccccc2C1)C(C)C ZINC000542915792 325062329 /nfs/dbraw/zinc/06/23/29/325062329.db2.gz SELQCCROXTWFTI-AWEZNQCLSA-N 1 1 231.383 3.522 20 0 BHADMO CC[N@@H+](C[C@@H]1CCc2ccccc2C1)C(C)C ZINC000542915793 325062039 /nfs/dbraw/zinc/06/20/39/325062039.db2.gz SELQCCROXTWFTI-CQSZACIVSA-N 1 1 231.383 3.522 20 0 BHADMO CC[C@H](C)[N@@H+](C)C[C@H]1CCc2ccccc2C1 ZINC000542916092 325062439 /nfs/dbraw/zinc/06/24/39/325062439.db2.gz WCRUKJZTWSGXLL-KBPBESRZSA-N 1 1 231.383 3.522 20 0 BHADMO CC[C@@H](C)[N@@H+](C)C[C@H]1CCc2ccccc2C1 ZINC000542916093 325062206 /nfs/dbraw/zinc/06/22/06/325062206.db2.gz WCRUKJZTWSGXLL-KGLIPLIRSA-N 1 1 231.383 3.522 20 0 BHADMO CC[C@H](C)[N@@H+](C)C[C@@H]1CCc2ccccc2C1 ZINC000542916095 325062336 /nfs/dbraw/zinc/06/23/36/325062336.db2.gz WCRUKJZTWSGXLL-UONOGXRCSA-N 1 1 231.383 3.522 20 0 BHADMO CC[C@@H](C)[N@@H+](C)C[C@@H]1CCc2ccccc2C1 ZINC000542916096 325061917 /nfs/dbraw/zinc/06/19/17/325061917.db2.gz WCRUKJZTWSGXLL-ZIAGYGMSSA-N 1 1 231.383 3.522 20 0 BHADMO CC[N@@H+](C[C@H]1CCc2ccccc2C1)C1CCC1 ZINC000542916255 325062543 /nfs/dbraw/zinc/06/25/43/325062543.db2.gz ZVJHVSVDQBUURQ-AWEZNQCLSA-N 1 1 243.394 3.666 20 0 BHADMO CC[N@@H+](C[C@@H]1CCc2ccccc2C1)C1CCC1 ZINC000542916256 325062386 /nfs/dbraw/zinc/06/23/86/325062386.db2.gz ZVJHVSVDQBUURQ-CQSZACIVSA-N 1 1 243.394 3.666 20 0 BHADMO CCCC[N@@H+](C[C@@H](C)OC)[C@@H](C)c1ccccc1 ZINC000542933267 325064076 /nfs/dbraw/zinc/06/40/76/325064076.db2.gz ZVORCRHZYHEUNJ-CABCVRRESA-N 1 1 249.398 3.885 20 0 BHADMO CCCC[N@@H+](C[C@H](C)OC)[C@@H](C)c1ccccc1 ZINC000542933272 325064113 /nfs/dbraw/zinc/06/41/13/325064113.db2.gz ZVORCRHZYHEUNJ-GJZGRUSLSA-N 1 1 249.398 3.885 20 0 BHADMO CCCC[N@@H+](C[C@@H](C)OC)[C@H](C)c1ccccc1 ZINC000542933274 325064326 /nfs/dbraw/zinc/06/43/26/325064326.db2.gz ZVORCRHZYHEUNJ-HUUCEWRRSA-N 1 1 249.398 3.885 20 0 BHADMO CCCC[N@@H+](C[C@H](C)OC)[C@H](C)c1ccccc1 ZINC000542933276 325064490 /nfs/dbraw/zinc/06/44/90/325064490.db2.gz ZVORCRHZYHEUNJ-LSDHHAIUSA-N 1 1 249.398 3.885 20 0 BHADMO CCOC[C@H]1CC[N@@H+](CC(CC)(CC)CC)C1 ZINC000542948890 325064998 /nfs/dbraw/zinc/06/49/98/325064998.db2.gz GBBXACAEDUXDLM-AWEZNQCLSA-N 1 1 241.419 3.561 20 0 BHADMO CCOC[C@@H]1CC[N@@H+](CC(CC)(CC)CC)C1 ZINC000542948892 325065209 /nfs/dbraw/zinc/06/52/09/325065209.db2.gz GBBXACAEDUXDLM-CQSZACIVSA-N 1 1 241.419 3.561 20 0 BHADMO CCC(CC)(CC)C[N@@H+](C)Cc1cccn1C ZINC000542949277 325065181 /nfs/dbraw/zinc/06/51/81/325065181.db2.gz SWXVJVIHOVBBEL-UHFFFAOYSA-N 1 1 236.403 3.673 20 0 BHADMO CCC(CC)(CC)C[N@@H+](C)CC1CCOCC1 ZINC000542949392 325064967 /nfs/dbraw/zinc/06/49/67/325064967.db2.gz VBLJWKZBTYFQJQ-UHFFFAOYSA-N 1 1 241.419 3.561 20 0 BHADMO C[C@@H](C[N@H+]1C[C@@H](C)[C@H]2CCCC[C@@H]21)C(F)(F)F ZINC000542970194 325065865 /nfs/dbraw/zinc/06/58/65/325065865.db2.gz SGVQDPHIQPERHO-KXNHARMFSA-N 1 1 249.320 3.695 20 0 BHADMO C[C@@H](C[N@H+]1C[C@@H](C)[C@@H]2CCCC[C@H]21)C(F)(F)F ZINC000542970195 325065659 /nfs/dbraw/zinc/06/56/59/325065659.db2.gz SGVQDPHIQPERHO-NOOOWODRSA-N 1 1 249.320 3.695 20 0 BHADMO C[C@@H](C[N@H+]1C[C@@H](C)[C@@H]2CCCC[C@@H]21)C(F)(F)F ZINC000542970196 325065687 /nfs/dbraw/zinc/06/56/87/325065687.db2.gz SGVQDPHIQPERHO-RHYQMDGZSA-N 1 1 249.320 3.695 20 0 BHADMO C[C@@H](C[N@H+]1C[C@@H](C)[C@H]2CCCC[C@H]21)C(F)(F)F ZINC000542970197 325065946 /nfs/dbraw/zinc/06/59/46/325065946.db2.gz SGVQDPHIQPERHO-WRWGMCAJSA-N 1 1 249.320 3.695 20 0 BHADMO CC(C)[C@@H]1CCC[N@H+]1CCCc1ccsc1 ZINC000543019878 325067468 /nfs/dbraw/zinc/06/74/68/325067468.db2.gz SSCDIVQGKZZDPP-AWEZNQCLSA-N 1 1 237.412 3.801 20 0 BHADMO CC(C)[C@H]1CCC[N@H+]1CCCc1ccsc1 ZINC000543019879 325067300 /nfs/dbraw/zinc/06/73/00/325067300.db2.gz SSCDIVQGKZZDPP-CQSZACIVSA-N 1 1 237.412 3.801 20 0 BHADMO CC[N@@H+](CCCc1ccsc1)CC(C)C ZINC000543020116 325067069 /nfs/dbraw/zinc/06/70/69/325067069.db2.gz JLXGTOCPAYEEOG-UHFFFAOYSA-N 1 1 225.401 3.659 20 0 BHADMO c1cc(CCC[N@H+]2CCC[C@H]2C2CCC2)cs1 ZINC000543029040 325068047 /nfs/dbraw/zinc/06/80/47/325068047.db2.gz GXNHDJDHKRJTDD-HNNXBMFYSA-N 1 1 249.423 3.945 20 0 BHADMO c1cc(CCC[N@H+]2CCC[C@@H]2C2CCC2)cs1 ZINC000543029041 325068038 /nfs/dbraw/zinc/06/80/38/325068038.db2.gz GXNHDJDHKRJTDD-OAHLLOKOSA-N 1 1 249.423 3.945 20 0 BHADMO C[C@@H]1CC[C@@H](C)[N@@H+](CCCc2ccsc2)C1 ZINC000543032703 325067813 /nfs/dbraw/zinc/06/78/13/325067813.db2.gz XRTIPECRAOUGCQ-CHWSQXEVSA-N 1 1 237.412 3.801 20 0 BHADMO C[C@@H]1CC[C@H](C)[N@@H+](CCCc2ccsc2)C1 ZINC000543032705 325067880 /nfs/dbraw/zinc/06/78/80/325067880.db2.gz XRTIPECRAOUGCQ-OLZOCXBDSA-N 1 1 237.412 3.801 20 0 BHADMO C[C@@H]1CC[C@H](C)C[N@@H+]1CCCc1ccsc1 ZINC000543032706 325068105 /nfs/dbraw/zinc/06/81/05/325068105.db2.gz XRTIPECRAOUGCQ-QWHCGFSZSA-N 1 1 237.412 3.801 20 0 BHADMO C[C@H]1CC[C@H](C)[N@@H+](CCCc2ccsc2)C1 ZINC000543032708 325068238 /nfs/dbraw/zinc/06/82/38/325068238.db2.gz XRTIPECRAOUGCQ-STQMWFEESA-N 1 1 237.412 3.801 20 0 BHADMO CC(C)[N@@H+](CCCc1ccsc1)C1CCC1 ZINC000543032861 325068114 /nfs/dbraw/zinc/06/81/14/325068114.db2.gz YPZJAGBOJLWHCM-UHFFFAOYSA-N 1 1 237.412 3.944 20 0 BHADMO C[C@H](Cc1ccsc1)[N@@H+](C)[C@@H](C)c1ccco1 ZINC000543057708 325068819 /nfs/dbraw/zinc/06/88/19/325068819.db2.gz LUPHVQSIKHHSCC-NEPJUHHUSA-N 1 1 249.379 3.965 20 0 BHADMO C[C@H](c1ccco1)[N@H+](C)[C@@H](C)Cc1ccsc1 ZINC000543057709 325069028 /nfs/dbraw/zinc/06/90/28/325069028.db2.gz LUPHVQSIKHHSCC-NWDGAFQWSA-N 1 1 249.379 3.965 20 0 BHADMO C[C@@H](Cc1ccsc1)[N@@H+](C)[C@@H](C)c1ccco1 ZINC000543057710 325068677 /nfs/dbraw/zinc/06/86/77/325068677.db2.gz LUPHVQSIKHHSCC-RYUDHWBXSA-N 1 1 249.379 3.965 20 0 BHADMO C[C@H](Cc1ccsc1)[N@@H+](C)[C@H](C)c1ccco1 ZINC000543057711 325068722 /nfs/dbraw/zinc/06/87/22/325068722.db2.gz LUPHVQSIKHHSCC-VXGBXAGGSA-N 1 1 249.379 3.965 20 0 BHADMO C[C@@H](Cc1ccsc1)[N@H+]1CCCC[C@H]1C ZINC000543058781 325068995 /nfs/dbraw/zinc/06/89/95/325068995.db2.gz ZJKJLXKMQCUVMC-NEPJUHHUSA-N 1 1 223.385 3.554 20 0 BHADMO C[C@H](Cc1ccsc1)[N@H+]1CCCC[C@@H]1C ZINC000543058788 325069632 /nfs/dbraw/zinc/06/96/32/325069632.db2.gz ZJKJLXKMQCUVMC-NWDGAFQWSA-N 1 1 223.385 3.554 20 0 BHADMO C[C@@H](Cc1ccsc1)[N@H+]1CCCC[C@@H]1C ZINC000543058790 325069480 /nfs/dbraw/zinc/06/94/80/325069480.db2.gz ZJKJLXKMQCUVMC-RYUDHWBXSA-N 1 1 223.385 3.554 20 0 BHADMO C[C@H](Cc1ccsc1)[N@H+]1CCCC[C@H]1C ZINC000543058791 325069377 /nfs/dbraw/zinc/06/93/77/325069377.db2.gz ZJKJLXKMQCUVMC-VXGBXAGGSA-N 1 1 223.385 3.554 20 0 BHADMO C[C@@H]1c2ccccc2C[N@H+]1C1CCCC1 ZINC000543064054 325069785 /nfs/dbraw/zinc/06/97/85/325069785.db2.gz WFSYRDKHDWSHBB-LLVKDONJSA-N 1 1 201.313 3.506 20 0 BHADMO C[C@H]1c2ccccc2C[N@H+]1C1CCCC1 ZINC000543064060 325069809 /nfs/dbraw/zinc/06/98/09/325069809.db2.gz WFSYRDKHDWSHBB-NSHDSACASA-N 1 1 201.313 3.506 20 0 BHADMO CCC(CC)(CC)C[N@@H+](C)Cc1cscn1 ZINC000543079345 325070481 /nfs/dbraw/zinc/07/04/81/325070481.db2.gz HDAQZSPFRBOLPP-UHFFFAOYSA-N 1 1 240.416 3.791 20 0 BHADMO C[C@H](Cc1ccsc1)[N@@H+](C)C(C1CC1)C1CC1 ZINC000543079932 325070387 /nfs/dbraw/zinc/07/03/87/325070387.db2.gz OVUVQYPDLLFFPZ-LLVKDONJSA-N 1 1 249.423 3.800 20 0 BHADMO C[C@@H](Cc1ccsc1)[N@@H+](C)C(C1CC1)C1CC1 ZINC000543079933 325070352 /nfs/dbraw/zinc/07/03/52/325070352.db2.gz OVUVQYPDLLFFPZ-NSHDSACASA-N 1 1 249.423 3.800 20 0 BHADMO C[C@H](Cc1ccsc1)[N@@H+](C)[C@@H](C)C1(C)CC1 ZINC000543080231 325070512 /nfs/dbraw/zinc/07/05/12/325070512.db2.gz WIEAKCAWJMRQPU-NEPJUHHUSA-N 1 1 237.412 3.800 20 0 BHADMO C[C@@H]([N@H+](C)[C@@H](C)Cc1ccsc1)C1(C)CC1 ZINC000543080233 325070214 /nfs/dbraw/zinc/07/02/14/325070214.db2.gz WIEAKCAWJMRQPU-NWDGAFQWSA-N 1 1 237.412 3.800 20 0 BHADMO C[C@@H](Cc1ccsc1)[N@@H+](C)[C@@H](C)C1(C)CC1 ZINC000543080235 325070292 /nfs/dbraw/zinc/07/02/92/325070292.db2.gz WIEAKCAWJMRQPU-RYUDHWBXSA-N 1 1 237.412 3.800 20 0 BHADMO C[C@H](Cc1ccsc1)[N@@H+](C)[C@H](C)C1(C)CC1 ZINC000543080237 325070105 /nfs/dbraw/zinc/07/01/05/325070105.db2.gz WIEAKCAWJMRQPU-VXGBXAGGSA-N 1 1 237.412 3.800 20 0 BHADMO C[C@@H](Cc1ccsc1)[N@H+]1C[C@H](C)CC[C@@H]1C ZINC000543080368 325070284 /nfs/dbraw/zinc/07/02/84/325070284.db2.gz WQIYDLIXZXCAJZ-AGIUHOORSA-N 1 1 237.412 3.800 20 0 BHADMO C[C@H](Cc1ccsc1)[N@H+]1C[C@H](C)CC[C@@H]1C ZINC000543080369 325070242 /nfs/dbraw/zinc/07/02/42/325070242.db2.gz WQIYDLIXZXCAJZ-FRRDWIJNSA-N 1 1 237.412 3.800 20 0 BHADMO C[C@H](Cc1ccsc1)[N@H+]1C[C@H](C)CC[C@H]1C ZINC000543080370 325070652 /nfs/dbraw/zinc/07/06/52/325070652.db2.gz WQIYDLIXZXCAJZ-JHJVBQTASA-N 1 1 237.412 3.800 20 0 BHADMO C[C@@H](Cc1ccsc1)[N@H+]1C[C@H](C)CC[C@H]1C ZINC000543080371 325070508 /nfs/dbraw/zinc/07/05/08/325070508.db2.gz WQIYDLIXZXCAJZ-UPJWGTAASA-N 1 1 237.412 3.800 20 0 BHADMO CC(C)C[N@@H+](C)[C@H](C)CCc1cccc(F)c1 ZINC000543082845 325070517 /nfs/dbraw/zinc/07/05/17/325070517.db2.gz HKQOIWQTXOJVPT-CYBMUJFWSA-N 1 1 237.362 3.735 20 0 BHADMO CC(C)C[N@@H+](C)[C@@H](C)CCc1cccc(F)c1 ZINC000543082846 325070113 /nfs/dbraw/zinc/07/01/13/325070113.db2.gz HKQOIWQTXOJVPT-ZDUSSCGKSA-N 1 1 237.362 3.735 20 0 BHADMO CC[C@]1(C)CC[N@H+]([C@@H](C)Cc2ccsc2)C1 ZINC000543093083 325071096 /nfs/dbraw/zinc/07/10/96/325071096.db2.gz MGQMAZQUZOFPMD-GXTWGEPZSA-N 1 1 237.412 3.801 20 0 BHADMO CC[C@@]1(C)CC[N@H+]([C@@H](C)Cc2ccsc2)C1 ZINC000543093084 325071002 /nfs/dbraw/zinc/07/10/02/325071002.db2.gz MGQMAZQUZOFPMD-JSGCOSHPSA-N 1 1 237.412 3.801 20 0 BHADMO CC[C@@]1(C)CC[N@H+]([C@H](C)Cc2ccsc2)C1 ZINC000543093085 325071100 /nfs/dbraw/zinc/07/11/00/325071100.db2.gz MGQMAZQUZOFPMD-OCCSQVGLSA-N 1 1 237.412 3.801 20 0 BHADMO CC[C@]1(C)CC[N@H+]([C@H](C)Cc2ccsc2)C1 ZINC000543093086 325071113 /nfs/dbraw/zinc/07/11/13/325071113.db2.gz MGQMAZQUZOFPMD-TZMCWYRMSA-N 1 1 237.412 3.801 20 0 BHADMO C[C@H](CCc1cccc(F)c1)[N@@H+](C)CCC1CC1 ZINC000543094390 325071048 /nfs/dbraw/zinc/07/10/48/325071048.db2.gz KAPHNXCLKAGSCR-CYBMUJFWSA-N 1 1 249.373 3.879 20 0 BHADMO C[C@@H](CCc1cccc(F)c1)[N@@H+](C)CCC1CC1 ZINC000543094391 325071127 /nfs/dbraw/zinc/07/11/27/325071127.db2.gz KAPHNXCLKAGSCR-ZDUSSCGKSA-N 1 1 249.373 3.879 20 0 BHADMO C[C@@H](Cc1ccsc1)[N@H+]1C[C@H](C)CC1(C)C ZINC000543094985 325069254 /nfs/dbraw/zinc/06/92/54/325069254.db2.gz IMTJUTBILHUCTE-NEPJUHHUSA-N 1 1 237.412 3.800 20 0 BHADMO C[C@H](Cc1ccsc1)[N@H+]1C[C@@H](C)CC1(C)C ZINC000543094987 325069567 /nfs/dbraw/zinc/06/95/67/325069567.db2.gz IMTJUTBILHUCTE-NWDGAFQWSA-N 1 1 237.412 3.800 20 0 BHADMO C[C@@H](Cc1ccsc1)[N@H+]1C[C@@H](C)CC1(C)C ZINC000543094989 325069579 /nfs/dbraw/zinc/06/95/79/325069579.db2.gz IMTJUTBILHUCTE-RYUDHWBXSA-N 1 1 237.412 3.800 20 0 BHADMO C[C@H](Cc1ccsc1)[N@H+]1C[C@H](C)CC1(C)C ZINC000543094990 325069552 /nfs/dbraw/zinc/06/95/52/325069552.db2.gz IMTJUTBILHUCTE-VXGBXAGGSA-N 1 1 237.412 3.800 20 0 BHADMO CC[C@@H]1C[C@@H](C)C[N@H+]1[C@@H](C)Cc1ccsc1 ZINC000543096354 325071018 /nfs/dbraw/zinc/07/10/18/325071018.db2.gz XIFCFGLYMTVZLA-MBNYWOFBSA-N 1 1 237.412 3.800 20 0 BHADMO CC[C@@H]1C[C@H](C)C[N@H+]1[C@H](C)Cc1ccsc1 ZINC000543096356 325071166 /nfs/dbraw/zinc/07/11/66/325071166.db2.gz XIFCFGLYMTVZLA-OUCADQQQSA-N 1 1 237.412 3.800 20 0 BHADMO CC[C@@H]1C[C@H](C)C[N@H+]1[C@@H](C)Cc1ccsc1 ZINC000543096357 325071213 /nfs/dbraw/zinc/07/12/13/325071213.db2.gz XIFCFGLYMTVZLA-SGMGOOAPSA-N 1 1 237.412 3.800 20 0 BHADMO CC[C@@H]1C[C@@H](C)C[N@H+]1[C@H](C)Cc1ccsc1 ZINC000543096358 325070965 /nfs/dbraw/zinc/07/09/65/325070965.db2.gz XIFCFGLYMTVZLA-YRGRVCCFSA-N 1 1 237.412 3.800 20 0 BHADMO C[C@@H]1C[N@@H+](Cc2ccsc2)[C@H]2CCCC[C@H]12 ZINC000543110490 325072627 /nfs/dbraw/zinc/07/26/27/325072627.db2.gz DXDINBIZDOLYIG-BNOWGMLFSA-N 1 1 235.396 3.759 20 0 BHADMO C[C@@H]1C[N@@H+](Cc2ccsc2)[C@@H]2CCCC[C@H]21 ZINC000543110491 325072654 /nfs/dbraw/zinc/07/26/54/325072654.db2.gz DXDINBIZDOLYIG-KWCYVHTRSA-N 1 1 235.396 3.759 20 0 BHADMO C[C@@H]1C[N@@H+](Cc2ccsc2)[C@@H]2CCCC[C@@H]21 ZINC000543110492 325072497 /nfs/dbraw/zinc/07/24/97/325072497.db2.gz DXDINBIZDOLYIG-MRVWCRGKSA-N 1 1 235.396 3.759 20 0 BHADMO C[C@@H]1C[N@@H+](Cc2ccsc2)[C@H]2CCCC[C@@H]12 ZINC000543110493 325072563 /nfs/dbraw/zinc/07/25/63/325072563.db2.gz DXDINBIZDOLYIG-XBFCOCLRSA-N 1 1 235.396 3.759 20 0 BHADMO Cc1ccc(CCC[N@H+](C(C)C)C2CC2)cc1 ZINC000543130408 325073903 /nfs/dbraw/zinc/07/39/03/325073903.db2.gz MPJACKXAZIXSET-UHFFFAOYSA-N 1 1 231.383 3.800 20 0 BHADMO Clc1ccc2c(c1)[C@H]([N@H+]1C[C@H]3CCC[C@@H]31)CC2 ZINC000543138808 325073798 /nfs/dbraw/zinc/07/37/98/325073798.db2.gz JIMXOTMIIBVHBA-BYCMXARLSA-N 1 1 247.769 3.812 20 0 BHADMO Clc1ccc2c(c1)[C@H]([N@H+]1C[C@H]3CCC[C@H]31)CC2 ZINC000543138809 325073830 /nfs/dbraw/zinc/07/38/30/325073830.db2.gz JIMXOTMIIBVHBA-KCPJHIHWSA-N 1 1 247.769 3.812 20 0 BHADMO Clc1ccc2c(c1)[C@H]([N@H+]1C[C@@H]3CCC[C@H]31)CC2 ZINC000543138810 325073602 /nfs/dbraw/zinc/07/36/02/325073602.db2.gz JIMXOTMIIBVHBA-NILFDRSVSA-N 1 1 247.769 3.812 20 0 BHADMO Clc1ccc2c(c1)[C@H]([N@H+]1C[C@@H]3CCC[C@@H]31)CC2 ZINC000543138811 325073878 /nfs/dbraw/zinc/07/38/78/325073878.db2.gz JIMXOTMIIBVHBA-TUKIKUTGSA-N 1 1 247.769 3.812 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)CCc1cccc(F)c1F ZINC000543139036 325073583 /nfs/dbraw/zinc/07/35/83/325073583.db2.gz QENUOYRCGJWKRG-LLVKDONJSA-N 1 1 241.325 3.628 20 0 BHADMO CCC[C@H](C)[N@@H+](C)CCc1cccc(F)c1F ZINC000543139038 325073861 /nfs/dbraw/zinc/07/38/61/325073861.db2.gz QENUOYRCGJWKRG-NSHDSACASA-N 1 1 241.325 3.628 20 0 BHADMO Cc1ccc(CCC[N@H+](C)CCC2CC2)cc1 ZINC000543139979 325073939 /nfs/dbraw/zinc/07/39/39/325073939.db2.gz GXZRNXDRBYZHEA-UHFFFAOYSA-N 1 1 231.383 3.660 20 0 BHADMO CCCc1[nH+]ccn1CCCc1ccc(C)cc1 ZINC000543144452 325074191 /nfs/dbraw/zinc/07/41/91/325074191.db2.gz UGKHVRLPTRHFEO-UHFFFAOYSA-N 1 1 242.366 3.777 20 0 BHADMO C[C@H]1CCC[N@H+]1[C@H]1CCc2ccc(Cl)cc21 ZINC000543205828 325077234 /nfs/dbraw/zinc/07/72/34/325077234.db2.gz HNRGQZLUEGCMHF-HZMBPMFUSA-N 1 1 235.758 3.812 20 0 BHADMO C[C@H]1CCC[N@H+]1[C@@H]1CCc2ccc(Cl)cc21 ZINC000543205841 325077283 /nfs/dbraw/zinc/07/72/83/325077283.db2.gz HNRGQZLUEGCMHF-IINYFYTJSA-N 1 1 235.758 3.812 20 0 BHADMO C[C@@H]1CCC[N@H+]1[C@@H]1CCc2ccc(Cl)cc21 ZINC000543205843 325076843 /nfs/dbraw/zinc/07/68/43/325076843.db2.gz HNRGQZLUEGCMHF-QMTHXVAHSA-N 1 1 235.758 3.812 20 0 BHADMO C[C@@H]1CCC[N@H+]1[C@H]1CCc2ccc(Cl)cc21 ZINC000543205845 325076928 /nfs/dbraw/zinc/07/69/28/325076928.db2.gz HNRGQZLUEGCMHF-YGRLFVJLSA-N 1 1 235.758 3.812 20 0 BHADMO Cc1ccc(CCC[N@H+]2CCC23CCC3)cc1 ZINC000543206777 325076895 /nfs/dbraw/zinc/07/68/95/325076895.db2.gz AVMZRFCDMCAKMK-UHFFFAOYSA-N 1 1 229.367 3.556 20 0 BHADMO C[C@@H]1CC[N@@H+](CCCc2ccccc2Cl)C1 ZINC000543208726 325077293 /nfs/dbraw/zinc/07/72/93/325077293.db2.gz SUYSKLKHALRGJK-GFCCVEGCSA-N 1 1 237.774 3.614 20 0 BHADMO C[C@H]1CC[N@@H+](CCCc2ccccc2Cl)C1 ZINC000543208728 325077273 /nfs/dbraw/zinc/07/72/73/325077273.db2.gz SUYSKLKHALRGJK-LBPRGKRZSA-N 1 1 237.774 3.614 20 0 BHADMO CSCCC[N@H+]1CC[C@H](c2cccc(C)c2)C1 ZINC000543245184 325078678 /nfs/dbraw/zinc/07/86/78/325078678.db2.gz PRJNKHQELPOZEE-HNNXBMFYSA-N 1 1 249.423 3.537 20 0 BHADMO CSCCC[N@H+]1CC[C@@H](c2cccc(C)c2)C1 ZINC000543245192 325078712 /nfs/dbraw/zinc/07/87/12/325078712.db2.gz PRJNKHQELPOZEE-OAHLLOKOSA-N 1 1 249.423 3.537 20 0 BHADMO Cc1ccc([C@H]2CC[N@H+](C3CCCC3)C2)cc1 ZINC000543246688 325078494 /nfs/dbraw/zinc/07/84/94/325078494.db2.gz NXZOMIWJRLEDCJ-HNNXBMFYSA-N 1 1 229.367 3.727 20 0 BHADMO Cc1ccc([C@@H]2CC[N@H+](C3CCCC3)C2)cc1 ZINC000543246689 325078723 /nfs/dbraw/zinc/07/87/23/325078723.db2.gz NXZOMIWJRLEDCJ-OAHLLOKOSA-N 1 1 229.367 3.727 20 0 BHADMO Cc1cccc([C@H]2CC[N@H+]([C@@H]3C=CCCC3)C2)c1 ZINC000543254491 325078342 /nfs/dbraw/zinc/07/83/42/325078342.db2.gz ZGERJCKAEFSLSJ-DLBZAZTESA-N 1 1 241.378 3.893 20 0 BHADMO Cc1cccc([C@@H]2CC[N@H+]([C@@H]3C=CCCC3)C2)c1 ZINC000543254492 325078577 /nfs/dbraw/zinc/07/85/77/325078577.db2.gz ZGERJCKAEFSLSJ-IAGOWNOFSA-N 1 1 241.378 3.893 20 0 BHADMO Cc1cccc([C@H]2CC[N@H+]([C@H]3C=CCCC3)C2)c1 ZINC000543254493 325078335 /nfs/dbraw/zinc/07/83/35/325078335.db2.gz ZGERJCKAEFSLSJ-IRXDYDNUSA-N 1 1 241.378 3.893 20 0 BHADMO Cc1cccc([C@@H]2CC[N@H+]([C@H]3C=CCCC3)C2)c1 ZINC000543254494 325078361 /nfs/dbraw/zinc/07/83/61/325078361.db2.gz ZGERJCKAEFSLSJ-SJORKVTESA-N 1 1 241.378 3.893 20 0 BHADMO C[C@@H]1CCCC[C@@H]1C[N@@H+](C)Cc1ccco1 ZINC000543393540 325085982 /nfs/dbraw/zinc/08/59/82/325085982.db2.gz IOLQEYVCJXSXNC-CHWSQXEVSA-N 1 1 221.344 3.538 20 0 BHADMO C[C@@H]1CCCC[C@H]1C[N@@H+](C)Cc1ccco1 ZINC000543393541 325085770 /nfs/dbraw/zinc/08/57/70/325085770.db2.gz IOLQEYVCJXSXNC-OLZOCXBDSA-N 1 1 221.344 3.538 20 0 BHADMO C[C@H]1CCCC[C@@H]1C[N@@H+](C)Cc1ccco1 ZINC000543393542 325086057 /nfs/dbraw/zinc/08/60/57/325086057.db2.gz IOLQEYVCJXSXNC-QWHCGFSZSA-N 1 1 221.344 3.538 20 0 BHADMO C[C@H]1CCCC[C@H]1C[N@@H+](C)Cc1ccco1 ZINC000543393543 325086217 /nfs/dbraw/zinc/08/62/17/325086217.db2.gz IOLQEYVCJXSXNC-STQMWFEESA-N 1 1 221.344 3.538 20 0 BHADMO CC[C@H]1CCC[C@H](C[N@@H+](C)Cc2ccc[nH]2)C1 ZINC000543395861 325085376 /nfs/dbraw/zinc/08/53/76/325085376.db2.gz DEYWJTLWOOWDKS-KBPBESRZSA-N 1 1 234.387 3.663 20 0 BHADMO CC[C@@H]1CCC[C@H](C[N@@H+](C)Cc2ccc[nH]2)C1 ZINC000543395864 325085369 /nfs/dbraw/zinc/08/53/69/325085369.db2.gz DEYWJTLWOOWDKS-KGLIPLIRSA-N 1 1 234.387 3.663 20 0 BHADMO CC[C@H]1CCC[C@@H](C[N@@H+](C)Cc2ccc[nH]2)C1 ZINC000543395866 325085246 /nfs/dbraw/zinc/08/52/46/325085246.db2.gz DEYWJTLWOOWDKS-UONOGXRCSA-N 1 1 234.387 3.663 20 0 BHADMO CC[C@@H]1CCC[C@@H](C[N@@H+](C)Cc2ccc[nH]2)C1 ZINC000543395867 325085005 /nfs/dbraw/zinc/08/50/05/325085005.db2.gz DEYWJTLWOOWDKS-ZIAGYGMSSA-N 1 1 234.387 3.663 20 0 BHADMO C[N@H+](C[C@H]1CC=CCC1)C[C@@H]1CC=CCC1 ZINC000543412033 325086527 /nfs/dbraw/zinc/08/65/27/325086527.db2.gz BHRZYHKROUZSMJ-GASCZTMLSA-N 1 1 219.372 3.631 20 0 BHADMO C[C@H]1C[N@@H+](Cc2cccs2)CC(C)(C)C1 ZINC000543413044 325086827 /nfs/dbraw/zinc/08/68/27/325086827.db2.gz WCPPSNCOIFLGNV-LLVKDONJSA-N 1 1 223.385 3.616 20 0 BHADMO C[C@@H]1C[N@@H+](Cc2cccs2)CC(C)(C)C1 ZINC000543413045 325086558 /nfs/dbraw/zinc/08/65/58/325086558.db2.gz WCPPSNCOIFLGNV-NSHDSACASA-N 1 1 223.385 3.616 20 0 BHADMO COc1ccc(C[N@H+]2CC[C@H](C(C)(C)C)C2)cc1 ZINC000543413457 325087482 /nfs/dbraw/zinc/08/74/82/325087482.db2.gz NDEMPFKMVNUJDR-AWEZNQCLSA-N 1 1 247.382 3.563 20 0 BHADMO COc1ccc(C[N@H+]2CC[C@@H](C(C)(C)C)C2)cc1 ZINC000543413458 325087370 /nfs/dbraw/zinc/08/73/70/325087370.db2.gz NDEMPFKMVNUJDR-CQSZACIVSA-N 1 1 247.382 3.563 20 0 BHADMO CC(C)(C)[C@H]1CC[N@@H+](Cc2ccc(Cl)o2)C1 ZINC000543413560 325087175 /nfs/dbraw/zinc/08/71/75/325087175.db2.gz UBAXHNLUHQVPBN-JTQLQIEISA-N 1 1 241.762 3.801 20 0 BHADMO CC(C)(C)[C@@H]1CC[N@@H+](Cc2ccc(Cl)o2)C1 ZINC000543413561 325087575 /nfs/dbraw/zinc/08/75/75/325087575.db2.gz UBAXHNLUHQVPBN-SNVBAGLBSA-N 1 1 241.762 3.801 20 0 BHADMO Cc1ccc([C@H]2CC[N@@H+](Cc3ccco3)C2)cc1 ZINC000543414163 325087608 /nfs/dbraw/zinc/08/76/08/325087608.db2.gz RGDSHQBTIXHBTC-HNNXBMFYSA-N 1 1 241.334 3.578 20 0 BHADMO Cc1ccc([C@@H]2CC[N@@H+](Cc3ccco3)C2)cc1 ZINC000543414166 325087677 /nfs/dbraw/zinc/08/76/77/325087677.db2.gz RGDSHQBTIXHBTC-OAHLLOKOSA-N 1 1 241.334 3.578 20 0 BHADMO C[C@@H](Cc1ccccc1)C[N@@H+](C)Cc1ccco1 ZINC000543446973 325088275 /nfs/dbraw/zinc/08/82/75/325088275.db2.gz GMWZDZZQRWWDQC-AWEZNQCLSA-N 1 1 243.350 3.590 20 0 BHADMO C[C@H](Cc1ccccc1)C[N@@H+](C)Cc1ccco1 ZINC000543446979 325088417 /nfs/dbraw/zinc/08/84/17/325088417.db2.gz GMWZDZZQRWWDQC-CQSZACIVSA-N 1 1 243.350 3.590 20 0 BHADMO C[C@@H](Cc1ccccc1)C[N@@H+](C)CC1CCC1 ZINC000543448089 325089104 /nfs/dbraw/zinc/08/91/04/325089104.db2.gz RCRAIGKPBNFDML-AWEZNQCLSA-N 1 1 231.383 3.597 20 0 BHADMO C[C@H](Cc1ccccc1)C[N@@H+](C)CC1CCC1 ZINC000543448090 325088803 /nfs/dbraw/zinc/08/88/03/325088803.db2.gz RCRAIGKPBNFDML-CQSZACIVSA-N 1 1 231.383 3.597 20 0 BHADMO CC[N@@H+](CCCOCc1ccccc1)CC(C)C ZINC000543449065 325089724 /nfs/dbraw/zinc/08/97/24/325089724.db2.gz AEMZPRUXXGDYFA-UHFFFAOYSA-N 1 1 249.398 3.571 20 0 BHADMO CCC[C@H]1CCCC[N@H+]1[C@H]1C=CCCC1 ZINC000543559302 325093873 /nfs/dbraw/zinc/09/38/73/325093873.db2.gz QGGJWNXQMWDRNR-KBPBESRZSA-N 1 1 207.361 3.750 20 0 BHADMO CCC[C@@H]1CCCC[N@H+]1[C@H]1C=CCCC1 ZINC000543559307 325093634 /nfs/dbraw/zinc/09/36/34/325093634.db2.gz QGGJWNXQMWDRNR-KGLIPLIRSA-N 1 1 207.361 3.750 20 0 BHADMO CCC[C@H]1CCCC[N@H+]1[C@@H]1C=CCCC1 ZINC000543559308 325093560 /nfs/dbraw/zinc/09/35/60/325093560.db2.gz QGGJWNXQMWDRNR-UONOGXRCSA-N 1 1 207.361 3.750 20 0 BHADMO CCC[C@@H]1CCCC[N@H+]1[C@@H]1C=CCCC1 ZINC000543559310 325093915 /nfs/dbraw/zinc/09/39/15/325093915.db2.gz QGGJWNXQMWDRNR-ZIAGYGMSSA-N 1 1 207.361 3.750 20 0 BHADMO C[N@H+](Cc1ccccn1)C[C@H]1CCCC(C)(C)C1 ZINC000543619796 325097875 /nfs/dbraw/zinc/09/78/75/325097875.db2.gz HXRONHRCRZHNII-AWEZNQCLSA-N 1 1 246.398 3.730 20 0 BHADMO C[N@H+](Cc1ccccn1)C[C@@H]1CCCC(C)(C)C1 ZINC000543619797 325097992 /nfs/dbraw/zinc/09/79/92/325097992.db2.gz HXRONHRCRZHNII-CQSZACIVSA-N 1 1 246.398 3.730 20 0 BHADMO CC[N@@H+](CC(F)F)CC1CCCCCC1 ZINC000543620655 325098971 /nfs/dbraw/zinc/09/89/71/325098971.db2.gz HEBALFQZHSIZQY-UHFFFAOYSA-N 1 1 219.319 3.544 20 0 BHADMO CC[N@H+](CC(F)F)CC1CCCCCC1 ZINC000543620655 325098968 /nfs/dbraw/zinc/09/89/68/325098968.db2.gz HEBALFQZHSIZQY-UHFFFAOYSA-N 1 1 219.319 3.544 20 0 BHADMO Cc1ccc(C)c([C@@H](C)[NH2+][C@H](C)c2ccon2)c1 ZINC000543627231 325098564 /nfs/dbraw/zinc/09/85/64/325098564.db2.gz VFNSYRVBFYQMNW-CHWSQXEVSA-N 1 1 244.338 3.703 20 0 BHADMO Cc1ccc(C)c([C@@H](C)[NH2+][C@@H](C)c2ccon2)c1 ZINC000543627232 325098923 /nfs/dbraw/zinc/09/89/23/325098923.db2.gz VFNSYRVBFYQMNW-OLZOCXBDSA-N 1 1 244.338 3.703 20 0 BHADMO Cc1ccc(C)c([C@H](C)[NH2+][C@H](C)c2ccon2)c1 ZINC000543627234 325098665 /nfs/dbraw/zinc/09/86/65/325098665.db2.gz VFNSYRVBFYQMNW-QWHCGFSZSA-N 1 1 244.338 3.703 20 0 BHADMO Cc1ccc(C)c([C@H](C)[NH2+][C@@H](C)c2ccon2)c1 ZINC000543627235 325098457 /nfs/dbraw/zinc/09/84/57/325098457.db2.gz VFNSYRVBFYQMNW-STQMWFEESA-N 1 1 244.338 3.703 20 0 BHADMO CC1=CC[N@@H+](C/C=C\c2ccc(F)cc2F)CC1 ZINC000543629541 325098654 /nfs/dbraw/zinc/09/86/54/325098654.db2.gz RIFHJPVFMJTVEL-IHWYPQMZSA-N 1 1 249.304 3.630 20 0 BHADMO CC1=CC[N@@H+](C/C=C/c2ccc(F)cc2F)CC1 ZINC000543629542 325098009 /nfs/dbraw/zinc/09/80/09/325098009.db2.gz RIFHJPVFMJTVEL-NSCUHMNNSA-N 1 1 249.304 3.630 20 0 BHADMO CC(C)C[N@@H+](C)C/C=C\c1ccc(F)cc1F ZINC000543632621 325099224 /nfs/dbraw/zinc/09/92/24/325099224.db2.gz VOJNLENYPXOPCD-PLNGDYQASA-N 1 1 239.309 3.566 20 0 BHADMO CC(C)C[N@@H+](C)C/C=C/c1ccc(F)cc1F ZINC000543632623 325099602 /nfs/dbraw/zinc/09/96/02/325099602.db2.gz VOJNLENYPXOPCD-SNAWJCMRSA-N 1 1 239.309 3.566 20 0 BHADMO CCC[C@@H]1CCCC[N@H+]1Cc1occc1C ZINC000543638494 325099240 /nfs/dbraw/zinc/09/92/40/325099240.db2.gz UMBFEYKZSCFNBK-CYBMUJFWSA-N 1 1 221.344 3.743 20 0 BHADMO CCC[C@H]1CCCC[N@H+]1Cc1occc1C ZINC000543638496 325099531 /nfs/dbraw/zinc/09/95/31/325099531.db2.gz UMBFEYKZSCFNBK-ZDUSSCGKSA-N 1 1 221.344 3.743 20 0 BHADMO CCC[C@@H]1CCCC[N@H+]1Cc1cccs1 ZINC000543645145 325100492 /nfs/dbraw/zinc/10/04/92/325100492.db2.gz VYHPDBVMWMBFHW-GFCCVEGCSA-N 1 1 223.385 3.903 20 0 BHADMO CCC[C@H]1CCCC[N@H+]1Cc1cccs1 ZINC000543645147 325100392 /nfs/dbraw/zinc/10/03/92/325100392.db2.gz VYHPDBVMWMBFHW-LBPRGKRZSA-N 1 1 223.385 3.903 20 0 BHADMO CCC1(C[N@@H+](C)[C@H](C)C(C)(C)C)CCOCC1 ZINC000543759016 325111857 /nfs/dbraw/zinc/11/18/57/325111857.db2.gz RNZKSMFUMGOXBL-CYBMUJFWSA-N 1 1 241.419 3.560 20 0 BHADMO CCC1(C[N@@H+](C)[C@@H](C)C(C)(C)C)CCOCC1 ZINC000543759017 325111810 /nfs/dbraw/zinc/11/18/10/325111810.db2.gz RNZKSMFUMGOXBL-ZDUSSCGKSA-N 1 1 241.419 3.560 20 0 BHADMO C[C@@H]1CC[C@]2(CC[N@H+]([C@H]3C=CCCC3)C2)C1 ZINC000543806272 325115589 /nfs/dbraw/zinc/11/55/89/325115589.db2.gz ASYGTTPSHOMXCX-ILXRZTDVSA-N 1 1 219.372 3.607 20 0 BHADMO C[C@@H]1CC[C@]2(CC[N@H+]([C@@H]3C=CCCC3)C2)C1 ZINC000543806273 325115082 /nfs/dbraw/zinc/11/50/82/325115082.db2.gz ASYGTTPSHOMXCX-KFWWJZLASA-N 1 1 219.372 3.607 20 0 BHADMO C[C@@H]1CC[C@@]2(CC[N@H+]([C@H]3C=CCCC3)C2)C1 ZINC000543806274 325115228 /nfs/dbraw/zinc/11/52/28/325115228.db2.gz ASYGTTPSHOMXCX-QLFBSQMISA-N 1 1 219.372 3.607 20 0 BHADMO C[C@@H]1CC[C@@]2(CC[N@H+]([C@@H]3C=CCCC3)C2)C1 ZINC000543806275 325115163 /nfs/dbraw/zinc/11/51/63/325115163.db2.gz ASYGTTPSHOMXCX-RBSFLKMASA-N 1 1 219.372 3.607 20 0 BHADMO C[C@@H](C[N@H+]1CC[C@@]2(CC[C@@H](C)C2)C1)C(F)(F)F ZINC000543810399 325114985 /nfs/dbraw/zinc/11/49/85/325114985.db2.gz IFKBHFZQYGGAEI-GRYCIOLGSA-N 1 1 249.320 3.697 20 0 BHADMO C[C@H](C[N@H+]1CC[C@@]2(CC[C@@H](C)C2)C1)C(F)(F)F ZINC000543810404 325115368 /nfs/dbraw/zinc/11/53/68/325115368.db2.gz IFKBHFZQYGGAEI-IJLUTSLNSA-N 1 1 249.320 3.697 20 0 BHADMO C[C@H](C[N@H+]1CC[C@]2(CC[C@@H](C)C2)C1)C(F)(F)F ZINC000543810610 325115056 /nfs/dbraw/zinc/11/50/56/325115056.db2.gz IFKBHFZQYGGAEI-UTUOFQBUSA-N 1 1 249.320 3.697 20 0 BHADMO C[C@@H](C[N@H+]1CC[C@]2(CC[C@@H](C)C2)C1)C(F)(F)F ZINC000543810611 325115351 /nfs/dbraw/zinc/11/53/51/325115351.db2.gz IFKBHFZQYGGAEI-WOPDTQHZSA-N 1 1 249.320 3.697 20 0 BHADMO CO[C@H](C)C[N@@H+](C)[C@@H](c1ccccc1C)C(C)C ZINC000543855830 325118570 /nfs/dbraw/zinc/11/85/70/325118570.db2.gz SKGMYUREBOXGAO-GDBMZVCRSA-N 1 1 249.398 3.659 20 0 BHADMO CO[C@@H](C)C[N@@H+](C)[C@@H](c1ccccc1C)C(C)C ZINC000543855831 325118360 /nfs/dbraw/zinc/11/83/60/325118360.db2.gz SKGMYUREBOXGAO-GOEBONIOSA-N 1 1 249.398 3.659 20 0 BHADMO CO[C@@H](C)C[N@@H+](C)[C@H](c1ccccc1C)C(C)C ZINC000543855832 325118526 /nfs/dbraw/zinc/11/85/26/325118526.db2.gz SKGMYUREBOXGAO-HOCLYGCPSA-N 1 1 249.398 3.659 20 0 BHADMO CO[C@H](C)C[N@@H+](C)[C@H](c1ccccc1C)C(C)C ZINC000543855833 325118081 /nfs/dbraw/zinc/11/80/81/325118081.db2.gz SKGMYUREBOXGAO-ZBFHGGJFSA-N 1 1 249.398 3.659 20 0 BHADMO C[C@@H]1C[N@H+]([C@@H]2C=CCCC2)[C@@H]2CCCC[C@H]21 ZINC000543898321 325121721 /nfs/dbraw/zinc/12/17/21/325121721.db2.gz WCZMMPGCARBMHT-APIJFGDWSA-N 1 1 219.372 3.606 20 0 BHADMO C[C@@H]1C[N@H+]([C@@H]2C=CCCC2)[C@@H]2CCCC[C@@H]21 ZINC000543898322 325121643 /nfs/dbraw/zinc/12/16/43/325121643.db2.gz WCZMMPGCARBMHT-KBUPBQIOSA-N 1 1 219.372 3.606 20 0 BHADMO C[C@@H]1C[N@H+]([C@@H]2C=CCCC2)[C@H]2CCCC[C@@H]12 ZINC000543898323 325121407 /nfs/dbraw/zinc/12/14/07/325121407.db2.gz WCZMMPGCARBMHT-KBXIAJHMSA-N 1 1 219.372 3.606 20 0 BHADMO C[C@@H]1C[N@H+]([C@@H]2C=CCCC2)[C@H]2CCCC[C@H]12 ZINC000543898324 325121761 /nfs/dbraw/zinc/12/17/61/325121761.db2.gz WCZMMPGCARBMHT-TUVASFSCSA-N 1 1 219.372 3.606 20 0 BHADMO C[N@@H+](CCCc1ccsc1)C1CCCC1 ZINC000543947147 325123372 /nfs/dbraw/zinc/12/33/72/325123372.db2.gz AJISFQBYMCMDLT-UHFFFAOYSA-N 1 1 223.385 3.555 20 0 BHADMO C[N@@H+](CCCc1ccsc1)C1CCCCC1 ZINC000543947255 325123362 /nfs/dbraw/zinc/12/33/62/325123362.db2.gz QFAKTOLMAJESAR-UHFFFAOYSA-N 1 1 237.412 3.945 20 0 BHADMO C[N@@H+](CCCc1ccsc1)Cc1ccccc1 ZINC000543947291 325122999 /nfs/dbraw/zinc/12/29/99/325122999.db2.gz SSABRHJVBYEVHY-UHFFFAOYSA-N 1 1 245.391 3.813 20 0 BHADMO C[C@@H]1CCC[N@@H+](CCCc2ccsc2)CC1 ZINC000543947798 325122935 /nfs/dbraw/zinc/12/29/35/325122935.db2.gz CROUURRGTRDWQO-CYBMUJFWSA-N 1 1 237.412 3.803 20 0 BHADMO C[C@H]1CCC[N@@H+](CCCc2ccsc2)CC1 ZINC000543947802 325122974 /nfs/dbraw/zinc/12/29/74/325122974.db2.gz CROUURRGTRDWQO-ZDUSSCGKSA-N 1 1 237.412 3.803 20 0 BHADMO CC(C)[C@@H](C)[N@@H+](C)CCCc1ccsc1 ZINC000543947994 325122879 /nfs/dbraw/zinc/12/28/79/325122879.db2.gz XAOZPRVSFQOGBZ-GFCCVEGCSA-N 1 1 225.401 3.657 20 0 BHADMO CC(C)[C@H](C)[N@@H+](C)CCCc1ccsc1 ZINC000543947996 325123146 /nfs/dbraw/zinc/12/31/46/325123146.db2.gz XAOZPRVSFQOGBZ-LBPRGKRZSA-N 1 1 225.401 3.657 20 0 BHADMO CC(C)C[N@@H+](CCCc1ccsc1)C1CC1 ZINC000543948253 325123340 /nfs/dbraw/zinc/12/33/40/325123340.db2.gz VISHNLWMGMIIRN-UHFFFAOYSA-N 1 1 237.412 3.801 20 0 BHADMO C[N@@H+](CCCc1ccsc1)CC1CCCC1 ZINC000543956544 325123573 /nfs/dbraw/zinc/12/35/73/325123573.db2.gz GWFVVAHZBOPLNM-UHFFFAOYSA-N 1 1 237.412 3.803 20 0 BHADMO C[N@@H+](CCCc1ccsc1)CC(C)(C)C ZINC000543956585 325124015 /nfs/dbraw/zinc/12/40/15/325124015.db2.gz MAUKWWKCFOAORU-UHFFFAOYSA-N 1 1 225.401 3.659 20 0 BHADMO CC[C@@]1(C)CC[N@@H+](CCCc2ccsc2)C1 ZINC000543959901 325123660 /nfs/dbraw/zinc/12/36/60/325123660.db2.gz FVKPRUFVJMEBRP-AWEZNQCLSA-N 1 1 237.412 3.803 20 0 BHADMO CC[C@]1(C)CC[N@@H+](CCCc2ccsc2)C1 ZINC000543959902 325124061 /nfs/dbraw/zinc/12/40/61/325124061.db2.gz FVKPRUFVJMEBRP-CQSZACIVSA-N 1 1 237.412 3.803 20 0 BHADMO CC(C)[C@H]1CC[N@@H+](CCCc2ccsc2)C1 ZINC000543960179 325123908 /nfs/dbraw/zinc/12/39/08/325123908.db2.gz ZWPXNAMYGFFPOL-AWEZNQCLSA-N 1 1 237.412 3.659 20 0 BHADMO CC(C)[C@@H]1CC[N@@H+](CCCc2ccsc2)C1 ZINC000543960180 325124004 /nfs/dbraw/zinc/12/40/04/325124004.db2.gz ZWPXNAMYGFFPOL-CQSZACIVSA-N 1 1 237.412 3.659 20 0 BHADMO C[C@H](CCc1cccc(F)c1)[N@@H+](C)CC1CCC1 ZINC000543983600 325125482 /nfs/dbraw/zinc/12/54/82/325125482.db2.gz YZZLWNQQEUTXOP-CYBMUJFWSA-N 1 1 249.373 3.879 20 0 BHADMO C[C@@H](CCc1cccc(F)c1)[N@@H+](C)CC1CCC1 ZINC000543983603 325125635 /nfs/dbraw/zinc/12/56/35/325125635.db2.gz YZZLWNQQEUTXOP-ZDUSSCGKSA-N 1 1 249.373 3.879 20 0 BHADMO C[C@@H]1CC[N@@H+](CCCc2ccsc2)C[C@H]1C ZINC000543989806 325125568 /nfs/dbraw/zinc/12/55/68/325125568.db2.gz BMOPVCAUVSAFAJ-CHWSQXEVSA-N 1 1 237.412 3.659 20 0 BHADMO C[C@@H]1CC[N@@H+](CCCc2ccsc2)C[C@@H]1C ZINC000543989807 325125200 /nfs/dbraw/zinc/12/52/00/325125200.db2.gz 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BHADMO C[C@H]1CCCC[C@H]1C[N@@H+](CC(F)F)C1CC1 ZINC000544348094 325138639 /nfs/dbraw/zinc/13/86/39/325138639.db2.gz FAONNCSJDFTIEH-QWRGUYRKSA-N 1 1 231.330 3.542 20 0 BHADMO C[C@H]1CCCC[C@H]1C[N@H+](CC(F)F)C1CC1 ZINC000544348094 325138636 /nfs/dbraw/zinc/13/86/36/325138636.db2.gz FAONNCSJDFTIEH-QWRGUYRKSA-N 1 1 231.330 3.542 20 0 BHADMO C[C@H]1CCCC[C@@H]1C[N@@H+](CC(F)F)C1CC1 ZINC000544348095 325138512 /nfs/dbraw/zinc/13/85/12/325138512.db2.gz FAONNCSJDFTIEH-WDEREUQCSA-N 1 1 231.330 3.542 20 0 BHADMO C[C@H]1CCCC[C@@H]1C[N@H+](CC(F)F)C1CC1 ZINC000544348095 325138509 /nfs/dbraw/zinc/13/85/09/325138509.db2.gz FAONNCSJDFTIEH-WDEREUQCSA-N 1 1 231.330 3.542 20 0 BHADMO C[C@@H]1CCCC[C@@H]1C[N@H+]1CCC[C@H]1c1ccc[nH]1 ZINC000544348980 325138246 /nfs/dbraw/zinc/13/82/46/325138246.db2.gz OEIQYZNKHNZERS-FMKPAKJESA-N 1 1 246.398 3.978 20 0 BHADMO C[C@@H]1CCCC[C@@H]1C[N@H+]1CCC[C@@H]1c1ccc[nH]1 ZINC000544348982 325138685 /nfs/dbraw/zinc/13/86/85/325138685.db2.gz OEIQYZNKHNZERS-IIAWOOMASA-N 1 1 246.398 3.978 20 0 BHADMO C[C@@H]1CCCC[C@H]1C[N@H+]1CCC[C@@H]1c1ccc[nH]1 ZINC000544348984 325138255 /nfs/dbraw/zinc/13/82/55/325138255.db2.gz OEIQYZNKHNZERS-IJEWVQPXSA-N 1 1 246.398 3.978 20 0 BHADMO C[C@@H]1CCCC[C@H]1C[N@H+]1CCC[C@H]1c1ccc[nH]1 ZINC000544348985 325138378 /nfs/dbraw/zinc/13/83/78/325138378.db2.gz OEIQYZNKHNZERS-YCPHGPKFSA-N 1 1 246.398 3.978 20 0 BHADMO CC(C)(C)[C@@H]1CC[N@@H+](Cc2cccs2)C1 ZINC000544365013 325138981 /nfs/dbraw/zinc/13/89/81/325138981.db2.gz FBQUEXFLDZQGSQ-LLVKDONJSA-N 1 1 223.385 3.616 20 0 BHADMO CC(C)(C)[C@H]1CC[N@@H+](Cc2cccs2)C1 ZINC000544365014 325139137 /nfs/dbraw/zinc/13/91/37/325139137.db2.gz FBQUEXFLDZQGSQ-NSHDSACASA-N 1 1 223.385 3.616 20 0 BHADMO CC(C)(C)[C@@H]1CC[N@@H+](Cc2ccsc2)C1 ZINC000544365941 325139368 /nfs/dbraw/zinc/13/93/68/325139368.db2.gz OBVYXJQFPYMUKT-GFCCVEGCSA-N 1 1 223.385 3.616 20 0 BHADMO CC(C)(C)[C@H]1CC[N@@H+](Cc2ccsc2)C1 ZINC000544365942 325139065 /nfs/dbraw/zinc/13/90/65/325139065.db2.gz OBVYXJQFPYMUKT-LBPRGKRZSA-N 1 1 223.385 3.616 20 0 BHADMO C[N@H+](Cc1ccc(Cl)o1)C[C@@H]1CC=CCC1 ZINC000544369364 325140030 /nfs/dbraw/zinc/14/00/30/325140030.db2.gz PLMBVQLPQWAMFV-LLVKDONJSA-N 1 1 239.746 3.721 20 0 BHADMO C[N@H+](Cc1ccc(Cl)o1)C[C@H]1CC=CCC1 ZINC000544369365 325139880 /nfs/dbraw/zinc/13/98/80/325139880.db2.gz PLMBVQLPQWAMFV-NSHDSACASA-N 1 1 239.746 3.721 20 0 BHADMO CC[C@H](C)C[N@@H+](C)CCCOCc1ccccc1 ZINC000544393768 325140542 /nfs/dbraw/zinc/14/05/42/325140542.db2.gz BPBSRLYTIKZHTB-HNNXBMFYSA-N 1 1 249.398 3.571 20 0 BHADMO CC[C@@H](C)C[N@@H+](C)CCCOCc1ccccc1 ZINC000544393769 325140641 /nfs/dbraw/zinc/14/06/41/325140641.db2.gz BPBSRLYTIKZHTB-OAHLLOKOSA-N 1 1 249.398 3.571 20 0 BHADMO CC[N@@H+](C[C@@H](C)Cc1ccccc1)C1CCC1 ZINC000544407536 325141441 /nfs/dbraw/zinc/14/14/41/325141441.db2.gz KIKAOYVSGGXDPL-AWEZNQCLSA-N 1 1 231.383 3.740 20 0 BHADMO CC[N@@H+](C[C@H](C)Cc1ccccc1)C1CCC1 ZINC000544407538 325141512 /nfs/dbraw/zinc/14/15/12/325141512.db2.gz KIKAOYVSGGXDPL-CQSZACIVSA-N 1 1 231.383 3.740 20 0 BHADMO CCCC[N@@H+](C)C[C@@H](C)Cc1ccccc1 ZINC000544408065 325141607 /nfs/dbraw/zinc/14/16/07/325141607.db2.gz PPBQJNNCUMNWDS-AWEZNQCLSA-N 1 1 219.372 3.597 20 0 BHADMO CCCC[N@@H+](C)C[C@H](C)Cc1ccccc1 ZINC000544408067 325141688 /nfs/dbraw/zinc/14/16/88/325141688.db2.gz PPBQJNNCUMNWDS-CQSZACIVSA-N 1 1 219.372 3.597 20 0 BHADMO CCC(CC)C[N@@H+](CC)CC[C@@H]1CCCCO1 ZINC000544408266 325141246 /nfs/dbraw/zinc/14/12/46/325141246.db2.gz JEYOYCSRUZFNMX-HNNXBMFYSA-N 1 1 241.419 3.704 20 0 BHADMO CCC(CC)C[N@@H+](CC)CC[C@H]1CCCCO1 ZINC000544408267 325141528 /nfs/dbraw/zinc/14/15/28/325141528.db2.gz JEYOYCSRUZFNMX-OAHLLOKOSA-N 1 1 241.419 3.704 20 0 BHADMO CC[C@H](C)[N@@H+](C)C[C@@H](C)Cc1ccccc1 ZINC000544408472 325141673 /nfs/dbraw/zinc/14/16/73/325141673.db2.gz ZLXZRSNVUURBKF-KBPBESRZSA-N 1 1 219.372 3.596 20 0 BHADMO CC[C@H](C)[N@@H+](C)C[C@H](C)Cc1ccccc1 ZINC000544408475 325141664 /nfs/dbraw/zinc/14/16/64/325141664.db2.gz ZLXZRSNVUURBKF-KGLIPLIRSA-N 1 1 219.372 3.596 20 0 BHADMO CC[C@@H](C)[N@@H+](C)C[C@@H](C)Cc1ccccc1 ZINC000544408476 325141410 /nfs/dbraw/zinc/14/14/10/325141410.db2.gz ZLXZRSNVUURBKF-UONOGXRCSA-N 1 1 219.372 3.596 20 0 BHADMO CC[C@@H](C)[N@@H+](C)C[C@H](C)Cc1ccccc1 ZINC000544408477 325141589 /nfs/dbraw/zinc/14/15/89/325141589.db2.gz ZLXZRSNVUURBKF-ZIAGYGMSSA-N 1 1 219.372 3.596 20 0 BHADMO CC(C)[C@H](C)[N@@H+](C)CCCOCc1ccccc1 ZINC000544408752 325141635 /nfs/dbraw/zinc/14/16/35/325141635.db2.gz LMOYUMVTROHCOU-HNNXBMFYSA-N 1 1 249.398 3.570 20 0 BHADMO CC(C)[C@@H](C)[N@@H+](C)CCCOCc1ccccc1 ZINC000544408755 325141711 /nfs/dbraw/zinc/14/17/11/325141711.db2.gz LMOYUMVTROHCOU-OAHLLOKOSA-N 1 1 249.398 3.570 20 0 BHADMO CCCCC[N@@H+](CCCc1ccncc1)C(C)C ZINC000544408865 325141192 /nfs/dbraw/zinc/14/11/92/325141192.db2.gz ULRXFEVICZDCTP-UHFFFAOYSA-N 1 1 248.414 3.915 20 0 BHADMO Cc1ccc([C@@H]([NH2+]Cc2ccco2)C2CCC2)o1 ZINC000544584308 325150387 /nfs/dbraw/zinc/15/03/87/325150387.db2.gz UHQRYIGPDYSQPG-HNNXBMFYSA-N 1 1 245.322 3.812 20 0 BHADMO Cc1ccc([C@H]([NH2+]Cc2ccco2)C2CCC2)o1 ZINC000544584309 325149937 /nfs/dbraw/zinc/14/99/37/325149937.db2.gz UHQRYIGPDYSQPG-OAHLLOKOSA-N 1 1 245.322 3.812 20 0 BHADMO CC[C@@H](C[N@H+]1CCCSCC1)c1ccccc1 ZINC000544598353 325150771 /nfs/dbraw/zinc/15/07/71/325150771.db2.gz RQDFXUVEMXNGOL-AWEZNQCLSA-N 1 1 249.423 3.619 20 0 BHADMO CC[C@H](C[N@H+]1CCCSCC1)c1ccccc1 ZINC000544598354 325150836 /nfs/dbraw/zinc/15/08/36/325150836.db2.gz RQDFXUVEMXNGOL-CQSZACIVSA-N 1 1 249.423 3.619 20 0 BHADMO C[N@H+](Cc1cccnc1)C[C@H]1CCCC(C)(C)C1 ZINC000544598761 325150814 /nfs/dbraw/zinc/15/08/14/325150814.db2.gz VHCHRKAXRJHRRS-AWEZNQCLSA-N 1 1 246.398 3.730 20 0 BHADMO C[N@H+](Cc1cccnc1)C[C@@H]1CCCC(C)(C)C1 ZINC000544598765 325150664 /nfs/dbraw/zinc/15/06/64/325150664.db2.gz VHCHRKAXRJHRRS-CQSZACIVSA-N 1 1 246.398 3.730 20 0 BHADMO C[N@H+](Cc1ccncc1)C[C@H]1CCCC(C)(C)C1 ZINC000544600267 325151611 /nfs/dbraw/zinc/15/16/11/325151611.db2.gz KGINUDFVIKWOCF-HNNXBMFYSA-N 1 1 246.398 3.730 20 0 BHADMO C[N@H+](Cc1ccncc1)C[C@@H]1CCCC(C)(C)C1 ZINC000544600268 325151587 /nfs/dbraw/zinc/15/15/87/325151587.db2.gz KGINUDFVIKWOCF-OAHLLOKOSA-N 1 1 246.398 3.730 20 0 BHADMO CCc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccon2)cc1 ZINC000544602470 325150676 /nfs/dbraw/zinc/15/06/76/325150676.db2.gz LUCJCESBCWYJIW-NEPJUHHUSA-N 1 1 244.338 3.649 20 0 BHADMO CCc1ccc([C@H](C)[NH2+][C@H](C)c2ccon2)cc1 ZINC000544602471 325150777 /nfs/dbraw/zinc/15/07/77/325150777.db2.gz LUCJCESBCWYJIW-NWDGAFQWSA-N 1 1 244.338 3.649 20 0 BHADMO CCc1ccc([C@H](C)[NH2+][C@@H](C)c2ccon2)cc1 ZINC000544602472 325151202 /nfs/dbraw/zinc/15/12/02/325151202.db2.gz LUCJCESBCWYJIW-RYUDHWBXSA-N 1 1 244.338 3.649 20 0 BHADMO CCc1ccc([C@@H](C)[NH2+][C@H](C)c2ccon2)cc1 ZINC000544602473 325150613 /nfs/dbraw/zinc/15/06/13/325150613.db2.gz LUCJCESBCWYJIW-VXGBXAGGSA-N 1 1 244.338 3.649 20 0 BHADMO Cc1cccc([C@@H](C)[NH2+][C@H](C)c2ccon2)c1C ZINC000544607204 325151741 /nfs/dbraw/zinc/15/17/41/325151741.db2.gz QZBZUUNVPTZHKZ-CHWSQXEVSA-N 1 1 244.338 3.703 20 0 BHADMO Cc1cccc([C@@H](C)[NH2+][C@@H](C)c2ccon2)c1C ZINC000544607205 325151639 /nfs/dbraw/zinc/15/16/39/325151639.db2.gz QZBZUUNVPTZHKZ-OLZOCXBDSA-N 1 1 244.338 3.703 20 0 BHADMO Cc1cccc([C@H](C)[NH2+][C@H](C)c2ccon2)c1C ZINC000544607206 398197362 /nfs/dbraw/zinc/19/73/62/398197362.db2.gz QZBZUUNVPTZHKZ-QWHCGFSZSA-N 1 1 244.338 3.703 20 0 BHADMO Cc1cccc([C@H](C)[NH2+][C@@H](C)c2ccon2)c1C ZINC000544607207 323955872 /nfs/dbraw/zinc/95/58/72/323955872.db2.gz QZBZUUNVPTZHKZ-STQMWFEESA-N 1 1 244.338 3.703 20 0 BHADMO CC[N@@H+](C/C=C/c1ccc(F)cc1F)C(C)C ZINC000544608554 325151684 /nfs/dbraw/zinc/15/16/84/325151684.db2.gz XETPMZRRCOCNHZ-AATRIKPKSA-N 1 1 239.309 3.708 20 0 BHADMO CC[N@@H+](C/C=C\c1ccc(F)cc1F)C(C)C ZINC000544608555 325151930 /nfs/dbraw/zinc/15/19/30/325151930.db2.gz XETPMZRRCOCNHZ-WAYWQWQTSA-N 1 1 239.309 3.708 20 0 BHADMO CC(C)c1ccc(C[NH2+][C@H](C)c2ccon2)cc1 ZINC000544621233 325152579 /nfs/dbraw/zinc/15/25/79/325152579.db2.gz PUDUDJGGNSKKEF-GFCCVEGCSA-N 1 1 244.338 3.649 20 0 BHADMO CC(C)c1ccc(C[NH2+][C@@H](C)c2ccon2)cc1 ZINC000544621234 325152645 /nfs/dbraw/zinc/15/26/45/325152645.db2.gz PUDUDJGGNSKKEF-LBPRGKRZSA-N 1 1 244.338 3.649 20 0 BHADMO CC(C)c1[nH+]ccn1CC1CCCCCC1 ZINC000544678074 325154717 /nfs/dbraw/zinc/15/47/17/325154717.db2.gz YADBVLWOYVTRRP-UHFFFAOYSA-N 1 1 220.360 3.977 20 0 BHADMO CCCC[C@H](CC)C[N@@H+](C)CCc1ccccn1 ZINC000544894529 325165228 /nfs/dbraw/zinc/16/52/28/325165228.db2.gz XKKUJUKSCFFIOZ-HNNXBMFYSA-N 1 1 248.414 3.772 20 0 BHADMO CCCC[C@@H](CC)C[N@@H+](C)CCc1ccccn1 ZINC000544894530 325165327 /nfs/dbraw/zinc/16/53/27/325165327.db2.gz XKKUJUKSCFFIOZ-OAHLLOKOSA-N 1 1 248.414 3.772 20 0 BHADMO CC[N@@H+](CCC1CC1)Cc1cc(F)ccc1F ZINC000544901437 325166273 /nfs/dbraw/zinc/16/62/73/325166273.db2.gz BYECOUPUENVTOT-UHFFFAOYSA-N 1 1 239.309 3.587 20 0 BHADMO CC[N@@H+](CCC1CC1)Cc1sccc1C ZINC000544939692 325168223 /nfs/dbraw/zinc/16/82/23/325168223.db2.gz DEUHUDZGXKHVJF-UHFFFAOYSA-N 1 1 223.385 3.679 20 0 BHADMO CC[N@@H+](CCC1CC1)Cc1ccc(OC)c(C)c1 ZINC000544940149 325168343 /nfs/dbraw/zinc/16/83/43/325168343.db2.gz BZGZMQFAAUKIRH-UHFFFAOYSA-N 1 1 247.382 3.626 20 0 BHADMO CC[N@@H+](CCC1CC1)Cc1cc(F)cc(F)c1 ZINC000544942535 325169127 /nfs/dbraw/zinc/16/91/27/325169127.db2.gz BLPUNIPLNZHAHV-UHFFFAOYSA-N 1 1 239.309 3.587 20 0 BHADMO CCCCC[N@H+]1C[C@@H](C)C[C@@H]1c1cccnc1 ZINC000545177624 325183126 /nfs/dbraw/zinc/18/31/26/325183126.db2.gz YRZSNFIEKFYAFM-DZGCQCFKSA-N 1 1 232.371 3.655 20 0 BHADMO CCCCC[N@H+]1C[C@H](C)C[C@H]1c1cccnc1 ZINC000545177625 325183109 /nfs/dbraw/zinc/18/31/09/325183109.db2.gz YRZSNFIEKFYAFM-HIFRSBDPSA-N 1 1 232.371 3.655 20 0 BHADMO CCCCC[N@H+]1C[C@H](C)C[C@@H]1c1cccnc1 ZINC000545177626 325183022 /nfs/dbraw/zinc/18/30/22/325183022.db2.gz YRZSNFIEKFYAFM-UKRRQHHQSA-N 1 1 232.371 3.655 20 0 BHADMO CCCCC[N@H+]1C[C@@H](C)C[C@H]1c1cccnc1 ZINC000545177627 325183016 /nfs/dbraw/zinc/18/30/16/325183016.db2.gz YRZSNFIEKFYAFM-ZFWWWQNUSA-N 1 1 232.371 3.655 20 0 BHADMO CCC[N@@H+](CCc1cccs1)CC(C)C ZINC000545216591 325194905 /nfs/dbraw/zinc/19/49/05/325194905.db2.gz MGCVAYRDHYTPHT-UHFFFAOYSA-N 1 1 225.401 3.659 20 0 BHADMO COCC[C@@H]1CCCC[N@@H+](CCC(C)(C)C)C1 ZINC000545229000 325196909 /nfs/dbraw/zinc/19/69/09/325196909.db2.gz ZKCDJUNBTHVCGV-AWEZNQCLSA-N 1 1 241.419 3.561 20 0 BHADMO COCC[C@H]1CCCC[N@@H+](CCC(C)(C)C)C1 ZINC000545229001 325196787 /nfs/dbraw/zinc/19/67/87/325196787.db2.gz ZKCDJUNBTHVCGV-CQSZACIVSA-N 1 1 241.419 3.561 20 0 BHADMO CC/C=C\CC[N@@H+](C1CC1)C1CCCC1 ZINC000545230536 324113013 /nfs/dbraw/zinc/11/30/13/324113013.db2.gz BHNXKAYMANMSJP-ARJAWSKDSA-N 1 1 207.361 3.750 20 0 BHADMO CC/C=C/CC[N@@H+](C1CC1)C1CCCC1 ZINC000545230537 324113137 /nfs/dbraw/zinc/11/31/37/324113137.db2.gz BHNXKAYMANMSJP-ONEGZZNKSA-N 1 1 207.361 3.750 20 0 BHADMO CC(C)Nc1ccc(C[N@H+]2CCC[C@H](C)C2)cc1 ZINC000545246927 325201198 /nfs/dbraw/zinc/20/11/98/325201198.db2.gz ITPRFRDDBGHUOE-AWEZNQCLSA-N 1 1 246.398 3.739 20 0 BHADMO CC(C)Nc1ccc(C[N@H+]2CCC[C@@H](C)C2)cc1 ZINC000545246928 325200856 /nfs/dbraw/zinc/20/08/56/325200856.db2.gz ITPRFRDDBGHUOE-CQSZACIVSA-N 1 1 246.398 3.739 20 0 BHADMO c1ccc([C@@H]2CCCC[N@@H+]2CC2CC2)cc1 ZINC000545278003 325204943 /nfs/dbraw/zinc/20/49/43/325204943.db2.gz JFYSBVJWAWHREB-HNNXBMFYSA-N 1 1 215.340 3.624 20 0 BHADMO c1ccc([C@H]2CCCC[N@@H+]2CC2CC2)cc1 ZINC000545278004 325205049 /nfs/dbraw/zinc/20/50/49/325205049.db2.gz JFYSBVJWAWHREB-OAHLLOKOSA-N 1 1 215.340 3.624 20 0 BHADMO C[N@@H+](CCCOCc1ccccc1)CC(C)(C)C ZINC000545278645 325205612 /nfs/dbraw/zinc/20/56/12/325205612.db2.gz VHXRBHAQMOIEAF-UHFFFAOYSA-N 1 1 249.398 3.571 20 0 BHADMO C[C@H](Cc1ccsc1)[N@@H+]([C@@H](C)C1CC1)C1CC1 ZINC000545293620 325208406 /nfs/dbraw/zinc/20/84/06/325208406.db2.gz XNEILSUJWOSFGC-NEPJUHHUSA-N 1 1 249.423 3.942 20 0 BHADMO C[C@H](C1CC1)[N@H+]([C@@H](C)Cc1ccsc1)C1CC1 ZINC000545293621 325208319 /nfs/dbraw/zinc/20/83/19/325208319.db2.gz XNEILSUJWOSFGC-NWDGAFQWSA-N 1 1 249.423 3.942 20 0 BHADMO C[C@@H](Cc1ccsc1)[N@@H+]([C@@H](C)C1CC1)C1CC1 ZINC000545293622 325208295 /nfs/dbraw/zinc/20/82/95/325208295.db2.gz XNEILSUJWOSFGC-RYUDHWBXSA-N 1 1 249.423 3.942 20 0 BHADMO C[C@H](Cc1ccsc1)[N@@H+]([C@H](C)C1CC1)C1CC1 ZINC000545293623 325208341 /nfs/dbraw/zinc/20/83/41/325208341.db2.gz XNEILSUJWOSFGC-VXGBXAGGSA-N 1 1 249.423 3.942 20 0 BHADMO CCc1ccc(C[N@H+]2CCCC3(CC3)C2)s1 ZINC000545322539 325213127 /nfs/dbraw/zinc/21/31/27/325213127.db2.gz DVWPINDZXLULMT-UHFFFAOYSA-N 1 1 235.396 3.687 20 0 BHADMO Cc1ccc2[nH]c(C[N@H+]3CCC3(C)C)cc2c1C ZINC000545328570 325213964 /nfs/dbraw/zinc/21/39/64/325213964.db2.gz FLYVJHKJUFARRW-UHFFFAOYSA-N 1 1 242.366 3.769 20 0 BHADMO CCCC[C@H](CC)C[N@@H+](C)Cc1cccnc1 ZINC000545517559 325226099 /nfs/dbraw/zinc/22/60/99/325226099.db2.gz MYPBKZOSLYOHLS-AWEZNQCLSA-N 1 1 234.387 3.730 20 0 BHADMO CCCC[C@@H](CC)C[N@@H+](C)Cc1cccnc1 ZINC000545517565 325225936 /nfs/dbraw/zinc/22/59/36/325225936.db2.gz MYPBKZOSLYOHLS-CQSZACIVSA-N 1 1 234.387 3.730 20 0 BHADMO CC[N@@H+](CCCc1ccsc1)CCC1CC1 ZINC000545519005 325226514 /nfs/dbraw/zinc/22/65/14/325226514.db2.gz MYYIOBJBJXYJRU-UHFFFAOYSA-N 1 1 237.412 3.803 20 0 BHADMO CC[N@@H+](CCCCC(F)(F)F)CCC1CC1 ZINC000545519629 325226591 /nfs/dbraw/zinc/22/65/91/325226591.db2.gz PSFNKJLDGFTZEQ-UHFFFAOYSA-N 1 1 237.309 3.841 20 0 BHADMO CCOc1ccc(C[N@@H+](CC)CCC2CC2)cc1 ZINC000545557284 325228047 /nfs/dbraw/zinc/22/80/47/325228047.db2.gz FVIXYKMAGIMPGB-UHFFFAOYSA-N 1 1 247.382 3.707 20 0 BHADMO CC[N@@H+](CCC1CC1)C[C@@H]1C[C@@H]1c1ccccc1 ZINC000545560460 325228788 /nfs/dbraw/zinc/22/87/88/325228788.db2.gz OQARYWQBXJZHDC-DLBZAZTESA-N 1 1 243.394 3.912 20 0 BHADMO CC[N@@H+](CCC1CC1)C[C@H]1C[C@@H]1c1ccccc1 ZINC000545560461 325228852 /nfs/dbraw/zinc/22/88/52/325228852.db2.gz OQARYWQBXJZHDC-IAGOWNOFSA-N 1 1 243.394 3.912 20 0 BHADMO CC[N@@H+](CCC1CC1)C[C@H]1C[C@H]1c1ccccc1 ZINC000545560462 325228816 /nfs/dbraw/zinc/22/88/16/325228816.db2.gz OQARYWQBXJZHDC-SJORKVTESA-N 1 1 243.394 3.912 20 0 BHADMO CCC(CC)[N@@H+](Cc1ccc(C)nc1)C1CC1 ZINC000545906968 325245753 /nfs/dbraw/zinc/24/57/53/325245753.db2.gz MLHIZGPXVXUJDZ-UHFFFAOYSA-N 1 1 232.371 3.543 20 0 BHADMO CCC[N@@H+](CCc1cccs1)C1CCCC1 ZINC000545923690 325247050 /nfs/dbraw/zinc/24/70/50/325247050.db2.gz SFASALNAKAEYHJ-UHFFFAOYSA-N 1 1 237.412 3.945 20 0 BHADMO CCC[C@@H](C)C[N@H+]1CCC[C@@H](C(F)(F)F)C1 ZINC000545986048 325254023 /nfs/dbraw/zinc/25/40/23/325254023.db2.gz XGODJTLBAXKGIE-GHMZBOCLSA-N 1 1 237.309 3.697 20 0 BHADMO CCC[C@@H](C)C[N@H+]1CCC[C@H](C(F)(F)F)C1 ZINC000545986049 325254082 /nfs/dbraw/zinc/25/40/82/325254082.db2.gz XGODJTLBAXKGIE-MNOVXSKESA-N 1 1 237.309 3.697 20 0 BHADMO CCC[C@H](C)C[N@H+]1CCC[C@H](C(F)(F)F)C1 ZINC000545986050 325254388 /nfs/dbraw/zinc/25/43/88/325254388.db2.gz XGODJTLBAXKGIE-QWRGUYRKSA-N 1 1 237.309 3.697 20 0 BHADMO CCC[C@H](C)C[N@H+]1CCC[C@@H](C(F)(F)F)C1 ZINC000545986051 325254372 /nfs/dbraw/zinc/25/43/72/325254372.db2.gz XGODJTLBAXKGIE-WDEREUQCSA-N 1 1 237.309 3.697 20 0 BHADMO C[C@H](C1CC1)[N@@H+](CCCc1ccsc1)C1CC1 ZINC000546000706 325256547 /nfs/dbraw/zinc/25/65/47/325256547.db2.gz HHCGCNHNCMQPMD-GFCCVEGCSA-N 1 1 249.423 3.944 20 0 BHADMO C[C@@H](C1CC1)[N@@H+](CCCc1ccsc1)C1CC1 ZINC000546000707 325256639 /nfs/dbraw/zinc/25/66/39/325256639.db2.gz HHCGCNHNCMQPMD-LBPRGKRZSA-N 1 1 249.423 3.944 20 0 BHADMO CCSc1cccc(C[N@H+]2CCC2(C)C)c1 ZINC000546035416 325262005 /nfs/dbraw/zinc/26/20/05/325262005.db2.gz WAIZGKAKTDUMNC-UHFFFAOYSA-N 1 1 235.396 3.783 20 0 BHADMO C[C@H](C[N@H+]1CC[C@@H](C)C(C)(C)C1)C(F)(F)F ZINC000546123695 325267851 /nfs/dbraw/zinc/26/78/51/325267851.db2.gz XHBHEMDRVNCDLY-NXEZZACHSA-N 1 1 237.309 3.553 20 0 BHADMO C[C@@H](C[N@H+]1CC[C@H](C)C(C)(C)C1)C(F)(F)F ZINC000546123696 325267822 /nfs/dbraw/zinc/26/78/22/325267822.db2.gz XHBHEMDRVNCDLY-UWVGGRQHSA-N 1 1 237.309 3.553 20 0 BHADMO C[C@H](C[N@H+]1CC[C@H](C)C(C)(C)C1)C(F)(F)F ZINC000546123697 325267533 /nfs/dbraw/zinc/26/75/33/325267533.db2.gz XHBHEMDRVNCDLY-VHSXEESVSA-N 1 1 237.309 3.553 20 0 BHADMO C[C@@H](C[N@H+]1CC[C@@H](C)C(C)(C)C1)C(F)(F)F ZINC000546123698 325267951 /nfs/dbraw/zinc/26/79/51/325267951.db2.gz XHBHEMDRVNCDLY-ZJUUUORDSA-N 1 1 237.309 3.553 20 0 BHADMO CCCC[C@@H](CC)C[N@H+]1CCC[C@H](COC)C1 ZINC000546223709 325272135 /nfs/dbraw/zinc/27/21/35/325272135.db2.gz IBYXAQUZBOLDQL-CABCVRRESA-N 1 1 241.419 3.561 20 0 BHADMO CCCC[C@H](CC)C[N@H+]1CCC[C@H](COC)C1 ZINC000546223710 325271910 /nfs/dbraw/zinc/27/19/10/325271910.db2.gz IBYXAQUZBOLDQL-GJZGRUSLSA-N 1 1 241.419 3.561 20 0 BHADMO CCCC[C@@H](CC)C[N@H+]1CCC[C@@H](COC)C1 ZINC000546223711 325272084 /nfs/dbraw/zinc/27/20/84/325272084.db2.gz IBYXAQUZBOLDQL-HUUCEWRRSA-N 1 1 241.419 3.561 20 0 BHADMO CCCC[C@H](CC)C[N@H+]1CCC[C@@H](COC)C1 ZINC000546223712 325271814 /nfs/dbraw/zinc/27/18/14/325271814.db2.gz IBYXAQUZBOLDQL-LSDHHAIUSA-N 1 1 241.419 3.561 20 0 BHADMO CC[N@@H+](CCC1CC1)Cc1cc(C)ccc1OC ZINC000546228468 325271950 /nfs/dbraw/zinc/27/19/50/325271950.db2.gz RESWYVZCVJGLGK-UHFFFAOYSA-N 1 1 247.382 3.626 20 0 BHADMO CC[N@@H+](CCC1CC1)Cc1ccc(F)c(F)c1 ZINC000546228548 325271784 /nfs/dbraw/zinc/27/17/84/325271784.db2.gz LRDHSGHKWPTMFN-UHFFFAOYSA-N 1 1 239.309 3.587 20 0 BHADMO CC[N@@H+](CCC1CC1)Cc1ccc(F)cc1F ZINC000546229954 325272346 /nfs/dbraw/zinc/27/23/46/325272346.db2.gz KCBHGDTZJZGLKT-UHFFFAOYSA-N 1 1 239.309 3.587 20 0 BHADMO CCC(CC)[N@@H+](CCCc1ccncc1)C1CC1 ZINC000546611881 325293871 /nfs/dbraw/zinc/29/38/71/325293871.db2.gz DYWWYXJKMLXOJW-UHFFFAOYSA-N 1 1 246.398 3.667 20 0 BHADMO CCC1(CC)C[N@H+](C2CCCC2)CCS1 ZINC000546630729 325296049 /nfs/dbraw/zinc/29/60/49/325296049.db2.gz XGKCFEPCROHVPA-UHFFFAOYSA-N 1 1 227.417 3.537 20 0 BHADMO CC/C=C\CC[N@H+]1CCC[C@H]1c1cccc(C)n1 ZINC000546643950 325297102 /nfs/dbraw/zinc/29/71/02/325297102.db2.gz OXVJEVDDLSCAKU-AWFCHZOYSA-N 1 1 244.382 3.883 20 0 BHADMO CC/C=C\CC[N@H+]1CCC[C@@H]1c1cccc(C)n1 ZINC000546643951 325297144 /nfs/dbraw/zinc/29/71/44/325297144.db2.gz OXVJEVDDLSCAKU-YIEVGGLXSA-N 1 1 244.382 3.883 20 0 BHADMO CC/C=C/CC[N@@H+](Cc1ccccn1)C(C)C ZINC000546644070 325297277 /nfs/dbraw/zinc/29/72/77/325297277.db2.gz LZEUKMTXSGJVDE-AATRIKPKSA-N 1 1 232.371 3.648 20 0 BHADMO CC/C=C\CC[N@@H+](Cc1ccccn1)C(C)C ZINC000546644071 325297137 /nfs/dbraw/zinc/29/71/37/325297137.db2.gz LZEUKMTXSGJVDE-WAYWQWQTSA-N 1 1 232.371 3.648 20 0 BHADMO Cc1cc(Cl)ccc1C[N@H+]1CCC1(C)C ZINC000546653503 325298770 /nfs/dbraw/zinc/29/87/70/325298770.db2.gz DBOJQICNUBOLJV-UHFFFAOYSA-N 1 1 223.747 3.633 20 0 BHADMO CCCC[C@H](CC)C[N@@H+](C)CCc1ccncc1 ZINC000546930195 325318791 /nfs/dbraw/zinc/31/87/91/325318791.db2.gz BDSGHWRBOFRKNV-HNNXBMFYSA-N 1 1 248.414 3.772 20 0 BHADMO CCCC[C@@H](CC)C[N@@H+](C)CCc1ccncc1 ZINC000546930197 325318706 /nfs/dbraw/zinc/31/87/06/325318706.db2.gz BDSGHWRBOFRKNV-OAHLLOKOSA-N 1 1 248.414 3.772 20 0 BHADMO CC[N@@H+](CCC1CC1)[C@H](C)c1ccccc1 ZINC000546931862 325319061 /nfs/dbraw/zinc/31/90/61/325319061.db2.gz XHGIHKPUBRQOBE-CYBMUJFWSA-N 1 1 217.356 3.870 20 0 BHADMO CC[N@@H+](CCC1CC1)[C@@H](C)c1ccccc1 ZINC000546931867 325318777 /nfs/dbraw/zinc/31/87/77/325318777.db2.gz XHGIHKPUBRQOBE-ZDUSSCGKSA-N 1 1 217.356 3.870 20 0 BHADMO CC[N@H+](C/C=C/c1ccccc1)CCC1CC1 ZINC000546932367 325318721 /nfs/dbraw/zinc/31/87/21/325318721.db2.gz ANNYRFULYOQDQR-RMKNXTFCSA-N 1 1 229.367 3.822 20 0 BHADMO CC[N@H+](C/C=C\c1ccccc1)CCC1CC1 ZINC000546932368 325318899 /nfs/dbraw/zinc/31/88/99/325318899.db2.gz ANNYRFULYOQDQR-TWGQIWQCSA-N 1 1 229.367 3.822 20 0 BHADMO CCCC[C@@H](CC)C[N@@H+](C)[C@@H]1CCSC1 ZINC000546934082 325319257 /nfs/dbraw/zinc/31/92/57/325319257.db2.gz MWPTXYCWORYRHJ-CHWSQXEVSA-N 1 1 229.433 3.640 20 0 BHADMO CCCC[C@@H](CC)C[N@@H+](C)[C@H]1CCSC1 ZINC000546934083 325317505 /nfs/dbraw/zinc/31/75/05/325317505.db2.gz MWPTXYCWORYRHJ-OLZOCXBDSA-N 1 1 229.433 3.640 20 0 BHADMO CCCC[C@H](CC)C[N@@H+](C)[C@@H]1CCSC1 ZINC000546934084 325317371 /nfs/dbraw/zinc/31/73/71/325317371.db2.gz MWPTXYCWORYRHJ-QWHCGFSZSA-N 1 1 229.433 3.640 20 0 BHADMO CCCC[C@H](CC)C[N@@H+](C)[C@H]1CCSC1 ZINC000546934085 325317579 /nfs/dbraw/zinc/31/75/79/325317579.db2.gz MWPTXYCWORYRHJ-STQMWFEESA-N 1 1 229.433 3.640 20 0 BHADMO CCCC[C@@H](CC)C[N@H+]1CC[C@H](COCC)C1 ZINC000546934570 325319359 /nfs/dbraw/zinc/31/93/59/325319359.db2.gz BHJZWMLPDRTUQA-CABCVRRESA-N 1 1 241.419 3.561 20 0 BHADMO CCCC[C@H](CC)C[N@H+]1CC[C@H](COCC)C1 ZINC000546934571 325319456 /nfs/dbraw/zinc/31/94/56/325319456.db2.gz BHJZWMLPDRTUQA-GJZGRUSLSA-N 1 1 241.419 3.561 20 0 BHADMO CCCC[C@@H](CC)C[N@H+]1CC[C@@H](COCC)C1 ZINC000546934572 325319300 /nfs/dbraw/zinc/31/93/00/325319300.db2.gz BHJZWMLPDRTUQA-HUUCEWRRSA-N 1 1 241.419 3.561 20 0 BHADMO CCCC[C@H](CC)C[N@H+]1CC[C@@H](COCC)C1 ZINC000546934573 325319407 /nfs/dbraw/zinc/31/94/07/325319407.db2.gz BHJZWMLPDRTUQA-LSDHHAIUSA-N 1 1 241.419 3.561 20 0 BHADMO CC[N@@H+](CCC1CC1)[C@H](C)Cc1ccsc1 ZINC000546970188 325320977 /nfs/dbraw/zinc/32/09/77/325320977.db2.gz JAJSAVONKGPIGB-GFCCVEGCSA-N 1 1 237.412 3.801 20 0 BHADMO CC[N@@H+](CCC1CC1)[C@@H](C)Cc1ccsc1 ZINC000546970199 325320491 /nfs/dbraw/zinc/32/04/91/325320491.db2.gz JAJSAVONKGPIGB-LBPRGKRZSA-N 1 1 237.412 3.801 20 0 BHADMO CCOc1cccc(C[N@@H+](CC)CCC2CC2)c1 ZINC000546972733 325321536 /nfs/dbraw/zinc/32/15/36/325321536.db2.gz BKRCTJGWFRRYMF-UHFFFAOYSA-N 1 1 247.382 3.707 20 0 BHADMO C[C@@H]1CC[N@@H+](Cc2cccs2)CC1(C)C ZINC000546973014 325321553 /nfs/dbraw/zinc/32/15/53/325321553.db2.gz RSXUPQJNMBSMGN-LLVKDONJSA-N 1 1 223.385 3.616 20 0 BHADMO C[C@H]1CC[N@@H+](Cc2cccs2)CC1(C)C ZINC000546973020 325321530 /nfs/dbraw/zinc/32/15/30/325321530.db2.gz RSXUPQJNMBSMGN-NSHDSACASA-N 1 1 223.385 3.616 20 0 BHADMO CCOc1ccccc1C[N@@H+](CC)CCC1CC1 ZINC000546973277 325321472 /nfs/dbraw/zinc/32/14/72/325321472.db2.gz KHCZNOBDMRAECC-UHFFFAOYSA-N 1 1 247.382 3.707 20 0 BHADMO FC1=CCC[N@@H+](CC2CCCCCC2)C1 ZINC000547291927 325335849 /nfs/dbraw/zinc/33/58/49/325335849.db2.gz YWLYNYIWSPVBHB-UHFFFAOYSA-N 1 1 211.324 3.516 20 0 BHADMO CC[N@H+](Cc1ccncc1)CC1CCCCCC1 ZINC000547293238 325335705 /nfs/dbraw/zinc/33/57/05/325335705.db2.gz SVRMUKPKWXYEKN-UHFFFAOYSA-N 1 1 246.398 3.874 20 0 BHADMO CCCC[N@@H+](CCC)CCc1cccs1 ZINC000547337515 325344222 /nfs/dbraw/zinc/34/42/22/325344222.db2.gz XPWRGIDZWZKWNB-UHFFFAOYSA-N 1 1 225.401 3.803 20 0 BHADMO CC/C=C\CC[N@H+]1CCC[C@@H]1c1ccccn1 ZINC000547351741 325346526 /nfs/dbraw/zinc/34/65/26/325346526.db2.gz XLXYXMYIVFITEK-ABCZVMIZSA-N 1 1 230.355 3.575 20 0 BHADMO CC/C=C/CC[N@H+]1CCC[C@H]1c1ccccn1 ZINC000547351742 325346546 /nfs/dbraw/zinc/34/65/46/325346546.db2.gz XLXYXMYIVFITEK-BWPKMQGJSA-N 1 1 230.355 3.575 20 0 BHADMO CC/C=C\CC[N@H+]1CCC[C@H]1c1ccccn1 ZINC000547351743 325346202 /nfs/dbraw/zinc/34/62/02/325346202.db2.gz XLXYXMYIVFITEK-JZIMQPMSSA-N 1 1 230.355 3.575 20 0 BHADMO CC/C=C/CC[N@H+]1CCC[C@@H]1c1ccccn1 ZINC000547351744 323194604 /nfs/dbraw/zinc/19/46/04/323194604.db2.gz XLXYXMYIVFITEK-NHZBNJEXSA-N 1 1 230.355 3.575 20 0 BHADMO CC(C)C[N@H+]1CCCC[C@H]1c1ccccc1 ZINC000547398467 325350799 /nfs/dbraw/zinc/35/07/99/325350799.db2.gz FCDLIFYYGFEGRW-HNNXBMFYSA-N 1 1 217.356 3.870 20 0 BHADMO CC(C)C[N@H+]1CCCC[C@@H]1c1ccccc1 ZINC000547398468 325350705 /nfs/dbraw/zinc/35/07/05/325350705.db2.gz FCDLIFYYGFEGRW-OAHLLOKOSA-N 1 1 217.356 3.870 20 0 BHADMO CCC[C@@H](C)C[N@@H+]([C@@H](C)C1CC1)C1CC1 ZINC000547412846 325351914 /nfs/dbraw/zinc/35/19/14/325351914.db2.gz BZSFYJXICVTGIK-NEPJUHHUSA-N 1 1 209.377 3.686 20 0 BHADMO CCC[C@H](C)C[N@@H+]([C@H](C)C1CC1)C1CC1 ZINC000547412852 325352001 /nfs/dbraw/zinc/35/20/01/325352001.db2.gz BZSFYJXICVTGIK-NWDGAFQWSA-N 1 1 209.377 3.686 20 0 BHADMO CCC[C@H](C)C[N@@H+]([C@@H](C)C1CC1)C1CC1 ZINC000547412853 325351812 /nfs/dbraw/zinc/35/18/12/325351812.db2.gz BZSFYJXICVTGIK-RYUDHWBXSA-N 1 1 209.377 3.686 20 0 BHADMO CCC[C@@H](C)C[N@@H+]([C@H](C)C1CC1)C1CC1 ZINC000547412855 325351872 /nfs/dbraw/zinc/35/18/72/325351872.db2.gz BZSFYJXICVTGIK-VXGBXAGGSA-N 1 1 209.377 3.686 20 0 BHADMO C[C@H](Cc1ccsc1)[N@H+]1CCCC2(CC2)C1 ZINC000547443238 325355764 /nfs/dbraw/zinc/35/57/64/325355764.db2.gz IIWIISOAXUHWSU-GFCCVEGCSA-N 1 1 235.396 3.555 20 0 BHADMO C[C@@H](Cc1ccsc1)[N@H+]1CCCC2(CC2)C1 ZINC000547443239 325355554 /nfs/dbraw/zinc/35/55/54/325355554.db2.gz IIWIISOAXUHWSU-LBPRGKRZSA-N 1 1 235.396 3.555 20 0 BHADMO C[C@@H]([N@@H+](C)Cc1ncc(Cl)s1)C(C)(C)C ZINC000547448941 325356042 /nfs/dbraw/zinc/35/60/42/325356042.db2.gz KTFQFIMWEWMAGQ-MRVPVSSYSA-N 1 1 246.807 3.663 20 0 BHADMO C[C@@H]([N@H+](C)Cc1ncc(Cl)s1)C(C)(C)C ZINC000547448941 325356039 /nfs/dbraw/zinc/35/60/39/325356039.db2.gz KTFQFIMWEWMAGQ-MRVPVSSYSA-N 1 1 246.807 3.663 20 0 BHADMO C[C@H]([N@@H+](C)Cc1ncc(Cl)s1)C(C)(C)C ZINC000547448942 325356280 /nfs/dbraw/zinc/35/62/80/325356280.db2.gz KTFQFIMWEWMAGQ-QMMMGPOBSA-N 1 1 246.807 3.663 20 0 BHADMO C[C@H]([N@H+](C)Cc1ncc(Cl)s1)C(C)(C)C ZINC000547448942 325356277 /nfs/dbraw/zinc/35/62/77/325356277.db2.gz KTFQFIMWEWMAGQ-QMMMGPOBSA-N 1 1 246.807 3.663 20 0 BHADMO CC1(C)CC[N@@H+](Cc2ccc(Cl)s2)C1 ZINC000547464563 325358784 /nfs/dbraw/zinc/35/87/84/325358784.db2.gz HFVQTSJMLWTWRY-UHFFFAOYSA-N 1 1 229.776 3.633 20 0 BHADMO Cc1cc(F)ccc1C[N@H+]([C@H](C)C1CC1)C1CC1 ZINC000547508333 325366473 /nfs/dbraw/zinc/36/64/73/325366473.db2.gz QKHNHCXPOWEYGM-GFCCVEGCSA-N 1 1 247.357 3.897 20 0 BHADMO Cc1cc(F)ccc1C[N@H+]([C@@H](C)C1CC1)C1CC1 ZINC000547508334 325366340 /nfs/dbraw/zinc/36/63/40/325366340.db2.gz QKHNHCXPOWEYGM-LBPRGKRZSA-N 1 1 247.357 3.897 20 0 BHADMO C[C@H]1[C@H](C(F)(F)F)CCC[N@H+]1C1CCCC1 ZINC000547518677 325368286 /nfs/dbraw/zinc/36/82/86/325368286.db2.gz YQMWVNIFOWVAOL-GXSJLCMTSA-N 1 1 235.293 3.592 20 0 BHADMO C[C@@H]1[C@@H](C(F)(F)F)CCC[N@H+]1C1CCCC1 ZINC000547518678 325368284 /nfs/dbraw/zinc/36/82/84/325368284.db2.gz YQMWVNIFOWVAOL-KOLCDFICSA-N 1 1 235.293 3.592 20 0 BHADMO C[C@@H]1[C@H](C(F)(F)F)CCC[N@H+]1C1CCCC1 ZINC000547518679 325368302 /nfs/dbraw/zinc/36/83/02/325368302.db2.gz YQMWVNIFOWVAOL-MWLCHTKSSA-N 1 1 235.293 3.592 20 0 BHADMO C[C@H]1[C@@H](C(F)(F)F)CCC[N@H+]1C1CCCC1 ZINC000547518680 325368255 /nfs/dbraw/zinc/36/82/55/325368255.db2.gz YQMWVNIFOWVAOL-ONGXEEELSA-N 1 1 235.293 3.592 20 0 BHADMO CC[C@@H]1[C@H](C)CC[N@H+]1[C@@H](C)Cc1ccsc1 ZINC000547525118 325369301 /nfs/dbraw/zinc/36/93/01/325369301.db2.gz BLIXLKPSUAIYMT-MBNYWOFBSA-N 1 1 237.412 3.800 20 0 BHADMO CC[C@@H]1[C@@H](C)CC[N@H+]1[C@H](C)Cc1ccsc1 ZINC000547525119 325369453 /nfs/dbraw/zinc/36/94/53/325369453.db2.gz BLIXLKPSUAIYMT-OUCADQQQSA-N 1 1 237.412 3.800 20 0 BHADMO CC[C@@H]1[C@@H](C)CC[N@H+]1[C@@H](C)Cc1ccsc1 ZINC000547525120 325369399 /nfs/dbraw/zinc/36/93/99/325369399.db2.gz BLIXLKPSUAIYMT-SGMGOOAPSA-N 1 1 237.412 3.800 20 0 BHADMO CC[C@@H]1[C@H](C)CC[N@H+]1[C@H](C)Cc1ccsc1 ZINC000547525121 325369595 /nfs/dbraw/zinc/36/95/95/325369595.db2.gz BLIXLKPSUAIYMT-YRGRVCCFSA-N 1 1 237.412 3.800 20 0 BHADMO C[C@@H]1CCCCC[N@H+]1Cc1ccc(F)cc1 ZINC000547607154 323254614 /nfs/dbraw/zinc/25/46/14/323254614.db2.gz APISQZNMYUYPNU-GFCCVEGCSA-N 1 1 221.319 3.590 20 0 BHADMO C[C@H]1CCCCC[N@H+]1Cc1ccc(F)cc1 ZINC000547607155 323254799 /nfs/dbraw/zinc/25/47/99/323254799.db2.gz APISQZNMYUYPNU-LBPRGKRZSA-N 1 1 221.319 3.590 20 0 BHADMO C[C@@H]1CCCCC[N@H+]1Cc1ccc(F)c(F)c1 ZINC000547607466 325374984 /nfs/dbraw/zinc/37/49/84/325374984.db2.gz YXWFDRJFADSGQJ-LLVKDONJSA-N 1 1 239.309 3.729 20 0 BHADMO C[C@H]1CCCCC[N@H+]1Cc1ccc(F)c(F)c1 ZINC000547607468 325375095 /nfs/dbraw/zinc/37/50/95/325375095.db2.gz YXWFDRJFADSGQJ-NSHDSACASA-N 1 1 239.309 3.729 20 0 BHADMO C[C@@H]1CCCCC[N@H+]1Cc1cccc2[nH]ccc21 ZINC000547607495 325374964 /nfs/dbraw/zinc/37/49/64/325374964.db2.gz ZINQSSNOXKABLI-CYBMUJFWSA-N 1 1 242.366 3.932 20 0 BHADMO C[C@H]1CCCCC[N@H+]1Cc1cccc2[nH]ccc21 ZINC000547607496 325375054 /nfs/dbraw/zinc/37/50/54/325375054.db2.gz ZINQSSNOXKABLI-ZDUSSCGKSA-N 1 1 242.366 3.932 20 0 BHADMO C[C@H]1CCCCC[N@H+]1C[C@H]1CC=CCC1 ZINC000547607598 325375119 /nfs/dbraw/zinc/37/51/19/325375119.db2.gz WJPUASLGMZYHNX-KBPBESRZSA-N 1 1 207.361 3.607 20 0 BHADMO C[C@@H]1CCCCC[N@H+]1C[C@H]1CC=CCC1 ZINC000547607599 325375110 /nfs/dbraw/zinc/37/51/10/325375110.db2.gz WJPUASLGMZYHNX-KGLIPLIRSA-N 1 1 207.361 3.607 20 0 BHADMO C[C@H]1CCCCC[N@H+]1C[C@@H]1CC=CCC1 ZINC000547607600 325373161 /nfs/dbraw/zinc/37/31/61/325373161.db2.gz WJPUASLGMZYHNX-UONOGXRCSA-N 1 1 207.361 3.607 20 0 BHADMO C[C@@H]1CCCCC[N@H+]1C[C@@H]1CC=CCC1 ZINC000547607601 325373413 /nfs/dbraw/zinc/37/34/13/325373413.db2.gz WJPUASLGMZYHNX-ZIAGYGMSSA-N 1 1 207.361 3.607 20 0 BHADMO Cc1ccc(C[N@@H+]2CCCCC[C@H]2C)s1 ZINC000547607610 325375070 /nfs/dbraw/zinc/37/50/70/325375070.db2.gz YHECWCFTAMEXGD-LLVKDONJSA-N 1 1 223.385 3.821 20 0 BHADMO Cc1ccc(C[N@@H+]2CCCCC[C@@H]2C)s1 ZINC000547607611 325374900 /nfs/dbraw/zinc/37/49/00/325374900.db2.gz YHECWCFTAMEXGD-NSHDSACASA-N 1 1 223.385 3.821 20 0 BHADMO CCC(CC)[N@@H+](Cc1ncccc1C)C1CC1 ZINC000547644880 325378355 /nfs/dbraw/zinc/37/83/55/325378355.db2.gz JOMNLEKYIFDTMS-UHFFFAOYSA-N 1 1 232.371 3.543 20 0 BHADMO CC[C@@H]1CCCC[C@H]1[N@@H+](C)Cc1ncccc1C ZINC000547746531 325391369 /nfs/dbraw/zinc/39/13/69/325391369.db2.gz FMDIAXVSWWPZGM-GDBMZVCRSA-N 1 1 246.398 3.791 20 0 BHADMO CC[C@H]1CCCC[C@H]1[N@@H+](C)Cc1ncccc1C ZINC000547746532 325391268 /nfs/dbraw/zinc/39/12/68/325391268.db2.gz FMDIAXVSWWPZGM-GOEBONIOSA-N 1 1 246.398 3.791 20 0 BHADMO CC[C@H]1CCCC[C@@H]1[N@@H+](C)Cc1ncccc1C ZINC000547746533 325391204 /nfs/dbraw/zinc/39/12/04/325391204.db2.gz FMDIAXVSWWPZGM-HOCLYGCPSA-N 1 1 246.398 3.791 20 0 BHADMO CC[C@@H]1CCCC[C@@H]1[N@@H+](C)Cc1ncccc1C ZINC000547746534 325391114 /nfs/dbraw/zinc/39/11/14/325391114.db2.gz FMDIAXVSWWPZGM-ZBFHGGJFSA-N 1 1 246.398 3.791 20 0 BHADMO CC[C@@H]1CCCC[C@H]1[N@@H+](C)Cc1cnccc1C ZINC000547747745 325391186 /nfs/dbraw/zinc/39/11/86/325391186.db2.gz ZZYPFAIMFGBKBH-GDBMZVCRSA-N 1 1 246.398 3.791 20 0 BHADMO CC[C@H]1CCCC[C@H]1[N@@H+](C)Cc1cnccc1C ZINC000547747746 325391072 /nfs/dbraw/zinc/39/10/72/325391072.db2.gz ZZYPFAIMFGBKBH-GOEBONIOSA-N 1 1 246.398 3.791 20 0 BHADMO CC[C@H]1CCCC[C@@H]1[N@@H+](C)Cc1cnccc1C ZINC000547747747 325391141 /nfs/dbraw/zinc/39/11/41/325391141.db2.gz ZZYPFAIMFGBKBH-HOCLYGCPSA-N 1 1 246.398 3.791 20 0 BHADMO CC[C@@H]1CCCC[C@@H]1[N@@H+](C)Cc1cnccc1C ZINC000547747748 325391240 /nfs/dbraw/zinc/39/12/40/325391240.db2.gz ZZYPFAIMFGBKBH-ZBFHGGJFSA-N 1 1 246.398 3.791 20 0 BHADMO C[C@@H]1C[C@H](C)[N@@H+]1Cc1cccc2ccccc21 ZINC000547768607 325394233 /nfs/dbraw/zinc/39/42/33/325394233.db2.gz FEWBJWOHHMPMII-BETUJISGSA-N 1 1 225.335 3.823 20 0 BHADMO CC[C@H](c1ccc(F)cc1)[N@@H+]1[C@H](C)C[C@@H]1C ZINC000547768879 323344966 /nfs/dbraw/zinc/34/49/66/323344966.db2.gz PBDJZGBIQHQTCH-UHIISALHSA-N 1 1 221.319 3.760 20 0 BHADMO CC[C@@H](c1ccc(F)cc1)[N@@H+]1[C@H](C)C[C@@H]1C ZINC000547768880 323345018 /nfs/dbraw/zinc/34/50/18/323345018.db2.gz PBDJZGBIQHQTCH-WDMOLILDSA-N 1 1 221.319 3.760 20 0 BHADMO C[C@@H]1C[C@H](C)[N@@H+]1CCCSCc1ccccc1 ZINC000547769132 325394614 /nfs/dbraw/zinc/39/46/14/325394614.db2.gz WXJSFDPRMGTVNT-OKILXGFUSA-N 1 1 249.423 3.793 20 0 BHADMO Cc1cc(C)cc(OCCC[N@@H+]2[C@H](C)C[C@@H]2C)c1 ZINC000547769291 325394960 /nfs/dbraw/zinc/39/49/60/325394960.db2.gz ALKYXDCHHIFFIF-GASCZTMLSA-N 1 1 247.382 3.555 20 0 BHADMO C[C@@H]1C[C@H](C)[N@@H+]1[C@@H]1CCc2c1cccc2Cl ZINC000547769411 325395024 /nfs/dbraw/zinc/39/50/24/325395024.db2.gz QETKXYRTGVWWGQ-ISTVAULSSA-N 1 1 235.758 3.810 20 0 BHADMO C[C@@H]1C[C@H](C)[N@@H+]1[C@H]1CCc2c1cccc2Cl ZINC000547769412 325395037 /nfs/dbraw/zinc/39/50/37/325395037.db2.gz QETKXYRTGVWWGQ-RBZYPMLTSA-N 1 1 235.758 3.810 20 0 BHADMO C[C@@H]1C[C@H](C)[N@@H+]1Cc1ccccc1C(F)(F)F ZINC000547769450 325394931 /nfs/dbraw/zinc/39/49/31/325394931.db2.gz WJRVYWVWVVSSAH-AOOOYVTPSA-N 1 1 243.272 3.688 20 0 BHADMO C[C@@H]1C[C@H](C)[N@@H+]1CCc1ccc2ccccc2c1 ZINC000547769517 325394892 /nfs/dbraw/zinc/39/48/92/325394892.db2.gz GGKWACQLOYVKGW-OKILXGFUSA-N 1 1 239.362 3.865 20 0 BHADMO C[C@@H](c1ccc(F)cc1F)[N@@H+]1[C@H](C)C[C@@H]1C ZINC000547769900 325394983 /nfs/dbraw/zinc/39/49/83/325394983.db2.gz ZVCKIGKLYFXZCH-AEJSXWLSSA-N 1 1 225.282 3.509 20 0 BHADMO C[C@H](c1ccc(F)cc1F)[N@@H+]1[C@H](C)C[C@@H]1C ZINC000547769902 325394739 /nfs/dbraw/zinc/39/47/39/325394739.db2.gz ZVCKIGKLYFXZCH-KXUCPTDWSA-N 1 1 225.282 3.509 20 0 BHADMO C[C@@H]1C[C@H](C)[N@@H+]1CCc1c(F)cccc1Cl ZINC000547769958 325395120 /nfs/dbraw/zinc/39/51/20/325395120.db2.gz IQKPZEAFWYTLRU-AOOOYVTPSA-N 1 1 241.737 3.504 20 0 BHADMO C[C@@H]1C[C@H](C)[N@@H+]1[C@@H]1CCCc2ccccc21 ZINC000547770027 325395548 /nfs/dbraw/zinc/39/55/48/325395548.db2.gz VNFLSDMFXUSFOF-TYNCELHUSA-N 1 1 215.340 3.547 20 0 BHADMO C[C@@H]1C[C@H](C)[N@@H+]1[C@H]1CCCc2ccccc21 ZINC000547770028 325395441 /nfs/dbraw/zinc/39/54/41/325395441.db2.gz VNFLSDMFXUSFOF-ZOWXZIJZSA-N 1 1 215.340 3.547 20 0 BHADMO C[C@@H]1C[C@H](C)[N@@H+]1Cc1ccc(C(F)F)cc1 ZINC000547770066 325395563 /nfs/dbraw/zinc/39/55/63/325395563.db2.gz BCNYTSJOSSDJAZ-AOOOYVTPSA-N 1 1 225.282 3.607 20 0 BHADMO CCC(C)(C)[N@@H+](C)Cc1cc(C)ccc1OC ZINC000547771421 325395746 /nfs/dbraw/zinc/39/57/46/325395746.db2.gz ZRRPAMUFGUELBL-UHFFFAOYSA-N 1 1 235.371 3.624 20 0 BHADMO CCC(C)(C)[N@@H+](C)Cc1ccccc1C ZINC000547771503 325395536 /nfs/dbraw/zinc/39/55/36/325395536.db2.gz XFBIHMCALWKVNP-UHFFFAOYSA-N 1 1 205.345 3.615 20 0 BHADMO CCC(C)(C)[N@@H+](C)Cc1cccc(C)c1 ZINC000547771642 325396264 /nfs/dbraw/zinc/39/62/64/325396264.db2.gz OGUGMEHQDBGDMN-UHFFFAOYSA-N 1 1 205.345 3.615 20 0 BHADMO CCC(C)(C)[N@@H+](C)Cc1cccc(F)c1F ZINC000547771960 325395961 /nfs/dbraw/zinc/39/59/61/325395961.db2.gz HXVMQLQZKPTCEI-UHFFFAOYSA-N 1 1 227.298 3.585 20 0 BHADMO Cc1cccc(N[C@H]2CCc3ccc(F)cc32)[nH+]1 ZINC000547786069 325397987 /nfs/dbraw/zinc/39/79/87/325397987.db2.gz MCQJUWCCXGLABD-AWEZNQCLSA-N 1 1 242.297 3.629 20 0 BHADMO Cc1cccc(N[C@@H]2CCc3ccc(F)cc32)[nH+]1 ZINC000547786070 325397949 /nfs/dbraw/zinc/39/79/49/325397949.db2.gz MCQJUWCCXGLABD-CQSZACIVSA-N 1 1 242.297 3.629 20 0 BHADMO Cc1cc(F)ccc1C[N@H+]1CCCC1(C)C ZINC000547829450 323374962 /nfs/dbraw/zinc/37/49/62/323374962.db2.gz AUCVVGKMJBIDPQ-UHFFFAOYSA-N 1 1 221.319 3.509 20 0 BHADMO CC[C@H](C)[N@@H+](C)CCCCc1ccccc1 ZINC000547831429 388489943 /nfs/dbraw/zinc/48/99/43/388489943.db2.gz MLSJVHYLUYEZPW-AWEZNQCLSA-N 1 1 219.372 3.740 20 0 BHADMO CC[C@@H](C)[N@@H+](C)CCCCc1ccccc1 ZINC000547831430 388490896 /nfs/dbraw/zinc/49/08/96/388490896.db2.gz MLSJVHYLUYEZPW-CQSZACIVSA-N 1 1 219.372 3.740 20 0 BHADMO CCC(CC)[N@@H+](Cc1ccc(C)nc1C)C1CC1 ZINC000547831581 388489965 /nfs/dbraw/zinc/48/99/65/388489965.db2.gz SJHZRNGJROSNAP-UHFFFAOYSA-N 1 1 246.398 3.851 20 0 BHADMO C[C@H](Cc1ccsc1)[N@H+]1CCCC[C@@H](C)C1 ZINC000547854228 388492725 /nfs/dbraw/zinc/49/27/25/388492725.db2.gz WPJCUJICDMZKJA-CHWSQXEVSA-N 1 1 237.412 3.801 20 0 BHADMO C[C@@H](Cc1ccsc1)[N@H+]1CCCC[C@@H](C)C1 ZINC000547854229 388492744 /nfs/dbraw/zinc/49/27/44/388492744.db2.gz WPJCUJICDMZKJA-OLZOCXBDSA-N 1 1 237.412 3.801 20 0 BHADMO C[C@H](Cc1ccsc1)[N@H+]1CCCC[C@H](C)C1 ZINC000547854230 388492497 /nfs/dbraw/zinc/49/24/97/388492497.db2.gz WPJCUJICDMZKJA-QWHCGFSZSA-N 1 1 237.412 3.801 20 0 BHADMO C[C@@H](Cc1ccsc1)[N@H+]1CCCC[C@H](C)C1 ZINC000547854231 388492888 /nfs/dbraw/zinc/49/28/88/388492888.db2.gz WPJCUJICDMZKJA-STQMWFEESA-N 1 1 237.412 3.801 20 0 BHADMO CCc1ccc(C[N@H+]2CCCCC[C@H]2C)o1 ZINC000547928338 388495433 /nfs/dbraw/zinc/49/54/33/388495433.db2.gz TXNDPPAWBCCCAT-GFCCVEGCSA-N 1 1 221.344 3.607 20 0 BHADMO CCc1ccc(C[N@H+]2CCCCC[C@@H]2C)o1 ZINC000547928339 388495127 /nfs/dbraw/zinc/49/51/27/388495127.db2.gz TXNDPPAWBCCCAT-LBPRGKRZSA-N 1 1 221.344 3.607 20 0 BHADMO C[C@@H]1CCCCC[N@H+]1Cc1ccccc1F ZINC000547928389 388495802 /nfs/dbraw/zinc/49/58/02/388495802.db2.gz DCOOZVPONZLYKH-GFCCVEGCSA-N 1 1 221.319 3.590 20 0 BHADMO C[C@H]1CCCCC[N@H+]1Cc1ccccc1F ZINC000547928390 388495362 /nfs/dbraw/zinc/49/53/62/388495362.db2.gz DCOOZVPONZLYKH-LBPRGKRZSA-N 1 1 221.319 3.590 20 0 BHADMO C[C@@H]1CCCCC[N@H+]1Cc1cccc(F)c1 ZINC000547931108 388495370 /nfs/dbraw/zinc/49/53/70/388495370.db2.gz UUSVRPMTZIBPMC-GFCCVEGCSA-N 1 1 221.319 3.590 20 0 BHADMO C[C@H]1CCCCC[N@H+]1Cc1cccc(F)c1 ZINC000547931109 388495383 /nfs/dbraw/zinc/49/53/83/388495383.db2.gz UUSVRPMTZIBPMC-LBPRGKRZSA-N 1 1 221.319 3.590 20 0 BHADMO Cc1ccsc1C[N@@H+]1CCCCC[C@H]1C ZINC000547931333 388496173 /nfs/dbraw/zinc/49/61/73/388496173.db2.gz JBIVZYMIIDUQGI-GFCCVEGCSA-N 1 1 223.385 3.821 20 0 BHADMO Cc1ccsc1C[N@@H+]1CCCCC[C@@H]1C ZINC000547931334 388496177 /nfs/dbraw/zinc/49/61/77/388496177.db2.gz JBIVZYMIIDUQGI-LBPRGKRZSA-N 1 1 223.385 3.821 20 0 BHADMO CCCC[N@@H+](CC)[C@H](C)Cc1ccsc1 ZINC000547972351 487715280 /nfs/dbraw/zinc/71/52/80/487715280.db2.gz MJCZYLDVHPIIEO-GFCCVEGCSA-N 1 1 225.401 3.801 20 0 BHADMO CCCC[N@@H+](CC)[C@@H](C)Cc1ccsc1 ZINC000547972352 487714986 /nfs/dbraw/zinc/71/49/86/487714986.db2.gz MJCZYLDVHPIIEO-LBPRGKRZSA-N 1 1 225.401 3.801 20 0 BHADMO CC[N@@H+](CC=C(C)C)[C@H](C)Cc1ccsc1 ZINC000547974086 398135096 /nfs/dbraw/zinc/13/50/96/398135096.db2.gz UTWMIZMFAJFMPY-CYBMUJFWSA-N 1 1 237.412 3.967 20 0 BHADMO CC[N@@H+](CC=C(C)C)[C@@H](C)Cc1ccsc1 ZINC000547974087 398135605 /nfs/dbraw/zinc/13/56/05/398135605.db2.gz UTWMIZMFAJFMPY-ZDUSSCGKSA-N 1 1 237.412 3.967 20 0 BHADMO C[C@@H]1C[N@@H+](Cc2c(F)cccc2F)C(C)(C)C1 ZINC000548066370 388508433 /nfs/dbraw/zinc/50/84/33/388508433.db2.gz CBTZEPOPIBGQAM-JTQLQIEISA-N 1 1 239.309 3.585 20 0 BHADMO C[C@H]1C[N@@H+](Cc2c(F)cccc2F)C(C)(C)C1 ZINC000548066371 388508677 /nfs/dbraw/zinc/50/86/77/388508677.db2.gz CBTZEPOPIBGQAM-SNVBAGLBSA-N 1 1 239.309 3.585 20 0 BHADMO C[C@@H](c1ncc(C(C)(C)C)o1)[N@@H+]1[C@H](C)C[C@@H]1C ZINC000548096139 388510858 /nfs/dbraw/zinc/51/08/58/388510858.db2.gz JWMGTTWEUTWZRG-AXFHLTTASA-N 1 1 236.359 3.516 20 0 BHADMO C[C@@H](c1ncc(C(C)(C)C)o1)[N@H+]1[C@H](C)C[C@@H]1C ZINC000548096139 388510856 /nfs/dbraw/zinc/51/08/56/388510856.db2.gz JWMGTTWEUTWZRG-AXFHLTTASA-N 1 1 236.359 3.516 20 0 BHADMO C[C@H](c1ncc(C(C)(C)C)o1)[NH+]1[C@H](C)C[C@H]1C ZINC000548096140 325428015 /nfs/dbraw/zinc/42/80/15/325428015.db2.gz JWMGTTWEUTWZRG-GMTAPVOTSA-N 1 1 236.359 3.516 20 0 BHADMO C[C@@H](c1ncc(C(C)(C)C)o1)[NH+]1[C@H](C)C[C@H]1C ZINC000548096141 388509869 /nfs/dbraw/zinc/50/98/69/388509869.db2.gz JWMGTTWEUTWZRG-MXWKQRLJSA-N 1 1 236.359 3.516 20 0 BHADMO C[C@H](c1ncc(C(C)(C)C)o1)[N@@H+]1[C@H](C)C[C@@H]1C ZINC000548096142 388509331 /nfs/dbraw/zinc/50/93/31/388509331.db2.gz JWMGTTWEUTWZRG-OUAUKWLOSA-N 1 1 236.359 3.516 20 0 BHADMO C[C@H](c1ncc(C(C)(C)C)o1)[N@H+]1[C@H](C)C[C@@H]1C ZINC000548096142 388509329 /nfs/dbraw/zinc/50/93/29/388509329.db2.gz JWMGTTWEUTWZRG-OUAUKWLOSA-N 1 1 236.359 3.516 20 0 BHADMO C[C@@H](c1c(F)cccc1F)[N@@H+]1[C@H](C)C[C@@H]1C ZINC000548096267 388511321 /nfs/dbraw/zinc/51/13/21/388511321.db2.gz LSGBXOWJEDSWEE-AEJSXWLSSA-N 1 1 225.282 3.509 20 0 BHADMO C[C@@H](c1c(F)cccc1F)[N@H+]1[C@H](C)C[C@@H]1C ZINC000548096267 388511318 /nfs/dbraw/zinc/51/13/18/388511318.db2.gz LSGBXOWJEDSWEE-AEJSXWLSSA-N 1 1 225.282 3.509 20 0 BHADMO C[C@@H](c1c(F)cccc1F)[NH+]1[C@H](C)C[C@H]1C ZINC000548096273 325428574 /nfs/dbraw/zinc/42/85/74/325428574.db2.gz LSGBXOWJEDSWEE-BBBLOLIVSA-N 1 1 225.282 3.509 20 0 BHADMO C[C@H](c1c(F)cccc1F)[N@@H+]1[C@H](C)C[C@@H]1C ZINC000548096274 388510703 /nfs/dbraw/zinc/51/07/03/388510703.db2.gz LSGBXOWJEDSWEE-KXUCPTDWSA-N 1 1 225.282 3.509 20 0 BHADMO C[C@H](c1c(F)cccc1F)[N@H+]1[C@H](C)C[C@@H]1C ZINC000548096274 388510701 /nfs/dbraw/zinc/51/07/01/388510701.db2.gz LSGBXOWJEDSWEE-KXUCPTDWSA-N 1 1 225.282 3.509 20 0 BHADMO C[C@H](c1c(F)cccc1F)[NH+]1[C@H](C)C[C@H]1C ZINC000548096275 388511155 /nfs/dbraw/zinc/51/11/55/388511155.db2.gz LSGBXOWJEDSWEE-OPRDCNLKSA-N 1 1 225.282 3.509 20 0 BHADMO C[C@@H]1C[C@H](C)[N@@H+]1CCCc1ccc(Cl)cc1 ZINC000548096375 388509643 /nfs/dbraw/zinc/50/96/43/388509643.db2.gz NQTUVHWUKUAESC-TXEJJXNPSA-N 1 1 237.774 3.755 20 0 BHADMO C[C@@H](c1cccc(Cl)c1)[N@@H+]1[C@H](C)C[C@@H]1C ZINC000548096591 388511355 /nfs/dbraw/zinc/51/13/55/388511355.db2.gz KUUWZRQGBNAZJR-AXFHLTTASA-N 1 1 223.747 3.884 20 0 BHADMO C[C@H](c1cccc(Cl)c1)[N@@H+]1[C@H](C)C[C@@H]1C ZINC000548096594 388509366 /nfs/dbraw/zinc/50/93/66/388509366.db2.gz KUUWZRQGBNAZJR-OUAUKWLOSA-N 1 1 223.747 3.884 20 0 BHADMO C[C@@H]1C[C@H](C)[N@@H+]1Cc1ccc2ccccc2c1 ZINC000548097292 388511163 /nfs/dbraw/zinc/51/11/63/388511163.db2.gz WEJQSCQBIJHVOT-BETUJISGSA-N 1 1 225.335 3.823 20 0 BHADMO C[C@@H](c1ccc(Cl)cc1)[N@@H+]1[C@H](C)C[C@@H]1C ZINC000548097419 388510727 /nfs/dbraw/zinc/51/07/27/388510727.db2.gz APWXFBUBDVHRMJ-AXFHLTTASA-N 1 1 223.747 3.884 20 0 BHADMO C[C@H](c1ccc(Cl)cc1)[N@@H+]1[C@H](C)C[C@@H]1C ZINC000548097422 388511376 /nfs/dbraw/zinc/51/13/76/388511376.db2.gz APWXFBUBDVHRMJ-OUAUKWLOSA-N 1 1 223.747 3.884 20 0 BHADMO C[C@@H]1C[C@H](C)[N@@H+]1Cc1cccc(C(F)(F)F)c1 ZINC000548097763 388511978 /nfs/dbraw/zinc/51/19/78/388511978.db2.gz UOWGDJZSAFZEMJ-AOOOYVTPSA-N 1 1 243.272 3.688 20 0 BHADMO Cc1ccc(OCCC[N@@H+]2[C@H](C)C[C@@H]2C)cc1C ZINC000548097806 388512033 /nfs/dbraw/zinc/51/20/33/388512033.db2.gz AUYRDHPNDZGUIB-GASCZTMLSA-N 1 1 247.382 3.555 20 0 BHADMO Cc1ccc(C[N@@H+]2[C@H](C)C[C@@H]2C)c(Cl)c1 ZINC000548097888 388512378 /nfs/dbraw/zinc/51/23/78/388512378.db2.gz MEGMJPIRMYPXOY-PHIMTYICSA-N 1 1 223.747 3.631 20 0 BHADMO C[C@@H]1C[C@H](C)[N@@H+]1Cc1ccc(Cl)c(Cl)c1 ZINC000548097935 388512157 /nfs/dbraw/zinc/51/21/57/388512157.db2.gz RWJVILWJUNFMPT-DTORHVGOSA-N 1 1 244.165 3.976 20 0 BHADMO C[C@@H]1C[C@H](C)[N@H+]1Cc1ccc(Cl)c(Cl)c1 ZINC000548097935 388512155 /nfs/dbraw/zinc/51/21/55/388512155.db2.gz RWJVILWJUNFMPT-DTORHVGOSA-N 1 1 244.165 3.976 20 0 BHADMO C[C@H]1C[C@H](C)[NH+]1Cc1ccc(Cl)c(Cl)c1 ZINC000548097936 325429982 /nfs/dbraw/zinc/42/99/82/325429982.db2.gz RWJVILWJUNFMPT-IUCAKERBSA-N 1 1 244.165 3.976 20 0 BHADMO C[C@@H]1C[C@@H](C)[NH+]1Cc1ccc(Cl)c(Cl)c1 ZINC000548097937 325430060 /nfs/dbraw/zinc/43/00/60/325430060.db2.gz RWJVILWJUNFMPT-RKDXNWHRSA-N 1 1 244.165 3.976 20 0 BHADMO C[C@@H]1C[C@H](C)[N@@H+]1CC1CCC(C(F)(F)F)CC1 ZINC000548098093 388512236 /nfs/dbraw/zinc/51/22/36/388512236.db2.gz KZOYATHVJKDMNR-ZYANWLCNSA-N 1 1 249.320 3.838 20 0 BHADMO C[C@@H]1C[C@H](C)[N@@H+]1[C@@H]1CCCc2ccc(F)cc21 ZINC000548098669 388511932 /nfs/dbraw/zinc/51/19/32/388511932.db2.gz VVANQDPSKTWYNA-JRPNMDOOSA-N 1 1 233.330 3.686 20 0 BHADMO C[C@@H]1C[C@H](C)[N@@H+]1[C@H]1CCCc2ccc(F)cc21 ZINC000548098670 388512581 /nfs/dbraw/zinc/51/25/81/388512581.db2.gz VVANQDPSKTWYNA-RWSFTLGLSA-N 1 1 233.330 3.686 20 0 BHADMO CCC(C)(C)[N@@H+](C)CCCc1cccc(OC)c1 ZINC000548099036 388512011 /nfs/dbraw/zinc/51/20/11/388512011.db2.gz PNONXNOEBQMQPY-UHFFFAOYSA-N 1 1 249.398 3.748 20 0 BHADMO C[C@@H]1[C@H](C(F)(F)F)CC[N@H+]1CCC(C)(C)C ZINC000548099785 388512167 /nfs/dbraw/zinc/51/21/67/388512167.db2.gz RMLWLTDIQVFGCS-NXEZZACHSA-N 1 1 237.309 3.695 20 0 BHADMO C[C@H]1[C@@H](C(F)(F)F)CC[N@H+]1CCC(C)(C)C ZINC000548099786 388511613 /nfs/dbraw/zinc/51/16/13/388511613.db2.gz RMLWLTDIQVFGCS-UWVGGRQHSA-N 1 1 237.309 3.695 20 0 BHADMO C[C@H]1[C@H](C(F)(F)F)CC[N@H+]1CCC(C)(C)C ZINC000548099787 388511689 /nfs/dbraw/zinc/51/16/89/388511689.db2.gz RMLWLTDIQVFGCS-VHSXEESVSA-N 1 1 237.309 3.695 20 0 BHADMO C[C@@H]1[C@@H](C(F)(F)F)CC[N@H+]1CCC(C)(C)C ZINC000548099788 388511596 /nfs/dbraw/zinc/51/15/96/388511596.db2.gz RMLWLTDIQVFGCS-ZJUUUORDSA-N 1 1 237.309 3.695 20 0 BHADMO C[C@@H]1CC[N@@H+](Cc2ccc(Cl)s2)[C@H]1C ZINC000548114111 388513554 /nfs/dbraw/zinc/51/35/54/388513554.db2.gz UTKVHRPCGCWTQT-BDAKNGLRSA-N 1 1 229.776 3.632 20 0 BHADMO C[C@@H]1[C@@H](C)CC[N@H+]1Cc1ccc(Cl)s1 ZINC000548114112 388513994 /nfs/dbraw/zinc/51/39/94/388513994.db2.gz UTKVHRPCGCWTQT-DTWKUNHWSA-N 1 1 229.776 3.632 20 0 BHADMO C[C@H]1CC[N@@H+](Cc2ccc(Cl)s2)[C@H]1C ZINC000548114113 388513711 /nfs/dbraw/zinc/51/37/11/388513711.db2.gz UTKVHRPCGCWTQT-IUCAKERBSA-N 1 1 229.776 3.632 20 0 BHADMO C[C@@H]1CC[N@@H+](Cc2ccc(Cl)s2)[C@@H]1C ZINC000548114114 388513392 /nfs/dbraw/zinc/51/33/92/388513392.db2.gz UTKVHRPCGCWTQT-RKDXNWHRSA-N 1 1 229.776 3.632 20 0 BHADMO Cc1cc(F)ccc1C[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000548157792 388518681 /nfs/dbraw/zinc/51/86/81/388518681.db2.gz HHATXVNVVKVVBX-TXEJJXNPSA-N 1 1 221.319 3.507 20 0 BHADMO Cc1cc(F)ccc1C[N@H+](CC1CC1)C(C)C ZINC000548158162 388518838 /nfs/dbraw/zinc/51/88/38/388518838.db2.gz WOJZRGVBMUVMAS-UHFFFAOYSA-N 1 1 235.346 3.755 20 0 BHADMO CCC(CC)[N@@H+](C[C@@H]1CCC(C)(C)O1)C1CC1 ZINC000548159153 388518701 /nfs/dbraw/zinc/51/87/01/388518701.db2.gz ZSYTVFXNFPLATL-AWEZNQCLSA-N 1 1 239.403 3.597 20 0 BHADMO CCC(CC)[N@@H+](C[C@H]1CCC(C)(C)O1)C1CC1 ZINC000548159154 388518734 /nfs/dbraw/zinc/51/87/34/388518734.db2.gz ZSYTVFXNFPLATL-CQSZACIVSA-N 1 1 239.403 3.597 20 0 BHADMO Cc1cc(F)ccc1C[N@H+](C(C)C)C1CCC1 ZINC000548159231 388518810 /nfs/dbraw/zinc/51/88/10/388518810.db2.gz GSTLUONTZSRMMR-UHFFFAOYSA-N 1 1 235.346 3.897 20 0 BHADMO CC[C@H]1CC[C@@H](C)[N@H+]1Cc1ncc(Cl)s1 ZINC000548160935 388518765 /nfs/dbraw/zinc/51/87/65/388518765.db2.gz GCKNPEFQMNJBGG-BDAKNGLRSA-N 1 1 244.791 3.559 20 0 BHADMO CC[C@H]1CC[C@@H](C)[N@@H+]1Cc1ncc(Cl)s1 ZINC000548160935 388518763 /nfs/dbraw/zinc/51/87/63/388518763.db2.gz GCKNPEFQMNJBGG-BDAKNGLRSA-N 1 1 244.791 3.559 20 0 BHADMO CC[C@@H]1CC[C@H](C)[N@H+]1Cc1ncc(Cl)s1 ZINC000548160936 388518751 /nfs/dbraw/zinc/51/87/51/388518751.db2.gz GCKNPEFQMNJBGG-DTWKUNHWSA-N 1 1 244.791 3.559 20 0 BHADMO CC[C@@H]1CC[C@H](C)[N@@H+]1Cc1ncc(Cl)s1 ZINC000548160936 388518750 /nfs/dbraw/zinc/51/87/50/388518750.db2.gz GCKNPEFQMNJBGG-DTWKUNHWSA-N 1 1 244.791 3.559 20 0 BHADMO CC[C@H]1CC[C@H](C)[N@H+]1Cc1ncc(Cl)s1 ZINC000548160937 388518829 /nfs/dbraw/zinc/51/88/29/388518829.db2.gz GCKNPEFQMNJBGG-IUCAKERBSA-N 1 1 244.791 3.559 20 0 BHADMO CC[C@H]1CC[C@H](C)[N@@H+]1Cc1ncc(Cl)s1 ZINC000548160937 388518828 /nfs/dbraw/zinc/51/88/28/388518828.db2.gz GCKNPEFQMNJBGG-IUCAKERBSA-N 1 1 244.791 3.559 20 0 BHADMO CC[C@@H]1CC[C@@H](C)[N@H+]1Cc1ncc(Cl)s1 ZINC000548160938 388518795 /nfs/dbraw/zinc/51/87/95/388518795.db2.gz GCKNPEFQMNJBGG-RKDXNWHRSA-N 1 1 244.791 3.559 20 0 BHADMO CC[C@@H]1CC[C@@H](C)[N@@H+]1Cc1ncc(Cl)s1 ZINC000548160938 388518794 /nfs/dbraw/zinc/51/87/94/388518794.db2.gz GCKNPEFQMNJBGG-RKDXNWHRSA-N 1 1 244.791 3.559 20 0 BHADMO CC(C)=CC[N@@H+]1CCC[C@@H](C(F)(F)F)[C@H]1C ZINC000548168644 387296203 /nfs/dbraw/zinc/29/62/03/387296203.db2.gz GVNDYZVMTUARMB-GHMZBOCLSA-N 1 1 235.293 3.615 20 0 BHADMO CC(C)=CC[N@@H+]1CCC[C@H](C(F)(F)F)[C@H]1C ZINC000548168645 387294907 /nfs/dbraw/zinc/29/49/07/387294907.db2.gz GVNDYZVMTUARMB-MNOVXSKESA-N 1 1 235.293 3.615 20 0 BHADMO CC(C)=CC[N@@H+]1CCC[C@H](C(F)(F)F)[C@@H]1C ZINC000548168646 387296105 /nfs/dbraw/zinc/29/61/05/387296105.db2.gz GVNDYZVMTUARMB-QWRGUYRKSA-N 1 1 235.293 3.615 20 0 BHADMO CC(C)=CC[N@@H+]1CCC[C@@H](C(F)(F)F)[C@@H]1C ZINC000548168647 387295836 /nfs/dbraw/zinc/29/58/36/387295836.db2.gz GVNDYZVMTUARMB-WDEREUQCSA-N 1 1 235.293 3.615 20 0 BHADMO CCCc1cccc(C[N@H+]2CCCSCC2)c1 ZINC000548170231 388519313 /nfs/dbraw/zinc/51/93/13/388519313.db2.gz FJSXVWPILFATCA-UHFFFAOYSA-N 1 1 249.423 3.578 20 0 BHADMO C[C@H](Cc1ccsc1)[N@H+]1CCCCC[C@H]1C ZINC000548258726 388523712 /nfs/dbraw/zinc/52/37/12/388523712.db2.gz UKWGASKYCRIOAC-CHWSQXEVSA-N 1 1 237.412 3.944 20 0 BHADMO C[C@@H](Cc1ccsc1)[N@H+]1CCCCC[C@H]1C ZINC000548258760 388523328 /nfs/dbraw/zinc/52/33/28/388523328.db2.gz UKWGASKYCRIOAC-OLZOCXBDSA-N 1 1 237.412 3.944 20 0 BHADMO C[C@H](Cc1ccsc1)[N@H+]1CCCCC[C@@H]1C ZINC000548258762 388523731 /nfs/dbraw/zinc/52/37/31/388523731.db2.gz UKWGASKYCRIOAC-QWHCGFSZSA-N 1 1 237.412 3.944 20 0 BHADMO C[C@@H](Cc1ccsc1)[N@H+]1CCCCC[C@@H]1C ZINC000548258763 388523130 /nfs/dbraw/zinc/52/31/30/388523130.db2.gz UKWGASKYCRIOAC-STQMWFEESA-N 1 1 237.412 3.944 20 0 BHADMO C[C@H]1CCCCC[N@H+]1Cc1ccccc1N(C)C ZINC000548259137 388523077 /nfs/dbraw/zinc/52/30/77/388523077.db2.gz LGDIRDBLSZPUCX-AWEZNQCLSA-N 1 1 246.398 3.517 20 0 BHADMO C[C@@H]1CCCCC[N@H+]1Cc1ccccc1N(C)C ZINC000548259138 388522871 /nfs/dbraw/zinc/52/28/71/388522871.db2.gz LGDIRDBLSZPUCX-CQSZACIVSA-N 1 1 246.398 3.517 20 0 BHADMO C[C@@H]1CCCCC[N@H+]1Cc1cccc(F)c1F ZINC000548259201 388522981 /nfs/dbraw/zinc/52/29/81/388522981.db2.gz YPNXQSQSKAMNAU-LLVKDONJSA-N 1 1 239.309 3.729 20 0 BHADMO C[C@H]1CCCCC[N@H+]1Cc1cccc(F)c1F ZINC000548259202 388523081 /nfs/dbraw/zinc/52/30/81/388523081.db2.gz YPNXQSQSKAMNAU-NSHDSACASA-N 1 1 239.309 3.729 20 0 BHADMO CC[N@@H+]([C@H](C)Cc1ccsc1)C1CCCC1 ZINC000548301857 388527357 /nfs/dbraw/zinc/52/73/57/388527357.db2.gz XDTLUMAZRPIIBV-GFCCVEGCSA-N 1 1 237.412 3.944 20 0 BHADMO CC[N@@H+]([C@@H](C)Cc1ccsc1)C1CCCC1 ZINC000548301858 388527178 /nfs/dbraw/zinc/52/71/78/388527178.db2.gz XDTLUMAZRPIIBV-LBPRGKRZSA-N 1 1 237.412 3.944 20 0 BHADMO C[N@@H+](CC1(c2ccccc2)CC1)C1CCCC1 ZINC000548401443 388534499 /nfs/dbraw/zinc/53/44/99/388534499.db2.gz SKIRFXZVIXCEIH-UHFFFAOYSA-N 1 1 229.367 3.593 20 0 BHADMO CC[N@@H+](CCC(F)(F)F)[C@@H]1CCCC[C@H]1C ZINC000548403528 388533743 /nfs/dbraw/zinc/53/37/43/388533743.db2.gz HHAYFHBIIIWBTB-GHMZBOCLSA-N 1 1 237.309 3.839 20 0 BHADMO CC[N@@H+](CCC(F)(F)F)[C@H]1CCCC[C@H]1C ZINC000548403537 388534173 /nfs/dbraw/zinc/53/41/73/388534173.db2.gz HHAYFHBIIIWBTB-MNOVXSKESA-N 1 1 237.309 3.839 20 0 BHADMO CC[N@@H+](CCC(F)(F)F)[C@H]1CCCC[C@@H]1C ZINC000548403538 388533790 /nfs/dbraw/zinc/53/37/90/388533790.db2.gz HHAYFHBIIIWBTB-QWRGUYRKSA-N 1 1 237.309 3.839 20 0 BHADMO CC[N@@H+](CCC(F)(F)F)[C@@H]1CCCC[C@@H]1C ZINC000548403539 388534169 /nfs/dbraw/zinc/53/41/69/388534169.db2.gz HHAYFHBIIIWBTB-WDEREUQCSA-N 1 1 237.309 3.839 20 0 BHADMO Cc1cccc(C)c1OCCC[N@@H+]1[C@H](C)C[C@@H]1C ZINC000548424372 388536747 /nfs/dbraw/zinc/53/67/47/388536747.db2.gz XXKZPXXKVVTWFC-GASCZTMLSA-N 1 1 247.382 3.555 20 0 BHADMO CC[C@H](c1ccccc1)[N@@H+]1[C@H](C)C[C@@H]1C ZINC000548424402 388536435 /nfs/dbraw/zinc/53/64/35/388536435.db2.gz FCBZGYHNSGEYNF-MBNYWOFBSA-N 1 1 203.329 3.620 20 0 BHADMO CC[C@@H](c1ccccc1)[N@@H+]1[C@H](C)C[C@@H]1C ZINC000548424403 388536906 /nfs/dbraw/zinc/53/69/06/388536906.db2.gz FCBZGYHNSGEYNF-SCRDCRAPSA-N 1 1 203.329 3.620 20 0 BHADMO C[C@@H](c1cc(F)ccc1F)[N@@H+]1[C@H](C)C[C@@H]1C ZINC000548424634 388537051 /nfs/dbraw/zinc/53/70/51/388537051.db2.gz DFGZFZKXMPSETN-AEJSXWLSSA-N 1 1 225.282 3.509 20 0 BHADMO C[C@H](c1cc(F)ccc1F)[N@@H+]1[C@H](C)C[C@@H]1C ZINC000548424636 388537133 /nfs/dbraw/zinc/53/71/33/388537133.db2.gz DFGZFZKXMPSETN-KXUCPTDWSA-N 1 1 225.282 3.509 20 0 BHADMO C[C@@H]1C[C@H](C)[N@@H+]1Cc1cccc(C(F)F)c1 ZINC000548424962 388536254 /nfs/dbraw/zinc/53/62/54/388536254.db2.gz IVMVSILYNNSCEU-AOOOYVTPSA-N 1 1 225.282 3.607 20 0 BHADMO Cc1ccc(C)c(OCCC[N@@H+]2[C@H](C)C[C@@H]2C)c1 ZINC000548425123 388537314 /nfs/dbraw/zinc/53/73/14/388537314.db2.gz PNYRPGCQNSLFQM-GASCZTMLSA-N 1 1 247.382 3.555 20 0 BHADMO C[C@@H]1C[C@H](C)[N@@H+]1Cc1ccc(C(F)(F)F)cc1 ZINC000548425169 388536457 /nfs/dbraw/zinc/53/64/57/388536457.db2.gz SSECRXJEOFSMHW-AOOOYVTPSA-N 1 1 243.272 3.688 20 0 BHADMO Cc1cc(C[N@@H+]2[C@H](C)C[C@@H]2C)c2ccccc2n1 ZINC000548425555 388537396 /nfs/dbraw/zinc/53/73/96/388537396.db2.gz QGUVUAUANQVNIL-BETUJISGSA-N 1 1 240.350 3.526 20 0 BHADMO C[C@@H](c1ccc(F)c(F)c1)[N@@H+]1[C@H](C)C[C@@H]1C ZINC000548425739 388536516 /nfs/dbraw/zinc/53/65/16/388536516.db2.gz NXVQFOUETIFPQM-AEJSXWLSSA-N 1 1 225.282 3.509 20 0 BHADMO C[C@H](c1ccc(F)c(F)c1)[N@@H+]1[C@H](C)C[C@@H]1C ZINC000548425741 388537000 /nfs/dbraw/zinc/53/70/00/388537000.db2.gz NXVQFOUETIFPQM-KXUCPTDWSA-N 1 1 225.282 3.509 20 0 BHADMO C[C@@H]1C[C@H](C)[N@@H+]1[C@@H]1CCc2ccc(Cl)cc21 ZINC000548426154 388536293 /nfs/dbraw/zinc/53/62/93/388536293.db2.gz VUHBMHGGJWZSHP-ISTVAULSSA-N 1 1 235.758 3.810 20 0 BHADMO C[C@@H]1C[C@H](C)[N@@H+]1[C@H]1CCc2ccc(Cl)cc21 ZINC000548426155 388536664 /nfs/dbraw/zinc/53/66/64/388536664.db2.gz VUHBMHGGJWZSHP-RBZYPMLTSA-N 1 1 235.758 3.810 20 0 BHADMO Cc1ccccc1[C@@H](C)[N@@H+]1[C@H](C)C[C@@H]1C ZINC000548426679 388536499 /nfs/dbraw/zinc/53/64/99/388536499.db2.gz BZVHLQIYFPFLOL-FRRDWIJNSA-N 1 1 203.329 3.539 20 0 BHADMO Cc1ccccc1[C@H](C)[N@@H+]1[C@H](C)C[C@@H]1C ZINC000548426682 388536862 /nfs/dbraw/zinc/53/68/62/388536862.db2.gz BZVHLQIYFPFLOL-XQQFMLRXSA-N 1 1 203.329 3.539 20 0 BHADMO CCC(C)(C)[N@@H+](C)CCc1cccc(F)c1F ZINC000548427262 388538886 /nfs/dbraw/zinc/53/88/86/388538886.db2.gz GMPRJLCEBFTHTI-UHFFFAOYSA-N 1 1 241.325 3.628 20 0 BHADMO CCC(C)(C)[N@@H+](C)Cc1ccc(F)c(F)c1 ZINC000548427726 388538814 /nfs/dbraw/zinc/53/88/14/388538814.db2.gz MUMUPQUJDLMUNR-UHFFFAOYSA-N 1 1 227.298 3.585 20 0 BHADMO CCC(C)(C)[N@@H+](C)Cc1cccc(Cl)c1 ZINC000548427844 388538856 /nfs/dbraw/zinc/53/88/56/388538856.db2.gz OPRYNKSVCGHQOL-UHFFFAOYSA-N 1 1 225.763 3.960 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@H](C)C(C)(C)C)c(C)n1 ZINC000548487147 388543203 /nfs/dbraw/zinc/54/32/03/388543203.db2.gz QUWJMDKIXZVAIL-CYBMUJFWSA-N 1 1 234.387 3.565 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@@H](C)C(C)(C)C)c(C)n1 ZINC000548487148 388543524 /nfs/dbraw/zinc/54/35/24/388543524.db2.gz QUWJMDKIXZVAIL-ZDUSSCGKSA-N 1 1 234.387 3.565 20 0 BHADMO CC(C)=CC[N@H+]1Cc2ccccc2C2(CC2)C1 ZINC000548497485 388544611 /nfs/dbraw/zinc/54/46/11/388544611.db2.gz ZLTZVQOZTIQCGR-UHFFFAOYSA-N 1 1 227.351 3.500 20 0 BHADMO C[C@@H]1CCCCC[N@H+]1Cc1cccc2cc[nH]c21 ZINC000548587376 388547595 /nfs/dbraw/zinc/54/75/95/388547595.db2.gz IOMXRAUCBACOIG-CYBMUJFWSA-N 1 1 242.366 3.932 20 0 BHADMO C[C@H]1CCCCC[N@H+]1Cc1cccc2cc[nH]c21 ZINC000548587377 388547059 /nfs/dbraw/zinc/54/70/59/388547059.db2.gz IOMXRAUCBACOIG-ZDUSSCGKSA-N 1 1 242.366 3.932 20 0 BHADMO C[C@H]1CCCCC[N@H+]1Cc1ccc(Cl)o1 ZINC000548587416 388547500 /nfs/dbraw/zinc/54/75/00/388547500.db2.gz PZJQQAFXHZJXIS-JTQLQIEISA-N 1 1 227.735 3.698 20 0 BHADMO C[C@@H]1CCCCC[N@H+]1Cc1ccc(Cl)o1 ZINC000548587417 388547394 /nfs/dbraw/zinc/54/73/94/388547394.db2.gz PZJQQAFXHZJXIS-SNVBAGLBSA-N 1 1 227.735 3.698 20 0 BHADMO C[C@@H]1CCCCC[N@H+]1CCCc1ccsc1 ZINC000548603740 388547761 /nfs/dbraw/zinc/54/77/61/388547761.db2.gz SXLJQIDRGAOGOJ-CYBMUJFWSA-N 1 1 237.412 3.945 20 0 BHADMO C[C@H]1CCCCC[N@H+]1CCCc1ccsc1 ZINC000548603741 388548090 /nfs/dbraw/zinc/54/80/90/388548090.db2.gz SXLJQIDRGAOGOJ-ZDUSSCGKSA-N 1 1 237.412 3.945 20 0 BHADMO Fc1cc(Cl)ccc1C[NH+]1C2CCC1CC2 ZINC000548721530 325475770 /nfs/dbraw/zinc/47/57/70/325475770.db2.gz QXVHYEDLUIFIEB-UHFFFAOYSA-N 1 1 239.721 3.606 20 0 BHADMO CC(C)=CC[N@H+](C)CC1(c2ccccc2)CC1 ZINC000548729336 388555076 /nfs/dbraw/zinc/55/50/76/388555076.db2.gz ONZNUBILRNCOEL-UHFFFAOYSA-N 1 1 229.367 3.616 20 0 BHADMO C[C@@H]1CCCC[C@H]1[N@@H+](C)[C@H]1C=CCCC1 ZINC000548730953 388554941 /nfs/dbraw/zinc/55/49/41/388554941.db2.gz YRJSOFXBMGVZLG-HZSPNIEDSA-N 1 1 207.361 3.606 20 0 BHADMO C[C@@H]1CCCC[C@@H]1[N@@H+](C)[C@@H]1C=CCCC1 ZINC000548730955 388555160 /nfs/dbraw/zinc/55/51/60/388555160.db2.gz YRJSOFXBMGVZLG-MCIONIFRSA-N 1 1 207.361 3.606 20 0 BHADMO C[C@@H]1CCCC[C@H]1[N@@H+](C)[C@@H]1C=CCCC1 ZINC000548730957 388555180 /nfs/dbraw/zinc/55/51/80/388555180.db2.gz YRJSOFXBMGVZLG-MGPQQGTHSA-N 1 1 207.361 3.606 20 0 BHADMO C[C@@H]1CCCC[C@@H]1[N@@H+](C)[C@H]1C=CCCC1 ZINC000548730958 388555123 /nfs/dbraw/zinc/55/51/23/388555123.db2.gz YRJSOFXBMGVZLG-RDBSUJKOSA-N 1 1 207.361 3.606 20 0 BHADMO COc1cccc(C[N@@H+](C)[C@H]2CCCC[C@@H]2C)c1 ZINC000548731185 388555203 /nfs/dbraw/zinc/55/52/03/388555203.db2.gz KCASYBKHRVMMMU-BBRMVZONSA-N 1 1 247.382 3.706 20 0 BHADMO COc1cccc(C[N@@H+](C)[C@H]2CCCC[C@H]2C)c1 ZINC000548731198 388555268 /nfs/dbraw/zinc/55/52/68/388555268.db2.gz KCASYBKHRVMMMU-CJNGLKHVSA-N 1 1 247.382 3.706 20 0 BHADMO COc1cccc(C[N@@H+](C)[C@@H]2CCCC[C@H]2C)c1 ZINC000548731199 388554723 /nfs/dbraw/zinc/55/47/23/388554723.db2.gz KCASYBKHRVMMMU-CZUORRHYSA-N 1 1 247.382 3.706 20 0 BHADMO COc1cccc(C[N@@H+](C)[C@@H]2CCCC[C@@H]2C)c1 ZINC000548731201 388554850 /nfs/dbraw/zinc/55/48/50/388554850.db2.gz KCASYBKHRVMMMU-XJKSGUPXSA-N 1 1 247.382 3.706 20 0 BHADMO C[C@@H]1C[C@H](C)[N@@H+]1Cc1cccc(Cl)c1Cl ZINC000548752995 388556793 /nfs/dbraw/zinc/55/67/93/388556793.db2.gz FWNUIHURIIYSCB-DTORHVGOSA-N 1 1 244.165 3.976 20 0 BHADMO C[C@@H]1C[C@H](C)[N@H+]1Cc1cccc(Cl)c1Cl ZINC000548752995 388556791 /nfs/dbraw/zinc/55/67/91/388556791.db2.gz FWNUIHURIIYSCB-DTORHVGOSA-N 1 1 244.165 3.976 20 0 BHADMO C[C@H]1C[C@H](C)[NH+]1Cc1cccc(Cl)c1Cl ZINC000548752999 325478194 /nfs/dbraw/zinc/47/81/94/325478194.db2.gz FWNUIHURIIYSCB-IUCAKERBSA-N 1 1 244.165 3.976 20 0 BHADMO C[C@@H]1C[C@@H](C)[NH+]1Cc1cccc(Cl)c1Cl ZINC000548753000 388557480 /nfs/dbraw/zinc/55/74/80/388557480.db2.gz FWNUIHURIIYSCB-RKDXNWHRSA-N 1 1 244.165 3.976 20 0 BHADMO CC[C@H](c1ccc(F)cc1F)[N@@H+]1[C@H](C)C[C@@H]1C ZINC000548753266 388556855 /nfs/dbraw/zinc/55/68/55/388556855.db2.gz QXHRJSIPBZTNNA-ISTVAULSSA-N 1 1 239.309 3.899 20 0 BHADMO CC[C@@H](c1ccc(F)cc1F)[N@@H+]1[C@H](C)C[C@@H]1C ZINC000548753270 388557717 /nfs/dbraw/zinc/55/77/17/388557717.db2.gz QXHRJSIPBZTNNA-RBZYPMLTSA-N 1 1 239.309 3.899 20 0 BHADMO C[C@@H]1C[C@H](C)[N@@H+]1C/C=C/c1ccc(Cl)cc1 ZINC000548753327 388557672 /nfs/dbraw/zinc/55/76/72/388557672.db2.gz QEQTYTLRMNETGL-ROUHBEFFSA-N 1 1 235.758 3.836 20 0 BHADMO C[C@@H]1C[C@H](C)[N@@H+]1C/C=C\c1ccc(Cl)cc1 ZINC000548753328 388556876 /nfs/dbraw/zinc/55/68/76/388556876.db2.gz QEQTYTLRMNETGL-XVGAQQEPSA-N 1 1 235.758 3.836 20 0 BHADMO Cc1cc(C)c(C[N@@H+]2[C@H](C)C[C@@H]2C)c(C)c1 ZINC000548753650 388557342 /nfs/dbraw/zinc/55/73/42/388557342.db2.gz DBMNORHHNJIRFE-OKILXGFUSA-N 1 1 217.356 3.595 20 0 BHADMO Cc1cccc([C@@H](C)[N@@H+]2[C@H](C)C[C@@H]2C)c1 ZINC000548753697 388557010 /nfs/dbraw/zinc/55/70/10/388557010.db2.gz NGNSABZDMNZYAW-FRRDWIJNSA-N 1 1 203.329 3.539 20 0 BHADMO Cc1cccc([C@H](C)[N@@H+]2[C@H](C)C[C@@H]2C)c1 ZINC000548753699 388009972 /nfs/dbraw/zinc/00/99/72/388009972.db2.gz NGNSABZDMNZYAW-XQQFMLRXSA-N 1 1 203.329 3.539 20 0 BHADMO C[C@@H]1C[C@H](C)[N@@H+]1CCCc1ccccc1Cl ZINC000548754899 388557488 /nfs/dbraw/zinc/55/74/88/388557488.db2.gz WZKZTZUBOUYOJI-TXEJJXNPSA-N 1 1 237.774 3.755 20 0 BHADMO CCC(C)(C)[N@@H+](C)C/C=C/c1ccccc1 ZINC000548755322 388557852 /nfs/dbraw/zinc/55/78/52/388557852.db2.gz XOOOLCREBCRHTP-FMIVXFBMSA-N 1 1 217.356 3.820 20 0 BHADMO CCC(C)(C)[N@@H+](C)C/C=C\c1ccccc1 ZINC000548755323 388557663 /nfs/dbraw/zinc/55/76/63/388557663.db2.gz XOOOLCREBCRHTP-XFXZXTDPSA-N 1 1 217.356 3.820 20 0 BHADMO CCC(C)(C)[N@@H+](C)Cc1ccc(F)cc1F ZINC000548755508 388556824 /nfs/dbraw/zinc/55/68/24/388556824.db2.gz BUZFKTORKPJKOP-UHFFFAOYSA-N 1 1 227.298 3.585 20 0 BHADMO CSc1ccccc1C[N@@H+](C)CC=C(C)C ZINC000548755546 388557582 /nfs/dbraw/zinc/55/75/82/388557582.db2.gz QHJIFNYCDNQCBH-UHFFFAOYSA-N 1 1 235.396 3.807 20 0 BHADMO CCC(C)(C)[N@@H+](C)Cc1c(F)cccc1F ZINC000548756086 388557885 /nfs/dbraw/zinc/55/78/85/388557885.db2.gz KZNLTNCAHKAZPS-UHFFFAOYSA-N 1 1 227.298 3.585 20 0 BHADMO Cc1ccccc1[C@]1(F)CC[N@@H+](CC2(C)CC2)C1 ZINC000548796245 388562813 /nfs/dbraw/zinc/56/28/13/388562813.db2.gz QETBVOOPWOSEFL-INIZCTEOSA-N 1 1 247.357 3.666 20 0 BHADMO Cc1ccccc1[C@@]1(F)CC[N@@H+](CC2(C)CC2)C1 ZINC000548796246 388563553 /nfs/dbraw/zinc/56/35/53/388563553.db2.gz QETBVOOPWOSEFL-MRXNPFEDSA-N 1 1 247.357 3.666 20 0 BHADMO CCC[C@@H](C)[N@H+]1CCO[C@@H](c2ccccc2C)C1 ZINC000548843951 388564220 /nfs/dbraw/zinc/56/42/20/388564220.db2.gz XLMBMMMSMRIJPN-GDBMZVCRSA-N 1 1 247.382 3.557 20 0 BHADMO CCC[C@H](C)[N@H+]1CCO[C@@H](c2ccccc2C)C1 ZINC000548843952 388564176 /nfs/dbraw/zinc/56/41/76/388564176.db2.gz XLMBMMMSMRIJPN-GOEBONIOSA-N 1 1 247.382 3.557 20 0 BHADMO CCC[C@H](C)[N@H+]1CCO[C@H](c2ccccc2C)C1 ZINC000548843953 388564880 /nfs/dbraw/zinc/56/48/80/388564880.db2.gz XLMBMMMSMRIJPN-HOCLYGCPSA-N 1 1 247.382 3.557 20 0 BHADMO CCC[C@@H](C)[N@H+]1CCO[C@H](c2ccccc2C)C1 ZINC000548843954 388564440 /nfs/dbraw/zinc/56/44/40/388564440.db2.gz XLMBMMMSMRIJPN-ZBFHGGJFSA-N 1 1 247.382 3.557 20 0 BHADMO CCC[C@@H](C)[N@H+]1CCCc2cc(OC)ccc2C1 ZINC000548849707 383966133 /nfs/dbraw/zinc/96/61/33/383966133.db2.gz BQISFDDVEAFUQA-CYBMUJFWSA-N 1 1 247.382 3.632 20 0 BHADMO CCC[C@H](C)[N@H+]1CCCc2cc(OC)ccc2C1 ZINC000548849708 383966194 /nfs/dbraw/zinc/96/61/94/383966194.db2.gz BQISFDDVEAFUQA-ZDUSSCGKSA-N 1 1 247.382 3.632 20 0 BHADMO c1cc2cc[nH+]cc2c(N[C@H]2CCC23CCC3)c1 ZINC000548860171 388565792 /nfs/dbraw/zinc/56/57/92/388565792.db2.gz NEEVBTDGLOGZII-HNNXBMFYSA-N 1 1 238.334 3.979 20 0 BHADMO c1cc2cc[nH+]cc2c(N[C@@H]2CCC23CCC3)c1 ZINC000548860172 388566212 /nfs/dbraw/zinc/56/62/12/388566212.db2.gz NEEVBTDGLOGZII-OAHLLOKOSA-N 1 1 238.334 3.979 20 0 BHADMO CC(C)SCC[N@H+]1[C@H](C)C[C@@H]2CCCC[C@H]21 ZINC000548918333 398139016 /nfs/dbraw/zinc/13/90/16/398139016.db2.gz NKCZCOULAMQLSE-HZSPNIEDSA-N 1 1 241.444 3.781 20 0 BHADMO CC(C)SCC[N@H+]1[C@H](C)C[C@H]2CCCC[C@@H]21 ZINC000548918334 398139127 /nfs/dbraw/zinc/13/91/27/398139127.db2.gz NKCZCOULAMQLSE-MCIONIFRSA-N 1 1 241.444 3.781 20 0 BHADMO CC(C)SCC[N@H+]1[C@H](C)C[C@H]2CCCC[C@H]21 ZINC000548918335 398138909 /nfs/dbraw/zinc/13/89/09/398138909.db2.gz NKCZCOULAMQLSE-MGPQQGTHSA-N 1 1 241.444 3.781 20 0 BHADMO CC(C)SCC[N@H+]1[C@H](C)C[C@@H]2CCCC[C@@H]21 ZINC000548918336 398138761 /nfs/dbraw/zinc/13/87/61/398138761.db2.gz NKCZCOULAMQLSE-RDBSUJKOSA-N 1 1 241.444 3.781 20 0 BHADMO CC(C)SCC[N@H+]1CCC[C@@H]1C(C)(C)C ZINC000548918809 398138846 /nfs/dbraw/zinc/13/88/46/398138846.db2.gz YYHBPFPGPGYIDA-GFCCVEGCSA-N 1 1 229.433 3.639 20 0 BHADMO CC(C)SCC[N@H+]1CCC[C@H]1C(C)(C)C ZINC000548918818 398139231 /nfs/dbraw/zinc/13/92/31/398139231.db2.gz YYHBPFPGPGYIDA-LBPRGKRZSA-N 1 1 229.433 3.639 20 0 BHADMO CC(C)SCC[N@H+]1CCc2ccccc2[C@H]1C ZINC000548918829 398138924 /nfs/dbraw/zinc/13/89/24/398138924.db2.gz ZFHZSPSGXZXGGK-CYBMUJFWSA-N 1 1 249.423 3.747 20 0 BHADMO CC(C)SCC[N@H+]1CCc2ccccc2[C@@H]1C ZINC000548918841 398139142 /nfs/dbraw/zinc/13/91/42/398139142.db2.gz ZFHZSPSGXZXGGK-ZDUSSCGKSA-N 1 1 249.423 3.747 20 0 BHADMO FCCC[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](c1ccccc1)C2 ZINC000548927941 388569026 /nfs/dbraw/zinc/56/90/26/388569026.db2.gz QASNSNNDBRJHTI-MUJYYYPQSA-N 1 1 247.357 3.757 20 0 BHADMO Cc1cccnc1C[N@H+](C)[C@H](C)C1CCCCC1 ZINC000548929038 388569553 /nfs/dbraw/zinc/56/95/53/388569553.db2.gz ISQXARFEEFCCRU-CQSZACIVSA-N 1 1 246.398 3.791 20 0 BHADMO C[C@H](C1CCCCC1)[N@@H+](C)Cc1cscn1 ZINC000548929637 388569569 /nfs/dbraw/zinc/56/95/69/388569569.db2.gz DBJLYHOEKRLMOA-LLVKDONJSA-N 1 1 238.400 3.544 20 0 BHADMO COCCCCC[N@@H+](C)[C@H](C)C1CCCCC1 ZINC000548930835 388569137 /nfs/dbraw/zinc/56/91/37/388569137.db2.gz UKDSTRFMZCOAKF-CQSZACIVSA-N 1 1 241.419 3.704 20 0 BHADMO Cc1cncc(C[N@H+](C)[C@H](C)C2CCCCC2)c1 ZINC000548931013 388569260 /nfs/dbraw/zinc/56/92/60/388569260.db2.gz XRFXHLPXMIGSLG-CQSZACIVSA-N 1 1 246.398 3.791 20 0 BHADMO CCCC[N@@H+](C)[C@H]1CCCc2ccccc21 ZINC000548933001 388569594 /nfs/dbraw/zinc/56/95/94/388569594.db2.gz CUJVNDPPUVMVAH-HNNXBMFYSA-N 1 1 217.356 3.796 20 0 BHADMO CCCC[N@@H+](C)[C@@H]1CCCc2ccccc21 ZINC000548933002 388569170 /nfs/dbraw/zinc/56/91/70/388569170.db2.gz CUJVNDPPUVMVAH-OAHLLOKOSA-N 1 1 217.356 3.796 20 0 BHADMO CC(C)[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](c1ccccc1)C2 ZINC000548934505 388569488 /nfs/dbraw/zinc/56/94/88/388569488.db2.gz HRTADTRTPOWGGO-MUJYYYPQSA-N 1 1 229.367 3.805 20 0 BHADMO CC1=C(C)C[N@@H+](C[C@@H]2CCC3(CCCC3)O2)CC1 ZINC000548937086 388569781 /nfs/dbraw/zinc/56/97/81/388569781.db2.gz UJPWKIQGUWHDNH-HNNXBMFYSA-N 1 1 249.398 3.520 20 0 BHADMO CC1=C(C)C[N@@H+](C[C@H]2CCC3(CCCC3)O2)CC1 ZINC000548937087 388569674 /nfs/dbraw/zinc/56/96/74/388569674.db2.gz UJPWKIQGUWHDNH-OAHLLOKOSA-N 1 1 249.398 3.520 20 0 BHADMO CC[N@@H+](C[C@H](OC)c1ccccc1)C1CCCC1 ZINC000549041184 388571253 /nfs/dbraw/zinc/57/12/53/388571253.db2.gz ZFXMLLYRYMYNPO-INIZCTEOSA-N 1 1 247.382 3.639 20 0 BHADMO CC[N@@H+](C[C@@H](OC)c1ccccc1)C1CCCC1 ZINC000549041185 388570991 /nfs/dbraw/zinc/57/09/91/388570991.db2.gz ZFXMLLYRYMYNPO-MRXNPFEDSA-N 1 1 247.382 3.639 20 0 BHADMO CC[N@H+](Cc1sccc1Cl)CC(C)C ZINC000549041407 388571625 /nfs/dbraw/zinc/57/16/25/388571625.db2.gz DKMVCTKWRCTKFD-UHFFFAOYSA-N 1 1 231.792 3.879 20 0 BHADMO CC[C@@H]1CCC[N@H+]1Cc1sccc1Cl ZINC000549041562 388571867 /nfs/dbraw/zinc/57/18/67/388571867.db2.gz OGHKNCALCPCXEH-SECBINFHSA-N 1 1 229.776 3.776 20 0 BHADMO CC[C@H]1CCC[N@H+]1Cc1sccc1Cl ZINC000549041563 388571720 /nfs/dbraw/zinc/57/17/20/388571720.db2.gz OGHKNCALCPCXEH-VIFPVBQESA-N 1 1 229.776 3.776 20 0 BHADMO CC(C)[C@@H](C)[N@@H+](C)Cc1sccc1Cl ZINC000549041857 388571216 /nfs/dbraw/zinc/57/12/16/388571216.db2.gz WNWGDDGEMUPBMF-SECBINFHSA-N 1 1 231.792 3.878 20 0 BHADMO CC(C)[C@H](C)[N@@H+](C)Cc1sccc1Cl ZINC000549041858 388570899 /nfs/dbraw/zinc/57/08/99/388570899.db2.gz WNWGDDGEMUPBMF-VIFPVBQESA-N 1 1 231.792 3.878 20 0 BHADMO CO[C@@H](C[N@@H+](C)C1CCCCC1)c1ccccc1 ZINC000549041885 388571636 /nfs/dbraw/zinc/57/16/36/388571636.db2.gz XJDQUYBUVBRZQG-INIZCTEOSA-N 1 1 247.382 3.639 20 0 BHADMO CO[C@H](C[N@@H+](C)C1CCCCC1)c1ccccc1 ZINC000549041886 388571397 /nfs/dbraw/zinc/57/13/97/388571397.db2.gz XJDQUYBUVBRZQG-MRXNPFEDSA-N 1 1 247.382 3.639 20 0 BHADMO CCC(CC)[N@@H+](CCOc1ccccc1)C1CC1 ZINC000549099143 388572752 /nfs/dbraw/zinc/57/27/52/388572752.db2.gz UPVQQCSEBRSGTG-UHFFFAOYSA-N 1 1 247.382 3.718 20 0 BHADMO CCC(C)(C)[N@@H+](C)C[C@H]1CCC2(CCCC2)O1 ZINC000549136855 388573107 /nfs/dbraw/zinc/57/31/07/388573107.db2.gz KWJAEFLPVMEONG-CYBMUJFWSA-N 1 1 239.403 3.599 20 0 BHADMO CCC(C)(C)[N@@H+](C)C[C@@H]1CCC2(CCCC2)O1 ZINC000549136856 388573627 /nfs/dbraw/zinc/57/36/27/388573627.db2.gz KWJAEFLPVMEONG-ZDUSSCGKSA-N 1 1 239.403 3.599 20 0 BHADMO CC1=C(c2ccco2)C[N@@H+](CC2CCCC2)CC1 ZINC000549158757 487724139 /nfs/dbraw/zinc/72/41/39/487724139.db2.gz ARVBNFZXNOVVDU-UHFFFAOYSA-N 1 1 245.366 3.949 20 0 BHADMO CC(C)C[N@H+]1CC[C@@H](C(F)(F)F)C2(CCC2)C1 ZINC000549171911 388574964 /nfs/dbraw/zinc/57/49/64/388574964.db2.gz KSHQGHFFAIZWLY-LLVKDONJSA-N 1 1 249.320 3.697 20 0 BHADMO CC(C)C[N@H+]1CC[C@H](C(F)(F)F)C2(CCC2)C1 ZINC000549171936 388574864 /nfs/dbraw/zinc/57/48/64/388574864.db2.gz KSHQGHFFAIZWLY-NSHDSACASA-N 1 1 249.320 3.697 20 0 BHADMO CC(C)Oc1ccc(C[N@@H+](C)[C@H](C)C2CC2)cc1 ZINC000549200838 388574800 /nfs/dbraw/zinc/57/48/00/388574800.db2.gz BLKXOPQJJWMUAT-CYBMUJFWSA-N 1 1 247.382 3.704 20 0 BHADMO CC(C)Oc1ccc(C[N@@H+](C)[C@@H](C)C2CC2)cc1 ZINC000549200839 388574163 /nfs/dbraw/zinc/57/41/63/388574163.db2.gz BLKXOPQJJWMUAT-ZDUSSCGKSA-N 1 1 247.382 3.704 20 0 BHADMO CC(C)Oc1ccc(C[N@@H+](C)C2CCCC2)cc1 ZINC000549202214 388574192 /nfs/dbraw/zinc/57/41/92/388574192.db2.gz PUCCIPGSRWJFEH-UHFFFAOYSA-N 1 1 247.382 3.848 20 0 BHADMO Cc1ccccc1C[N@H+](C)[C@H]1CC[C@@H](C)C1 ZINC000549343343 388576711 /nfs/dbraw/zinc/57/67/11/388576711.db2.gz GVFQEEBMAYSIFV-DOMZBBRYSA-N 1 1 217.356 3.615 20 0 BHADMO Cc1ccccc1C[N@H+](C)[C@@H]1CC[C@@H](C)C1 ZINC000549343344 388576299 /nfs/dbraw/zinc/57/62/99/388576299.db2.gz GVFQEEBMAYSIFV-IUODEOHRSA-N 1 1 217.356 3.615 20 0 BHADMO Cc1ccccc1C[N@H+](C)[C@@H]1CC[C@H](C)C1 ZINC000549343345 388577071 /nfs/dbraw/zinc/57/70/71/388577071.db2.gz GVFQEEBMAYSIFV-SWLSCSKDSA-N 1 1 217.356 3.615 20 0 BHADMO Cc1ccccc1C[N@H+](C)[C@H]1CC[C@H](C)C1 ZINC000549343346 388576493 /nfs/dbraw/zinc/57/64/93/388576493.db2.gz GVFQEEBMAYSIFV-WFASDCNBSA-N 1 1 217.356 3.615 20 0 BHADMO CCc1ccc(C[N@@H+](C)CC2CCCCC2)nc1 ZINC000549344498 388576720 /nfs/dbraw/zinc/57/67/20/388576720.db2.gz NNBFKIPVYAIFMZ-UHFFFAOYSA-N 1 1 246.398 3.656 20 0 BHADMO CC1(C)CC[N@@H+](Cc2sccc2Cl)C1 ZINC000549349000 388577761 /nfs/dbraw/zinc/57/77/61/388577761.db2.gz PFUUCWBOEZYVGE-UHFFFAOYSA-N 1 1 229.776 3.633 20 0 BHADMO CC1=C[C@@H](C)C[N@@H+](Cc2sccc2Cl)C1 ZINC000549349141 388577900 /nfs/dbraw/zinc/57/79/00/388577900.db2.gz UHORFUKRFKGIDK-SECBINFHSA-N 1 1 241.787 3.800 20 0 BHADMO CC1=C[C@H](C)C[N@@H+](Cc2sccc2Cl)C1 ZINC000549349148 388577972 /nfs/dbraw/zinc/57/79/72/388577972.db2.gz UHORFUKRFKGIDK-VIFPVBQESA-N 1 1 241.787 3.800 20 0 BHADMO CCCC[N@@H+](C[C@H](OC)c1ccccc1)C1CC1 ZINC000549349658 388577349 /nfs/dbraw/zinc/57/73/49/388577349.db2.gz AROXHYUXKLNZNB-INIZCTEOSA-N 1 1 247.382 3.639 20 0 BHADMO CCCC[N@@H+](C[C@@H](OC)c1ccccc1)C1CC1 ZINC000549349660 388577437 /nfs/dbraw/zinc/57/74/37/388577437.db2.gz AROXHYUXKLNZNB-MRXNPFEDSA-N 1 1 247.382 3.639 20 0 BHADMO CO[C@@H](C[N@@H+](CC(C)C)C(C)C)c1ccccc1 ZINC000549351436 388578132 /nfs/dbraw/zinc/57/81/32/388578132.db2.gz MIXMITYTLRJGFN-INIZCTEOSA-N 1 1 249.398 3.741 20 0 BHADMO CO[C@H](C[N@@H+](CC(C)C)C(C)C)c1ccccc1 ZINC000549351438 388577404 /nfs/dbraw/zinc/57/74/04/388577404.db2.gz MIXMITYTLRJGFN-MRXNPFEDSA-N 1 1 249.398 3.741 20 0 BHADMO CCc1ccc(C[N@@H+](CCC(C)C)C2CC2)nc1 ZINC000549366560 388577624 /nfs/dbraw/zinc/57/76/24/388577624.db2.gz OLZYCCRHGRZGKD-UHFFFAOYSA-N 1 1 246.398 3.655 20 0 BHADMO CCOc1ccccc1C[N@@H+](C)[C@@H]1CC[C@H](C)C1 ZINC000549366964 388578089 /nfs/dbraw/zinc/57/80/89/388578089.db2.gz DKUNWFUMSBGMDQ-DZGCQCFKSA-N 1 1 247.382 3.706 20 0 BHADMO CCOc1ccccc1C[N@@H+](C)[C@H]1CC[C@@H](C)C1 ZINC000549366965 388577315 /nfs/dbraw/zinc/57/73/15/388577315.db2.gz DKUNWFUMSBGMDQ-HIFRSBDPSA-N 1 1 247.382 3.706 20 0 BHADMO CCOc1ccccc1C[N@@H+](C)[C@@H]1CC[C@@H](C)C1 ZINC000549366966 388578026 /nfs/dbraw/zinc/57/80/26/388578026.db2.gz DKUNWFUMSBGMDQ-UKRRQHHQSA-N 1 1 247.382 3.706 20 0 BHADMO CCOc1ccccc1C[N@@H+](C)[C@H]1CC[C@H](C)C1 ZINC000549366967 388577877 /nfs/dbraw/zinc/57/78/77/388577877.db2.gz DKUNWFUMSBGMDQ-ZFWWWQNUSA-N 1 1 247.382 3.706 20 0 BHADMO CCc1ccc(C[N@H+](CC)C2CCCCC2)nc1 ZINC000549367062 388577686 /nfs/dbraw/zinc/57/76/86/388577686.db2.gz VODHYSWEUOQBEN-UHFFFAOYSA-N 1 1 246.398 3.799 20 0 BHADMO Cc1occc1C[N@H+](C)[C@H]1C=CCCCCC1 ZINC000549367081 388577977 /nfs/dbraw/zinc/57/79/77/388577977.db2.gz WZRVLYMOIPKLRA-HNNXBMFYSA-N 1 1 233.355 3.909 20 0 BHADMO Cc1occc1C[N@H+](C)[C@@H]1C=CCCCCC1 ZINC000549367082 388578041 /nfs/dbraw/zinc/57/80/41/388578041.db2.gz WZRVLYMOIPKLRA-OAHLLOKOSA-N 1 1 233.355 3.909 20 0 BHADMO CCC[N@@H+](CC)Cc1ccc(C(C)C)nc1CC ZINC000549367121 388577809 /nfs/dbraw/zinc/57/78/09/388577809.db2.gz YRGNXDVAWAHPFC-UHFFFAOYSA-N 1 1 248.414 3.999 20 0 BHADMO C[N@@H+](CCC(F)(F)F)[C@@H]1C=CCCCCC1 ZINC000549405363 388578464 /nfs/dbraw/zinc/57/84/64/388578464.db2.gz MVXIRFQTKXOXQP-LLVKDONJSA-N 1 1 235.293 3.760 20 0 BHADMO C[N@@H+](CCC(F)(F)F)[C@H]1C=CCCCCC1 ZINC000549405364 388578632 /nfs/dbraw/zinc/57/86/32/388578632.db2.gz MVXIRFQTKXOXQP-NSHDSACASA-N 1 1 235.293 3.760 20 0 BHADMO Cc1ncccc1C[N@H+](C)[C@@H](C)C1CCCCC1 ZINC000549406534 388578719 /nfs/dbraw/zinc/57/87/19/388578719.db2.gz AJZZTQQLSAHEPP-AWEZNQCLSA-N 1 1 246.398 3.791 20 0 BHADMO Cc1ncccc1C[N@H+](C)[C@H](C)C1CCCCC1 ZINC000549406535 388578724 /nfs/dbraw/zinc/57/87/24/388578724.db2.gz AJZZTQQLSAHEPP-CQSZACIVSA-N 1 1 246.398 3.791 20 0 BHADMO C[C@H](C1CCCCC1)[N@@H+](C)Cc1ccco1 ZINC000549407179 388578840 /nfs/dbraw/zinc/57/88/40/388578840.db2.gz CMCXGBKNTHMGGP-GFCCVEGCSA-N 1 1 221.344 3.680 20 0 BHADMO C[C@H](C1CCCCC1)[N@@H+](C)C[C@@H]1C[C@H]1C ZINC000549408049 388578486 /nfs/dbraw/zinc/57/84/86/388578486.db2.gz JZINPBJPAPWLCA-BZPMIXESSA-N 1 1 209.377 3.543 20 0 BHADMO C[C@H](C1CCCCC1)[N@@H+](C)C[C@H]1C[C@H]1C ZINC000549408063 388579208 /nfs/dbraw/zinc/57/92/08/388579208.db2.gz JZINPBJPAPWLCA-YRGRVCCFSA-N 1 1 209.377 3.543 20 0 BHADMO CCc1ccc(C[N@H+]2CCCC[C@H]2C(C)C)nc1 ZINC000549445857 388580369 /nfs/dbraw/zinc/58/03/69/388580369.db2.gz DEWCROMQTXBVMO-INIZCTEOSA-N 1 1 246.398 3.655 20 0 BHADMO CCc1ccc(C[N@H+]2CCCC[C@@H]2C(C)C)nc1 ZINC000549445858 388579814 /nfs/dbraw/zinc/57/98/14/388579814.db2.gz DEWCROMQTXBVMO-MRXNPFEDSA-N 1 1 246.398 3.655 20 0 BHADMO C[N@H+](Cc1cccc(F)c1Cl)CC1CCC1 ZINC000549446492 388580701 /nfs/dbraw/zinc/58/07/01/388580701.db2.gz TZHDSOYJVQGLIC-UHFFFAOYSA-N 1 1 241.737 3.711 20 0 BHADMO CCC(CC)(CC)C[N@H+]1CC[C@H](OC(F)F)C1 ZINC000549452530 388579453 /nfs/dbraw/zinc/57/94/53/388579453.db2.gz SYKJSKAIYNTZPL-NSHDSACASA-N 1 1 249.345 3.516 20 0 BHADMO CCc1ccc(C[N@@H+]2CCCCC[C@@H]2CC)nc1 ZINC000549464835 388581044 /nfs/dbraw/zinc/58/10/44/388581044.db2.gz HQYPKMOOHDXKBI-INIZCTEOSA-N 1 1 246.398 3.799 20 0 BHADMO CCc1ccc(C[N@@H+]2CCCCC[C@H]2CC)nc1 ZINC000549464836 388581822 /nfs/dbraw/zinc/58/18/22/388581822.db2.gz HQYPKMOOHDXKBI-MRXNPFEDSA-N 1 1 246.398 3.799 20 0 BHADMO C[C@@H]1CC[N@H+]([C@@H]2C=CCCCCC2)[C@H]1C ZINC000549470102 388581590 /nfs/dbraw/zinc/58/15/90/388581590.db2.gz VSDLRAPSTWGEQX-HZSPNIEDSA-N 1 1 207.361 3.606 20 0 BHADMO C[C@@H]1CC[N@H+]([C@H]2C=CCCCCC2)[C@@H]1C ZINC000549470103 388581336 /nfs/dbraw/zinc/58/13/36/388581336.db2.gz VSDLRAPSTWGEQX-MCIONIFRSA-N 1 1 207.361 3.606 20 0 BHADMO C[C@@H]1CC[N@H+]([C@@H]2C=CCCCCC2)[C@@H]1C ZINC000549470104 388580989 /nfs/dbraw/zinc/58/09/89/388580989.db2.gz VSDLRAPSTWGEQX-MGPQQGTHSA-N 1 1 207.361 3.606 20 0 BHADMO C[C@@H]1CC[N@H+]([C@H]2C=CCCCCC2)[C@H]1C ZINC000549470105 388581413 /nfs/dbraw/zinc/58/14/13/388581413.db2.gz VSDLRAPSTWGEQX-RDBSUJKOSA-N 1 1 207.361 3.606 20 0 BHADMO CCC[C@H]1CCC[N@@H+](Cc2ccc(CC)cn2)C1 ZINC000549471425 388581269 /nfs/dbraw/zinc/58/12/69/388581269.db2.gz LHYBAOHBAZGORP-HNNXBMFYSA-N 1 1 246.398 3.656 20 0 BHADMO CCC[C@@H]1CCC[N@@H+](Cc2ccc(CC)cn2)C1 ZINC000549471433 388581608 /nfs/dbraw/zinc/58/16/08/388581608.db2.gz LHYBAOHBAZGORP-OAHLLOKOSA-N 1 1 246.398 3.656 20 0 BHADMO C[C@@H](C[N@@H+](C)Cc1cccnc1)C1CCCCC1 ZINC000549531504 388583580 /nfs/dbraw/zinc/58/35/80/388583580.db2.gz CPKTXWZHVRNEAR-AWEZNQCLSA-N 1 1 246.398 3.730 20 0 BHADMO C[C@H](C[N@@H+](C)Cc1cccnc1)C1CCCCC1 ZINC000549531505 388583143 /nfs/dbraw/zinc/58/31/43/388583143.db2.gz CPKTXWZHVRNEAR-CQSZACIVSA-N 1 1 246.398 3.730 20 0 BHADMO CCC[C@H]1CCCC[N@H+]1Cc1ccc(CC)cn1 ZINC000549545453 388584725 /nfs/dbraw/zinc/58/47/25/388584725.db2.gz TXUYIRVMNZQNRC-INIZCTEOSA-N 1 1 246.398 3.799 20 0 BHADMO CCC[C@@H]1CCCC[N@H+]1Cc1ccc(CC)cn1 ZINC000549545454 388584642 /nfs/dbraw/zinc/58/46/42/388584642.db2.gz TXUYIRVMNZQNRC-MRXNPFEDSA-N 1 1 246.398 3.799 20 0 BHADMO CCc1ccc(C[N@H+]2C[C@H](C)CC(C)(C)C2)nc1 ZINC000549545506 388584745 /nfs/dbraw/zinc/58/47/45/388584745.db2.gz XIWWLNQGAGLOGC-CYBMUJFWSA-N 1 1 246.398 3.512 20 0 BHADMO CCc1ccc(C[N@H+]2C[C@@H](C)CC(C)(C)C2)nc1 ZINC000549545507 388584019 /nfs/dbraw/zinc/58/40/19/388584019.db2.gz XIWWLNQGAGLOGC-ZDUSSCGKSA-N 1 1 246.398 3.512 20 0 BHADMO CC[N@@H+](CCCc1ccccc1)C1CCCC1 ZINC000549547926 388584720 /nfs/dbraw/zinc/58/47/20/388584720.db2.gz QEUUFIVYKLHVMV-UHFFFAOYSA-N 1 1 231.383 3.884 20 0 BHADMO Cc1ccc(C)c(C[N@H+](CC2CC2)C(C)C)c1 ZINC000549558752 583152610 /nfs/dbraw/zinc/15/26/10/583152610.db2.gz OABGBOJIWHZHFO-UHFFFAOYSA-N 1 1 231.383 3.924 20 0 BHADMO C[C@H]1CC[N@H+]([C@H]2C=CCCCCC2)CCS1 ZINC000549611768 388585442 /nfs/dbraw/zinc/58/54/42/388585442.db2.gz FDENRFPYUOWYLH-KBPBESRZSA-N 1 1 239.428 3.703 20 0 BHADMO C[C@@H]1CC[N@H+]([C@H]2C=CCCCCC2)CCS1 ZINC000549611769 388585406 /nfs/dbraw/zinc/58/54/06/388585406.db2.gz FDENRFPYUOWYLH-KGLIPLIRSA-N 1 1 239.428 3.703 20 0 BHADMO C[C@H]1CC[N@H+]([C@@H]2C=CCCCCC2)CCS1 ZINC000549611770 388585631 /nfs/dbraw/zinc/58/56/31/388585631.db2.gz FDENRFPYUOWYLH-UONOGXRCSA-N 1 1 239.428 3.703 20 0 BHADMO C[C@@H]1CC[N@H+]([C@@H]2C=CCCCCC2)CCS1 ZINC000549611771 388585303 /nfs/dbraw/zinc/58/53/03/388585303.db2.gz FDENRFPYUOWYLH-ZIAGYGMSSA-N 1 1 239.428 3.703 20 0 BHADMO CC1=CCC[N@@H+](Cc2cccc(F)c2Cl)C1 ZINC000549674665 388587134 /nfs/dbraw/zinc/58/71/34/388587134.db2.gz QKRPDTSIMNDWEI-UHFFFAOYSA-N 1 1 239.721 3.631 20 0 BHADMO CC1=CCC[N@H+](Cc2cccc(F)c2Cl)C1 ZINC000549674665 388587131 /nfs/dbraw/zinc/58/71/31/388587131.db2.gz QKRPDTSIMNDWEI-UHFFFAOYSA-N 1 1 239.721 3.631 20 0 BHADMO CC[N@@H+](Cc1ccc(COC)cc1)CC(C)(C)C ZINC000549718108 388588866 /nfs/dbraw/zinc/58/88/66/388588866.db2.gz WGOZZLSQLHNUGY-UHFFFAOYSA-N 1 1 249.398 3.701 20 0 BHADMO CCCC[N@@H+](C)Cc1cccc(F)c1Cl ZINC000549750396 388589250 /nfs/dbraw/zinc/58/92/50/388589250.db2.gz CJTAYUXOQVUDLY-UHFFFAOYSA-N 1 1 229.726 3.711 20 0 BHADMO CC[N@H+](Cc1ccc(C(C)C)nc1C)CC(C)C ZINC000549770383 388590033 /nfs/dbraw/zinc/59/00/33/388590033.db2.gz BAEDHSBCHIDSOF-UHFFFAOYSA-N 1 1 248.414 3.991 20 0 BHADMO CCCC[N@@H+](C)Cc1ccccc1OCC(C)C ZINC000549781010 388591772 /nfs/dbraw/zinc/59/17/72/388591772.db2.gz CZHUTDHKBJGRHR-UHFFFAOYSA-N 1 1 249.398 3.953 20 0 BHADMO CC(C)COc1ccccc1C[N@@H+](C)CC1CC1 ZINC000549781360 388591574 /nfs/dbraw/zinc/59/15/74/388591574.db2.gz HQWVUGCNMNDVON-UHFFFAOYSA-N 1 1 247.382 3.563 20 0 BHADMO CCC[N@@H+](Cc1cccc(F)c1Cl)C1CC1 ZINC000549806103 388591789 /nfs/dbraw/zinc/59/17/89/388591789.db2.gz UKXIKIAQDWKUBW-UHFFFAOYSA-N 1 1 241.737 3.854 20 0 BHADMO CCc1ccc(C[N@@H+](C2CC2)C2CCCC2)nc1 ZINC000549821963 388592561 /nfs/dbraw/zinc/59/25/61/388592561.db2.gz KQKBYIBLKYFRMB-UHFFFAOYSA-N 1 1 244.382 3.551 20 0 BHADMO CC[N@@H+](CC1CC1)[C@H]1C=CCCCCC1 ZINC000549844143 388593012 /nfs/dbraw/zinc/59/30/12/388593012.db2.gz FZMFFPBEXXGKEN-AWEZNQCLSA-N 1 1 207.361 3.607 20 0 BHADMO CC[N@@H+](CC1CC1)[C@@H]1C=CCCCCC1 ZINC000549844144 388592469 /nfs/dbraw/zinc/59/24/69/388592469.db2.gz FZMFFPBEXXGKEN-CQSZACIVSA-N 1 1 207.361 3.607 20 0 BHADMO CC[C@H]1CCCCC[N@H+]1CCC1(OC)CCC1 ZINC000549859835 388593600 /nfs/dbraw/zinc/59/36/00/388593600.db2.gz CAIPRVPPYMJYFB-AWEZNQCLSA-N 1 1 239.403 3.600 20 0 BHADMO CC[C@@H]1CCCCC[N@H+]1CCC1(OC)CCC1 ZINC000549859836 388593791 /nfs/dbraw/zinc/59/37/91/388593791.db2.gz CAIPRVPPYMJYFB-CQSZACIVSA-N 1 1 239.403 3.600 20 0 BHADMO C[C@H](Cc1ccsc1)[N@@H+](C)[C@H]1CC[C@@H](C)C1 ZINC000549865547 388594207 /nfs/dbraw/zinc/59/42/07/388594207.db2.gz ZVLAPUYGRPPGGI-BZPMIXESSA-N 1 1 237.412 3.800 20 0 BHADMO C[C@@H](Cc1ccsc1)[N@@H+](C)[C@H]1CC[C@@H](C)C1 ZINC000549865566 388593841 /nfs/dbraw/zinc/59/38/41/388593841.db2.gz ZVLAPUYGRPPGGI-DYEKYZERSA-N 1 1 237.412 3.800 20 0 BHADMO C[C@@H](Cc1ccsc1)[N@@H+](C)[C@@H]1CC[C@@H](C)C1 ZINC000549865568 388593722 /nfs/dbraw/zinc/59/37/22/388593722.db2.gz ZVLAPUYGRPPGGI-MBNYWOFBSA-N 1 1 237.412 3.800 20 0 BHADMO C[C@H](Cc1ccsc1)[N@@H+](C)[C@@H]1CC[C@@H](C)C1 ZINC000549865570 388593677 /nfs/dbraw/zinc/59/36/77/388593677.db2.gz ZVLAPUYGRPPGGI-YRGRVCCFSA-N 1 1 237.412 3.800 20 0 BHADMO C[N@@H+](CCC1CC1)[C@H]1C=CCCCCC1 ZINC000549916674 388594487 /nfs/dbraw/zinc/59/44/87/388594487.db2.gz XWVYBJRFWGTXSL-AWEZNQCLSA-N 1 1 207.361 3.607 20 0 BHADMO C[N@@H+](CCC1CC1)[C@@H]1C=CCCCCC1 ZINC000549916678 388594805 /nfs/dbraw/zinc/59/48/05/388594805.db2.gz XWVYBJRFWGTXSL-CQSZACIVSA-N 1 1 207.361 3.607 20 0 BHADMO C[C@@H](C[N@@H+](C)[C@@H]1CCSC1)C1CCCCC1 ZINC000549921131 388594970 /nfs/dbraw/zinc/59/49/70/388594970.db2.gz MMGDJAGVLDUVIH-GXTWGEPZSA-N 1 1 241.444 3.640 20 0 BHADMO C[C@@H](C[N@@H+](C)[C@H]1CCSC1)C1CCCCC1 ZINC000549921132 388594885 /nfs/dbraw/zinc/59/48/85/388594885.db2.gz MMGDJAGVLDUVIH-JSGCOSHPSA-N 1 1 241.444 3.640 20 0 BHADMO C[C@H](C[N@@H+](C)[C@H]1CCSC1)C1CCCCC1 ZINC000549921133 388594881 /nfs/dbraw/zinc/59/48/81/388594881.db2.gz MMGDJAGVLDUVIH-OCCSQVGLSA-N 1 1 241.444 3.640 20 0 BHADMO C[C@H](C[N@@H+](C)[C@@H]1CCSC1)C1CCCCC1 ZINC000549921134 388594634 /nfs/dbraw/zinc/59/46/34/388594634.db2.gz MMGDJAGVLDUVIH-TZMCWYRMSA-N 1 1 241.444 3.640 20 0 BHADMO C[C@@H]1C[N@H+]([C@H]2CCc3ccc(Cl)cc32)[C@H]1C ZINC000549921424 388595013 /nfs/dbraw/zinc/59/50/13/388595013.db2.gz FYBCEHUDAAFBQP-BFVZDQMLSA-N 1 1 235.758 3.668 20 0 BHADMO C[C@@H]1C[N@H+]([C@@H]2CCc3ccc(Cl)cc32)[C@@H]1C ZINC000549921425 388594890 /nfs/dbraw/zinc/59/48/90/388594890.db2.gz FYBCEHUDAAFBQP-GPCCPHFNSA-N 1 1 235.758 3.668 20 0 BHADMO C[C@@H]1C[N@H+]([C@@H]2CCc3ccc(Cl)cc32)[C@H]1C ZINC000549921426 388594424 /nfs/dbraw/zinc/59/44/24/388594424.db2.gz FYBCEHUDAAFBQP-ISTVAULSSA-N 1 1 235.758 3.668 20 0 BHADMO C[C@@H]1C[N@H+]([C@H]2CCc3ccc(Cl)cc32)[C@@H]1C ZINC000549921427 388595061 /nfs/dbraw/zinc/59/50/61/388595061.db2.gz FYBCEHUDAAFBQP-RULNRJAQSA-N 1 1 235.758 3.668 20 0 BHADMO CC[C@H](c1ccc(F)cc1)[N@H+]1C[C@H](C)[C@@H]1C ZINC000549921636 388594759 /nfs/dbraw/zinc/59/47/59/388594759.db2.gz JDHIKLZWYGFRTP-COPLHBTASA-N 1 1 221.319 3.617 20 0 BHADMO CC[C@H](c1ccc(F)cc1)[N@H+]1C[C@@H](C)[C@H]1C ZINC000549921637 388594655 /nfs/dbraw/zinc/59/46/55/388594655.db2.gz JDHIKLZWYGFRTP-JTNHKYCSSA-N 1 1 221.319 3.617 20 0 BHADMO CC[C@H](c1ccc(F)cc1)[N@H+]1C[C@H](C)[C@H]1C ZINC000549921638 388594445 /nfs/dbraw/zinc/59/44/45/388594445.db2.gz JDHIKLZWYGFRTP-MISXGVKJSA-N 1 1 221.319 3.617 20 0 BHADMO CC[C@H](c1ccc(F)cc1)[N@H+]1C[C@@H](C)[C@@H]1C ZINC000549921639 388594798 /nfs/dbraw/zinc/59/47/98/388594798.db2.gz JDHIKLZWYGFRTP-UHIISALHSA-N 1 1 221.319 3.617 20 0 BHADMO CC1=CC[N@@H+](Cc2cccc(F)c2Cl)CC1 ZINC000549921804 388594582 /nfs/dbraw/zinc/59/45/82/388594582.db2.gz MLVZTWVGCDASGF-UHFFFAOYSA-N 1 1 239.721 3.631 20 0 BHADMO CC1=CC[N@H+](Cc2cccc(F)c2Cl)CC1 ZINC000549921804 388594579 /nfs/dbraw/zinc/59/45/79/388594579.db2.gz MLVZTWVGCDASGF-UHFFFAOYSA-N 1 1 239.721 3.631 20 0 BHADMO C[C@H](c1ccc(Cl)cc1)[N@H+]1C[C@@H](C)[C@H]1C ZINC000549923553 388595511 /nfs/dbraw/zinc/59/55/11/388595511.db2.gz GYJVQNWHSBLIFY-GMTAPVOTSA-N 1 1 223.747 3.741 20 0 BHADMO C[C@@H](c1ccc(Cl)cc1)[N@H+]1C[C@@H](C)[C@H]1C ZINC000549923559 388595423 /nfs/dbraw/zinc/59/54/23/388595423.db2.gz GYJVQNWHSBLIFY-MXWKQRLJSA-N 1 1 223.747 3.741 20 0 BHADMO C[C@H](c1ccc(Cl)cc1)[N@H+]1C[C@@H](C)[C@@H]1C ZINC000549923560 388595503 /nfs/dbraw/zinc/59/55/03/388595503.db2.gz GYJVQNWHSBLIFY-OUAUKWLOSA-N 1 1 223.747 3.741 20 0 BHADMO C[C@@H](c1ccc(Cl)cc1)[N@H+]1C[C@@H](C)[C@@H]1C ZINC000549923561 388595331 /nfs/dbraw/zinc/59/53/31/388595331.db2.gz GYJVQNWHSBLIFY-VWYCJHECSA-N 1 1 223.747 3.741 20 0 BHADMO C[C@@H](c1cccc(Cl)c1F)[N@H+]1C[C@@H](C)[C@H]1C ZINC000549931450 388595899 /nfs/dbraw/zinc/59/58/99/388595899.db2.gz PXZOATUPSRRODD-BBBLOLIVSA-N 1 1 241.737 3.880 20 0 BHADMO C[C@@H](c1cccc(Cl)c1F)[N@@H+]1C[C@@H](C)[C@H]1C ZINC000549931450 388595898 /nfs/dbraw/zinc/59/58/98/388595898.db2.gz PXZOATUPSRRODD-BBBLOLIVSA-N 1 1 241.737 3.880 20 0 BHADMO C[C@H](c1cccc(Cl)c1F)[N@H+]1C[C@@H](C)[C@@H]1C ZINC000549931472 388595470 /nfs/dbraw/zinc/59/54/70/388595470.db2.gz PXZOATUPSRRODD-KXUCPTDWSA-N 1 1 241.737 3.880 20 0 BHADMO C[C@H](c1cccc(Cl)c1F)[N@@H+]1C[C@@H](C)[C@@H]1C ZINC000549931472 388595467 /nfs/dbraw/zinc/59/54/67/388595467.db2.gz PXZOATUPSRRODD-KXUCPTDWSA-N 1 1 241.737 3.880 20 0 BHADMO C[C@H](c1cccc(Cl)c1F)[N@H+]1C[C@@H](C)[C@H]1C ZINC000549931474 388595577 /nfs/dbraw/zinc/59/55/77/388595577.db2.gz PXZOATUPSRRODD-OPRDCNLKSA-N 1 1 241.737 3.880 20 0 BHADMO C[C@H](c1cccc(Cl)c1F)[N@@H+]1C[C@@H](C)[C@H]1C ZINC000549931474 388595575 /nfs/dbraw/zinc/59/55/75/388595575.db2.gz PXZOATUPSRRODD-OPRDCNLKSA-N 1 1 241.737 3.880 20 0 BHADMO C[C@@H](c1cccc(Cl)c1F)[N@H+]1C[C@@H](C)[C@@H]1C ZINC000549931477 388595793 /nfs/dbraw/zinc/59/57/93/388595793.db2.gz PXZOATUPSRRODD-UTLUCORTSA-N 1 1 241.737 3.880 20 0 BHADMO C[C@@H](c1cccc(Cl)c1F)[N@@H+]1C[C@@H](C)[C@@H]1C ZINC000549931477 388595792 /nfs/dbraw/zinc/59/57/92/388595792.db2.gz PXZOATUPSRRODD-UTLUCORTSA-N 1 1 241.737 3.880 20 0 BHADMO CCCCC[N@@H+](C)Cc1c(F)cccc1F ZINC000549947547 388595235 /nfs/dbraw/zinc/59/52/35/388595235.db2.gz USXDGTUVLBOELG-UHFFFAOYSA-N 1 1 227.298 3.587 20 0 BHADMO CCCCC[N@H+](C)Cc1c(F)cccc1F ZINC000549947547 388595234 /nfs/dbraw/zinc/59/52/34/388595234.db2.gz USXDGTUVLBOELG-UHFFFAOYSA-N 1 1 227.298 3.587 20 0 BHADMO CCCC[C@@H](C)[N@@H+](CCCC)Cc1ccno1 ZINC000549988490 388596639 /nfs/dbraw/zinc/59/66/39/388596639.db2.gz TUQAOTGQDRJPFX-CYBMUJFWSA-N 1 1 238.375 3.855 20 0 BHADMO CCCC[C@H](C)[N@@H+](CCCC)Cc1ccno1 ZINC000549988491 388596885 /nfs/dbraw/zinc/59/68/85/388596885.db2.gz TUQAOTGQDRJPFX-ZDUSSCGKSA-N 1 1 238.375 3.855 20 0 BHADMO CCCC[C@@H](C)[N@@H+](CCCC)Cc1c[nH]cn1 ZINC000549988726 388596381 /nfs/dbraw/zinc/59/63/81/388596381.db2.gz UXTQWECEUXJOCD-CYBMUJFWSA-N 1 1 237.391 3.591 20 0 BHADMO CCCC[C@@H](C)[N@H+](CCCC)Cc1c[nH]cn1 ZINC000549988726 388596380 /nfs/dbraw/zinc/59/63/80/388596380.db2.gz UXTQWECEUXJOCD-CYBMUJFWSA-N 1 1 237.391 3.591 20 0 BHADMO CCCC[C@@H](C)[N@@H+](CCCC)Cc1cnc[nH]1 ZINC000549988726 388596377 /nfs/dbraw/zinc/59/63/77/388596377.db2.gz UXTQWECEUXJOCD-CYBMUJFWSA-N 1 1 237.391 3.591 20 0 BHADMO CCCC[C@H](C)[N@@H+](CCCC)Cc1c[nH]cn1 ZINC000549988727 388597115 /nfs/dbraw/zinc/59/71/15/388597115.db2.gz UXTQWECEUXJOCD-ZDUSSCGKSA-N 1 1 237.391 3.591 20 0 BHADMO CCCC[C@H](C)[N@H+](CCCC)Cc1c[nH]cn1 ZINC000549988727 388597114 /nfs/dbraw/zinc/59/71/14/388597114.db2.gz UXTQWECEUXJOCD-ZDUSSCGKSA-N 1 1 237.391 3.591 20 0 BHADMO CCCC[C@H](C)[N@@H+](CCCC)Cc1cnc[nH]1 ZINC000549988727 388597111 /nfs/dbraw/zinc/59/71/11/388597111.db2.gz UXTQWECEUXJOCD-ZDUSSCGKSA-N 1 1 237.391 3.591 20 0 BHADMO COCc1ccc(C[N@@H+](C)C2(C)CCCC2)cc1 ZINC000550000095 388596668 /nfs/dbraw/zinc/59/66/68/388596668.db2.gz NYZZBDXRUZDTQQ-UHFFFAOYSA-N 1 1 247.382 3.598 20 0 BHADMO CC[C@@H](c1ccc(F)cc1)[N@H+]1CCC[C@H]1CF ZINC000550028089 388596674 /nfs/dbraw/zinc/59/66/74/388596674.db2.gz BJFIDMWYBCEEDK-KBPBESRZSA-N 1 1 239.309 3.711 20 0 BHADMO CC[C@@H](c1ccc(F)cc1)[N@H+]1CCC[C@@H]1CF ZINC000550028091 388596616 /nfs/dbraw/zinc/59/66/16/388596616.db2.gz BJFIDMWYBCEEDK-KGLIPLIRSA-N 1 1 239.309 3.711 20 0 BHADMO CC[C@H](c1ccc(F)cc1)[N@H+]1CCC[C@H]1CF ZINC000550028093 388596301 /nfs/dbraw/zinc/59/63/01/388596301.db2.gz BJFIDMWYBCEEDK-UONOGXRCSA-N 1 1 239.309 3.711 20 0 BHADMO CC[C@H](c1ccc(F)cc1)[N@H+]1CCC[C@@H]1CF ZINC000550028094 388596819 /nfs/dbraw/zinc/59/68/19/388596819.db2.gz BJFIDMWYBCEEDK-ZIAGYGMSSA-N 1 1 239.309 3.711 20 0 BHADMO C[C@@H](c1cccc(Cl)c1)[N@H+]1CCC[C@H]1CF ZINC000550028179 388596198 /nfs/dbraw/zinc/59/61/98/388596198.db2.gz DEUVETVUJGYLGJ-GWCFXTLKSA-N 1 1 241.737 3.835 20 0 BHADMO C[C@@H](c1cccc(Cl)c1)[N@@H+]1CCC[C@H]1CF ZINC000550028179 388596197 /nfs/dbraw/zinc/59/61/97/388596197.db2.gz DEUVETVUJGYLGJ-GWCFXTLKSA-N 1 1 241.737 3.835 20 0 BHADMO C[C@@H](c1cccc(Cl)c1)[N@H+]1CCC[C@@H]1CF ZINC000550028180 388596963 /nfs/dbraw/zinc/59/69/63/388596963.db2.gz DEUVETVUJGYLGJ-GXFFZTMASA-N 1 1 241.737 3.835 20 0 BHADMO C[C@@H](c1cccc(Cl)c1)[N@@H+]1CCC[C@@H]1CF ZINC000550028180 388596960 /nfs/dbraw/zinc/59/69/60/388596960.db2.gz DEUVETVUJGYLGJ-GXFFZTMASA-N 1 1 241.737 3.835 20 0 BHADMO C[C@H](c1cccc(Cl)c1)[N@H+]1CCC[C@H]1CF ZINC000550028181 388596827 /nfs/dbraw/zinc/59/68/27/388596827.db2.gz DEUVETVUJGYLGJ-MFKMUULPSA-N 1 1 241.737 3.835 20 0 BHADMO C[C@H](c1cccc(Cl)c1)[N@@H+]1CCC[C@H]1CF ZINC000550028181 388596825 /nfs/dbraw/zinc/59/68/25/388596825.db2.gz DEUVETVUJGYLGJ-MFKMUULPSA-N 1 1 241.737 3.835 20 0 BHADMO C[C@H](c1cccc(Cl)c1)[N@H+]1CCC[C@@H]1CF ZINC000550028182 388597021 /nfs/dbraw/zinc/59/70/21/388597021.db2.gz DEUVETVUJGYLGJ-ZWNOBZJWSA-N 1 1 241.737 3.835 20 0 BHADMO C[C@H](c1cccc(Cl)c1)[N@@H+]1CCC[C@@H]1CF ZINC000550028182 388597018 /nfs/dbraw/zinc/59/70/18/388597018.db2.gz DEUVETVUJGYLGJ-ZWNOBZJWSA-N 1 1 241.737 3.835 20 0 BHADMO CCCc1ccc(C[N@H+]2CCC[C@H]2CF)cc1 ZINC000550028694 388596692 /nfs/dbraw/zinc/59/66/92/388596692.db2.gz IRYYMOGKWYGVPQ-HNNXBMFYSA-N 1 1 235.346 3.573 20 0 BHADMO CCCc1ccc(C[N@H+]2CCC[C@@H]2CF)cc1 ZINC000550028695 388596610 /nfs/dbraw/zinc/59/66/10/388596610.db2.gz IRYYMOGKWYGVPQ-OAHLLOKOSA-N 1 1 235.346 3.573 20 0 BHADMO c1cc(CCC[N@H+]2CC[C@@H](CC3CC3)C2)cs1 ZINC000550048633 388597388 /nfs/dbraw/zinc/59/73/88/388597388.db2.gz HEPPRDFYFYPWSO-HNNXBMFYSA-N 1 1 249.423 3.803 20 0 BHADMO c1cc(CCC[N@H+]2CC[C@H](CC3CC3)C2)cs1 ZINC000550048639 388597481 /nfs/dbraw/zinc/59/74/81/388597481.db2.gz HEPPRDFYFYPWSO-OAHLLOKOSA-N 1 1 249.423 3.803 20 0 BHADMO CCc1ccc(C[N@H+](CC)C(CC)CC)nc1 ZINC000550105078 388598252 /nfs/dbraw/zinc/59/82/52/388598252.db2.gz IGGXBNMKAYMTMO-UHFFFAOYSA-N 1 1 234.387 3.655 20 0 BHADMO CCc1ccc(C[N@H+](CC)CC(C)(C)C)nc1 ZINC000550105685 388598518 /nfs/dbraw/zinc/59/85/18/388598518.db2.gz RKOPXZGIAXBHJJ-UHFFFAOYSA-N 1 1 234.387 3.512 20 0 BHADMO C[C@@H]1[C@@H](C)C[N@H+]1CC1CCC(C(F)(F)F)CC1 ZINC000550305924 388605785 /nfs/dbraw/zinc/60/57/85/388605785.db2.gz LOZIGKWMTRMPMS-DMOGRIERSA-N 1 1 249.320 3.695 20 0 BHADMO C[C@H]1C[N@@H+](CC2CCC(C(F)(F)F)CC2)[C@H]1C ZINC000550305927 388605436 /nfs/dbraw/zinc/60/54/36/388605436.db2.gz LOZIGKWMTRMPMS-JYBOHDQNSA-N 1 1 249.320 3.695 20 0 BHADMO C[C@@H]1C[N@@H+](CC2CCC(C(F)(F)F)CC2)[C@H]1C ZINC000550305928 388605280 /nfs/dbraw/zinc/60/52/80/388605280.db2.gz LOZIGKWMTRMPMS-QKEWWQLBSA-N 1 1 249.320 3.695 20 0 BHADMO C[C@@H]1C[N@@H+](CC2CCC(C(F)(F)F)CC2)[C@@H]1C ZINC000550305929 388605766 /nfs/dbraw/zinc/60/57/66/388605766.db2.gz LOZIGKWMTRMPMS-QYNFOATHSA-N 1 1 249.320 3.695 20 0 BHADMO CCc1nc(C(C)C)ccc1C[N@H+]1C[C@@H](C)[C@H]1C ZINC000550306107 388605450 /nfs/dbraw/zinc/60/54/50/388605450.db2.gz QDSNVNUURJLAMJ-CHWSQXEVSA-N 1 1 246.398 3.608 20 0 BHADMO CCc1nc(C(C)C)ccc1C[N@H+]1C[C@@H](C)[C@@H]1C ZINC000550306108 388605422 /nfs/dbraw/zinc/60/54/22/388605422.db2.gz QDSNVNUURJLAMJ-OLZOCXBDSA-N 1 1 246.398 3.608 20 0 BHADMO CCc1nc(C(C)C)ccc1C[N@H+]1C[C@H](C)[C@H]1C ZINC000550306109 388605822 /nfs/dbraw/zinc/60/58/22/388605822.db2.gz QDSNVNUURJLAMJ-QWHCGFSZSA-N 1 1 246.398 3.608 20 0 BHADMO CCc1nc(C(C)C)ccc1C[N@H+]1C[C@H](C)[C@@H]1C ZINC000550306110 388605276 /nfs/dbraw/zinc/60/52/76/388605276.db2.gz QDSNVNUURJLAMJ-STQMWFEESA-N 1 1 246.398 3.608 20 0 BHADMO FC[C@H]1CCC[N@H+]1Cc1cc2ccccc2s1 ZINC000550392972 388607395 /nfs/dbraw/zinc/60/73/95/388607395.db2.gz PJZVSLQVJKXFDF-GFCCVEGCSA-N 1 1 249.354 3.835 20 0 BHADMO FC[C@@H]1CCC[N@H+]1Cc1cc2ccccc2s1 ZINC000550392973 388607211 /nfs/dbraw/zinc/60/72/11/388607211.db2.gz PJZVSLQVJKXFDF-LBPRGKRZSA-N 1 1 249.354 3.835 20 0 BHADMO C[C@H](c1ccccc1Cl)[N@H+]1CCC[C@@H]1CF ZINC000550393012 388607189 /nfs/dbraw/zinc/60/71/89/388607189.db2.gz QPCFGRFXFDZKIK-GHMZBOCLSA-N 1 1 241.737 3.835 20 0 BHADMO C[C@H](c1ccccc1Cl)[N@@H+]1CCC[C@@H]1CF ZINC000550393012 388607185 /nfs/dbraw/zinc/60/71/85/388607185.db2.gz QPCFGRFXFDZKIK-GHMZBOCLSA-N 1 1 241.737 3.835 20 0 BHADMO C[C@H](c1ccccc1Cl)[N@H+]1CCC[C@H]1CF ZINC000550393039 388607470 /nfs/dbraw/zinc/60/74/70/388607470.db2.gz QPCFGRFXFDZKIK-MNOVXSKESA-N 1 1 241.737 3.835 20 0 BHADMO C[C@H](c1ccccc1Cl)[N@@H+]1CCC[C@H]1CF ZINC000550393039 388607467 /nfs/dbraw/zinc/60/74/67/388607467.db2.gz QPCFGRFXFDZKIK-MNOVXSKESA-N 1 1 241.737 3.835 20 0 BHADMO C[C@@H](c1ccccc1Cl)[N@H+]1CCC[C@H]1CF ZINC000550393041 388607403 /nfs/dbraw/zinc/60/74/03/388607403.db2.gz QPCFGRFXFDZKIK-QWRGUYRKSA-N 1 1 241.737 3.835 20 0 BHADMO C[C@@H](c1ccccc1Cl)[N@@H+]1CCC[C@H]1CF ZINC000550393041 388607402 /nfs/dbraw/zinc/60/74/02/388607402.db2.gz QPCFGRFXFDZKIK-QWRGUYRKSA-N 1 1 241.737 3.835 20 0 BHADMO C[C@@H](c1ccccc1Cl)[N@H+]1CCC[C@@H]1CF ZINC000550393043 388607552 /nfs/dbraw/zinc/60/75/52/388607552.db2.gz QPCFGRFXFDZKIK-WDEREUQCSA-N 1 1 241.737 3.835 20 0 BHADMO C[C@@H](c1ccccc1Cl)[N@@H+]1CCC[C@@H]1CF ZINC000550393043 388607550 /nfs/dbraw/zinc/60/75/50/388607550.db2.gz QPCFGRFXFDZKIK-WDEREUQCSA-N 1 1 241.737 3.835 20 0 BHADMO FC[C@@H]1CCC[N@H+]1Cc1ccc2ccccc2c1 ZINC000550409570 388607457 /nfs/dbraw/zinc/60/74/57/388607457.db2.gz OUEIKXFCZWDXAY-INIZCTEOSA-N 1 1 243.325 3.774 20 0 BHADMO FC[C@H]1CCC[N@H+]1Cc1ccc2ccccc2c1 ZINC000550409571 388607952 /nfs/dbraw/zinc/60/79/52/388607952.db2.gz OUEIKXFCZWDXAY-MRXNPFEDSA-N 1 1 243.325 3.774 20 0 BHADMO C[C@H](C[N@H+]1CC(C)(C)[C@@H]2CCC[C@H]21)C(F)(F)F ZINC000550444030 388608569 /nfs/dbraw/zinc/60/85/69/388608569.db2.gz KARCAGWHULTOMQ-GMTAPVOTSA-N 1 1 249.320 3.695 20 0 BHADMO C[C@H](C[N@H+]1CC(C)(C)[C@@H]2CCC[C@@H]21)C(F)(F)F ZINC000550444033 388608564 /nfs/dbraw/zinc/60/85/64/388608564.db2.gz KARCAGWHULTOMQ-MXWKQRLJSA-N 1 1 249.320 3.695 20 0 BHADMO C[C@H](C[N@H+]1CC(C)(C)[C@H]2CCC[C@H]21)C(F)(F)F ZINC000550444034 388608258 /nfs/dbraw/zinc/60/82/58/388608258.db2.gz KARCAGWHULTOMQ-OUAUKWLOSA-N 1 1 249.320 3.695 20 0 BHADMO C[C@H](C[N@H+]1CC(C)(C)[C@H]2CCC[C@@H]21)C(F)(F)F ZINC000550444035 388609063 /nfs/dbraw/zinc/60/90/63/388609063.db2.gz KARCAGWHULTOMQ-VWYCJHECSA-N 1 1 249.320 3.695 20 0 BHADMO CCCC[N@@H+](CCC(C)(C)O)C1CCCCC1 ZINC000550524858 388610852 /nfs/dbraw/zinc/61/08/52/388610852.db2.gz MZUWYEZXWSZVDM-UHFFFAOYSA-N 1 1 241.419 3.582 20 0 BHADMO CCC[N@H+](Cc1cccc(OC)c1)CC(C)C ZINC000550583591 388611337 /nfs/dbraw/zinc/61/13/37/388611337.db2.gz SRBUGFFDBOSPIN-UHFFFAOYSA-N 1 1 235.371 3.563 20 0 BHADMO Cc1cc(C)c(C[N@H+](C)[C@H](C)C2CC2)c(C)c1 ZINC000550675028 388613537 /nfs/dbraw/zinc/61/35/37/388613537.db2.gz RFFUAMCNUOWVQW-CQSZACIVSA-N 1 1 231.383 3.842 20 0 BHADMO CCCOc1cccc(C[N@@H+](C)[C@H](C)C2CC2)c1 ZINC000550678187 388613424 /nfs/dbraw/zinc/61/34/24/388613424.db2.gz CORWQZVOFIZKDU-CYBMUJFWSA-N 1 1 247.382 3.706 20 0 BHADMO CCCOc1cccc(C[N@@H+](C)[C@@H](C)C2CC2)c1 ZINC000550678189 388613790 /nfs/dbraw/zinc/61/37/90/388613790.db2.gz CORWQZVOFIZKDU-ZDUSSCGKSA-N 1 1 247.382 3.706 20 0 BHADMO C[N@@H+](C[C@@H]1CCC(F)(F)C1)C1CCCCC1 ZINC000550679998 388613621 /nfs/dbraw/zinc/61/36/21/388613621.db2.gz FMPCUTAQGFCVSX-LLVKDONJSA-N 1 1 231.330 3.686 20 0 BHADMO C[N@@H+](C[C@H]1CCC(F)(F)C1)C1CCCCC1 ZINC000550679999 388613387 /nfs/dbraw/zinc/61/33/87/388613387.db2.gz FMPCUTAQGFCVSX-NSHDSACASA-N 1 1 231.330 3.686 20 0 BHADMO CC[C@H]1CCCC[N@H+]1C[C@@H]1CCC(F)(F)C1 ZINC000550680706 388613280 /nfs/dbraw/zinc/61/32/80/388613280.db2.gz INYJGPWSTUHHEH-NEPJUHHUSA-N 1 1 231.330 3.686 20 0 BHADMO CC[C@@H]1CCCC[N@H+]1C[C@H]1CCC(F)(F)C1 ZINC000550680707 388613403 /nfs/dbraw/zinc/61/34/03/388613403.db2.gz INYJGPWSTUHHEH-NWDGAFQWSA-N 1 1 231.330 3.686 20 0 BHADMO CC[C@H]1CCCC[N@H+]1C[C@H]1CCC(F)(F)C1 ZINC000550680709 388613236 /nfs/dbraw/zinc/61/32/36/388613236.db2.gz INYJGPWSTUHHEH-RYUDHWBXSA-N 1 1 231.330 3.686 20 0 BHADMO CC[C@@H]1CCCC[N@H+]1C[C@@H]1CCC(F)(F)C1 ZINC000550680711 388613411 /nfs/dbraw/zinc/61/34/11/388613411.db2.gz INYJGPWSTUHHEH-VXGBXAGGSA-N 1 1 231.330 3.686 20 0 BHADMO CCCCC[N@@H+](CCc1cscn1)C(C)C ZINC000550680754 388613326 /nfs/dbraw/zinc/61/33/26/388613326.db2.gz QMZGDGNYFXLLIR-UHFFFAOYSA-N 1 1 240.416 3.586 20 0 BHADMO CC1CCC([N@@H+](C)C[C@H]2CCC(F)(F)C2)CC1 ZINC000550706452 388613945 /nfs/dbraw/zinc/61/39/45/388613945.db2.gz HCCIHUQTZYRBIC-CPCZMJQVSA-N 1 1 245.357 3.932 20 0 BHADMO CC1CCC([N@@H+](C)C[C@@H]2CCC(F)(F)C2)CC1 ZINC000550706453 388613133 /nfs/dbraw/zinc/61/31/33/388613133.db2.gz HCCIHUQTZYRBIC-OTTFEQOBSA-N 1 1 245.357 3.932 20 0 BHADMO CC1(C)CCC[N@@H+](C[C@@H]2CCC(F)(F)C2)CC1 ZINC000550707709 388613979 /nfs/dbraw/zinc/61/39/79/388613979.db2.gz XROGUMUEBOFWFR-GFCCVEGCSA-N 1 1 245.357 3.934 20 0 BHADMO CC1(C)CCC[N@@H+](C[C@H]2CCC(F)(F)C2)CC1 ZINC000550707710 388613848 /nfs/dbraw/zinc/61/38/48/388613848.db2.gz XROGUMUEBOFWFR-LBPRGKRZSA-N 1 1 245.357 3.934 20 0 BHADMO C[C@@H]([NH2+]CC(C)(F)F)C(C)(C)c1ccccc1 ZINC000550858006 388616315 /nfs/dbraw/zinc/61/63/15/388616315.db2.gz GWJIHLFNFCHWDK-LLVKDONJSA-N 1 1 241.325 3.598 20 0 BHADMO C[C@H]([NH2+]CC(C)(F)F)C(C)(C)c1ccccc1 ZINC000550858011 325541374 /nfs/dbraw/zinc/54/13/74/325541374.db2.gz GWJIHLFNFCHWDK-NSHDSACASA-N 1 1 241.325 3.598 20 0 BHADMO CCC[N@H+](Cc1cc(C)c(O)c(C)c1)CC1CC1 ZINC000550915831 388617124 /nfs/dbraw/zinc/61/71/24/388617124.db2.gz GHPFUMANUQMUPZ-UHFFFAOYSA-N 1 1 247.382 3.631 20 0 BHADMO C[C@@H]([NH2+][C@@H]1CCC[C@@H]1F)c1cc(F)ccc1F ZINC000550933694 388617297 /nfs/dbraw/zinc/61/72/97/388617297.db2.gz VFZIJLKCRPOYLI-OXHMUOHRSA-N 1 1 243.272 3.506 20 0 BHADMO CCCCOCC[N@@H+](C)[C@@H](C)c1ccc(C)cc1 ZINC000550964055 398147762 /nfs/dbraw/zinc/14/77/62/398147762.db2.gz ZMVDUPONKVLNET-HNNXBMFYSA-N 1 1 249.398 3.805 20 0 BHADMO CCCCOCC[N@@H+](C)[C@H](C)c1ccc(C)cc1 ZINC000550964056 398147498 /nfs/dbraw/zinc/14/74/98/398147498.db2.gz ZMVDUPONKVLNET-OAHLLOKOSA-N 1 1 249.398 3.805 20 0 BHADMO C[N@H+]1CCCC[C@@H]1CCSc1ccccc1 ZINC000550990338 388618638 /nfs/dbraw/zinc/61/86/38/388618638.db2.gz QHYHSBDGHGGOFL-CYBMUJFWSA-N 1 1 235.396 3.653 20 0 BHADMO C[N@H+]1CCCC[C@H]1CCSc1ccccc1 ZINC000550990339 388618847 /nfs/dbraw/zinc/61/88/47/388618847.db2.gz QHYHSBDGHGGOFL-ZDUSSCGKSA-N 1 1 235.396 3.653 20 0 BHADMO CC(C)[N@@H+](C)Cc1csc(-c2ccccc2)n1 ZINC000551030205 388620653 /nfs/dbraw/zinc/62/06/53/388620653.db2.gz HSUSUIQCDPUVOL-UHFFFAOYSA-N 1 1 246.379 3.650 20 0 BHADMO C[C@@H]1CCCC[C@@H]1[N@@H+](C)C[C@H]1CCC(F)(F)C1 ZINC000551060770 388621114 /nfs/dbraw/zinc/62/11/14/388621114.db2.gz XLSLQMOHLIVWPU-AGIUHOORSA-N 1 1 245.357 3.932 20 0 BHADMO C[C@@H]1CCCC[C@H]1[N@@H+](C)C[C@H]1CCC(F)(F)C1 ZINC000551060971 388621342 /nfs/dbraw/zinc/62/13/42/388621342.db2.gz XLSLQMOHLIVWPU-FRRDWIJNSA-N 1 1 245.357 3.932 20 0 BHADMO C[C@@H]1CCCC[C@H]1[N@@H+](C)C[C@@H]1CCC(F)(F)C1 ZINC000551060972 388621044 /nfs/dbraw/zinc/62/10/44/388621044.db2.gz XLSLQMOHLIVWPU-JHJVBQTASA-N 1 1 245.357 3.932 20 0 BHADMO C[C@@H]1CCCC[C@@H]1[N@@H+](C)C[C@@H]1CCC(F)(F)C1 ZINC000551060974 388621666 /nfs/dbraw/zinc/62/16/66/388621666.db2.gz XLSLQMOHLIVWPU-UPJWGTAASA-N 1 1 245.357 3.932 20 0 BHADMO FC1(F)CC[C@H](C[N@H+]2CCC[C@@H]3CCC[C@@H]32)C1 ZINC000551094724 388621038 /nfs/dbraw/zinc/62/10/38/388621038.db2.gz FDXXIEGYZJAGGM-AVGNSLFASA-N 1 1 243.341 3.686 20 0 BHADMO FC1(F)CC[C@H](C[N@H+]2CCC[C@@H]3CCC[C@H]32)C1 ZINC000551094725 388621479 /nfs/dbraw/zinc/62/14/79/388621479.db2.gz FDXXIEGYZJAGGM-RWMBFGLXSA-N 1 1 243.341 3.686 20 0 BHADMO FC1(F)CC[C@H](C[N@H+]2CCC[C@H]3CCC[C@@H]32)C1 ZINC000551094726 388621484 /nfs/dbraw/zinc/62/14/84/388621484.db2.gz FDXXIEGYZJAGGM-XQQFMLRXSA-N 1 1 243.341 3.686 20 0 BHADMO FC1(F)CC[C@H](C[N@H+]2CCC[C@H]3CCC[C@H]32)C1 ZINC000551094727 388620970 /nfs/dbraw/zinc/62/09/70/388620970.db2.gz FDXXIEGYZJAGGM-YNEHKIRRSA-N 1 1 243.341 3.686 20 0 BHADMO C[C@@H]([NH2+][C@H]1CCC[C@H]1F)c1cc(F)ccc1F ZINC000551307692 325553471 /nfs/dbraw/zinc/55/34/71/325553471.db2.gz VFZIJLKCRPOYLI-WQHBLYJGSA-N 1 1 243.272 3.506 20 0 BHADMO C[N@@H+](CCC1CCCCCC1)Cc1ccncc1 ZINC000551328786 388626444 /nfs/dbraw/zinc/62/64/44/388626444.db2.gz SQMAFHLYYWEDBL-UHFFFAOYSA-N 1 1 246.398 3.874 20 0 BHADMO C[N@@H+](CCC1CCCCCC1)Cc1cccnc1 ZINC000551328898 388626183 /nfs/dbraw/zinc/62/61/83/388626183.db2.gz VGTZSRFTDWCAIB-UHFFFAOYSA-N 1 1 246.398 3.874 20 0 BHADMO CCCC[N@@H+](C)[C@H]1CCCc2cc(OC)ccc21 ZINC000551369186 388628352 /nfs/dbraw/zinc/62/83/52/388628352.db2.gz VOIUEBUDXYIKEZ-INIZCTEOSA-N 1 1 247.382 3.805 20 0 BHADMO CCCC[N@@H+](C)[C@@H]1CCCc2cc(OC)ccc21 ZINC000551369187 388627732 /nfs/dbraw/zinc/62/77/32/388627732.db2.gz VOIUEBUDXYIKEZ-MRXNPFEDSA-N 1 1 247.382 3.805 20 0 BHADMO CCC(CC)C[N@@H+](CC)CCCCCF ZINC000551382358 388628292 /nfs/dbraw/zinc/62/82/92/388628292.db2.gz VKUGWPRHWUMNRZ-UHFFFAOYSA-N 1 1 217.372 3.884 20 0 BHADMO Cc1cccc(C[N@@H+](C)CCCCCF)c1 ZINC000551382435 388627884 /nfs/dbraw/zinc/62/78/84/388627884.db2.gz ZOZFDOBNLKAVQQ-UHFFFAOYSA-N 1 1 223.335 3.567 20 0 BHADMO C[N@@H+](CCCCCF)Cc1ccc(Cl)cc1 ZINC000551382632 388627721 /nfs/dbraw/zinc/62/77/21/388627721.db2.gz LVOGGOUVBCDYBW-UHFFFAOYSA-N 1 1 243.753 3.912 20 0 BHADMO C[N@@H+](CCCCCF)[C@H]1CCc2ccccc21 ZINC000551382751 388628145 /nfs/dbraw/zinc/62/81/45/388628145.db2.gz SDADEOASGPDZFN-HNNXBMFYSA-N 1 1 235.346 3.746 20 0 BHADMO C[N@@H+](CCCCCF)[C@@H]1CCc2ccccc21 ZINC000551382752 388627546 /nfs/dbraw/zinc/62/75/46/388627546.db2.gz SDADEOASGPDZFN-OAHLLOKOSA-N 1 1 235.346 3.746 20 0 BHADMO CCC1(CC)CC[N@@H+](CCCCCF)C1 ZINC000551385994 388627558 /nfs/dbraw/zinc/62/75/58/388627558.db2.gz WYENALZVEIWMOD-UHFFFAOYSA-N 1 1 215.356 3.638 20 0 BHADMO C[C@@H]1CCC[C@@H](C)[N@@H+](CCCCCF)C1 ZINC000551386729 388627877 /nfs/dbraw/zinc/62/78/77/388627877.db2.gz AMCWPLCHDMFJSF-CHWSQXEVSA-N 1 1 215.356 3.637 20 0 BHADMO C[C@@H]1CCC[C@H](C)[N@@H+](CCCCCF)C1 ZINC000551386730 388627581 /nfs/dbraw/zinc/62/75/81/388627581.db2.gz AMCWPLCHDMFJSF-OLZOCXBDSA-N 1 1 215.356 3.637 20 0 BHADMO C[C@@H]1CCC[C@H](C)C[N@@H+]1CCCCCF ZINC000551386731 388628275 /nfs/dbraw/zinc/62/82/75/388628275.db2.gz AMCWPLCHDMFJSF-QWHCGFSZSA-N 1 1 215.356 3.637 20 0 BHADMO C[C@H]1CCC[C@H](C)[N@@H+](CCCCCF)C1 ZINC000551386732 388628261 /nfs/dbraw/zinc/62/82/61/388628261.db2.gz AMCWPLCHDMFJSF-STQMWFEESA-N 1 1 215.356 3.637 20 0 BHADMO CC(C)[C@H]1CCCC[N@H+]1CCCCCF ZINC000551386741 388628361 /nfs/dbraw/zinc/62/83/61/388628361.db2.gz AUKHEJLUKBRRFW-CYBMUJFWSA-N 1 1 215.356 3.637 20 0 BHADMO CC(C)[C@@H]1CCCC[N@H+]1CCCCCF ZINC000551386742 388626418 /nfs/dbraw/zinc/62/64/18/388626418.db2.gz AUKHEJLUKBRRFW-ZDUSSCGKSA-N 1 1 215.356 3.637 20 0 BHADMO CC1(C)CCC[N@@H+](CCCCCF)CC1 ZINC000551387218 388628342 /nfs/dbraw/zinc/62/83/42/388628342.db2.gz YVLSGCKKTXIHJL-UHFFFAOYSA-N 1 1 215.356 3.638 20 0 BHADMO CCC1(CC)C[N@@H+](CCCCCF)CCS1 ZINC000551392024 388627966 /nfs/dbraw/zinc/62/79/66/388627966.db2.gz XGNWDCYWWHQTSG-UHFFFAOYSA-N 1 1 247.423 3.734 20 0 BHADMO Cc1cccc([C@H]2CC[N@@H+](CCCCCF)C2)c1 ZINC000551395162 388628707 /nfs/dbraw/zinc/62/87/07/388628707.db2.gz QCHNHYZCCBVOKP-INIZCTEOSA-N 1 1 249.373 3.924 20 0 BHADMO Cc1cccc([C@@H]2CC[N@@H+](CCCCCF)C2)c1 ZINC000551395164 388628991 /nfs/dbraw/zinc/62/89/91/388628991.db2.gz QCHNHYZCCBVOKP-MRXNPFEDSA-N 1 1 249.373 3.924 20 0 BHADMO FCCCCC[N@H+]1CCC=C(c2ccccc2)C1 ZINC000551404393 388628924 /nfs/dbraw/zinc/62/89/24/388628924.db2.gz ZHRVNMSAQFUUGI-UHFFFAOYSA-N 1 1 247.357 3.916 20 0 BHADMO CCOc1ccc(C[N@@H+](CC)C2CCCC2)cc1 ZINC000551405773 388628721 /nfs/dbraw/zinc/62/87/21/388628721.db2.gz BPUXCYVGSZVKIU-UHFFFAOYSA-N 1 1 247.382 3.850 20 0 BHADMO CC(C)(C)CC[N@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000551441378 388629783 /nfs/dbraw/zinc/62/97/83/388629783.db2.gz FNXXUIDFHUBBTO-JTQLQIEISA-N 1 1 237.309 3.697 20 0 BHADMO CC(C)(C)CC[N@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000551441379 388630305 /nfs/dbraw/zinc/63/03/05/388630305.db2.gz FNXXUIDFHUBBTO-SNVBAGLBSA-N 1 1 237.309 3.697 20 0 BHADMO Cc1cc(F)ccc1C[N@@H+](C)CCCCCF ZINC000551443354 388630497 /nfs/dbraw/zinc/63/04/97/388630497.db2.gz TTYHOBWPCUCHDC-UHFFFAOYSA-N 1 1 241.325 3.706 20 0 BHADMO CC(C)(C)[C@@H]1CCC[N@@H+](CCCCCF)C1 ZINC000551448186 388630127 /nfs/dbraw/zinc/63/01/27/388630127.db2.gz MEWUVVJBOFZNIC-CYBMUJFWSA-N 1 1 229.383 3.884 20 0 BHADMO CC(C)(C)[C@H]1CCC[N@@H+](CCCCCF)C1 ZINC000551448187 388630587 /nfs/dbraw/zinc/63/05/87/388630587.db2.gz MEWUVVJBOFZNIC-ZDUSSCGKSA-N 1 1 229.383 3.884 20 0 BHADMO CCCCCSCC[C@H]1CCCC[N@H+]1C ZINC000551461171 388630398 /nfs/dbraw/zinc/63/03/98/388630398.db2.gz HWLUBHZQBMGHLD-CYBMUJFWSA-N 1 1 229.433 3.784 20 0 BHADMO CCCCCSCC[C@@H]1CCCC[N@H+]1C ZINC000551461172 388630264 /nfs/dbraw/zinc/63/02/64/388630264.db2.gz HWLUBHZQBMGHLD-ZDUSSCGKSA-N 1 1 229.433 3.784 20 0 BHADMO CC(C)c1ccc(C[N@@H+](C)[C@H]2CCSC2)cc1 ZINC000551462396 384452722 /nfs/dbraw/zinc/45/27/22/384452722.db2.gz ACULBBIDAKRJDQ-HNNXBMFYSA-N 1 1 249.423 3.747 20 0 BHADMO CC(C)c1ccc(C[N@@H+](C)[C@@H]2CCSC2)cc1 ZINC000551462397 384453611 /nfs/dbraw/zinc/45/36/11/384453611.db2.gz ACULBBIDAKRJDQ-OAHLLOKOSA-N 1 1 249.423 3.747 20 0 BHADMO CCC1CC(Nc2cccc3cc[nH+]cc32)C1 ZINC000551532910 388632840 /nfs/dbraw/zinc/63/28/40/388632840.db2.gz IMECZLNRKFDKNX-UHFFFAOYSA-N 1 1 226.323 3.835 20 0 BHADMO CC(C)C(C[N@@H+](C)Cc1cscn1)C(C)C ZINC000551551670 388633731 /nfs/dbraw/zinc/63/37/31/388633731.db2.gz DRVWFBCISMWLFH-UHFFFAOYSA-N 1 1 240.416 3.503 20 0 BHADMO CC(C)C(C[N@@H+](C)CCC(F)(F)F)C(C)C ZINC000551557629 388633776 /nfs/dbraw/zinc/63/37/76/388633776.db2.gz GBYZAKSFMNCJKX-UHFFFAOYSA-N 1 1 239.325 3.799 20 0 BHADMO Cc1cccc(C[N@H+](C)CC(C(C)C)C(C)C)n1 ZINC000551558408 388633380 /nfs/dbraw/zinc/63/33/80/388633380.db2.gz OWMRJPAWVWTJAT-UHFFFAOYSA-N 1 1 248.414 3.750 20 0 BHADMO CC[N@H+](Cc1ccccn1)CC(C(C)C)C(C)C ZINC000551559561 388633352 /nfs/dbraw/zinc/63/33/52/388633352.db2.gz SZPMPBQWECKOBE-UHFFFAOYSA-N 1 1 248.414 3.832 20 0 BHADMO CC[N@@H+](Cc1ccc(Cl)o1)C1CCCC1 ZINC000551585675 388634290 /nfs/dbraw/zinc/63/42/90/388634290.db2.gz DLRVYDOWPOXGFA-UHFFFAOYSA-N 1 1 227.735 3.698 20 0 BHADMO CC[N@@H+](Cc1cccc2cc[nH]c21)C1CCCC1 ZINC000551585702 388634599 /nfs/dbraw/zinc/63/45/99/388634599.db2.gz DSBCQEKFUIKBGF-UHFFFAOYSA-N 1 1 242.366 3.932 20 0 BHADMO CCCC[N@@H+](C)Cc1ccc(C)cc1C ZINC000551683223 388636281 /nfs/dbraw/zinc/63/62/81/388636281.db2.gz PNJFVPHPMXLELP-UHFFFAOYSA-N 1 1 205.345 3.535 20 0 BHADMO CC(C)CC[N@@H+](CCCCCF)C1CC1 ZINC000551691962 388637009 /nfs/dbraw/zinc/63/70/09/388637009.db2.gz DYHCWYNXFQHGEW-UHFFFAOYSA-N 1 1 215.356 3.637 20 0 BHADMO C[N@@H+](CCCCCF)CCCc1ccccc1 ZINC000551692263 388636362 /nfs/dbraw/zinc/63/63/62/388636362.db2.gz JPVJNMLZJZRQCD-UHFFFAOYSA-N 1 1 237.362 3.691 20 0 BHADMO C[C@@H]1CCC[C@@H]([N@@H+](C)CCCCCF)C1 ZINC000551694306 388637030 /nfs/dbraw/zinc/63/70/30/388637030.db2.gz SOJRUMVPIVZZLE-CHWSQXEVSA-N 1 1 215.356 3.637 20 0 BHADMO C[C@@H]1CCC[C@H]([N@@H+](C)CCCCCF)C1 ZINC000551694307 388636773 /nfs/dbraw/zinc/63/67/73/388636773.db2.gz SOJRUMVPIVZZLE-OLZOCXBDSA-N 1 1 215.356 3.637 20 0 BHADMO C[C@H]1CCC[C@@H]([N@@H+](C)CCCCCF)C1 ZINC000551694308 388637136 /nfs/dbraw/zinc/63/71/36/388637136.db2.gz SOJRUMVPIVZZLE-QWHCGFSZSA-N 1 1 215.356 3.637 20 0 BHADMO C[C@H]1CCC[C@H]([N@@H+](C)CCCCCF)C1 ZINC000551694309 388636702 /nfs/dbraw/zinc/63/67/02/388636702.db2.gz SOJRUMVPIVZZLE-STQMWFEESA-N 1 1 215.356 3.637 20 0 BHADMO C[C@@H]1c2ccsc2CC[N@@H+]1CCCCCF ZINC000551696412 388636240 /nfs/dbraw/zinc/63/62/40/388636240.db2.gz AONDXPHVEBMIAD-LLVKDONJSA-N 1 1 241.375 3.807 20 0 BHADMO C[C@H]1c2ccsc2CC[N@@H+]1CCCCCF ZINC000551696413 388636208 /nfs/dbraw/zinc/63/62/08/388636208.db2.gz AONDXPHVEBMIAD-NSHDSACASA-N 1 1 241.375 3.807 20 0 BHADMO C[C@H](c1ccccc1F)[N@@H+](C)CCCCCF ZINC000551696418 388636956 /nfs/dbraw/zinc/63/69/56/388636956.db2.gz AQVUMLYUQKKOCK-GFCCVEGCSA-N 1 1 241.325 3.958 20 0 BHADMO C[C@@H](c1ccccc1F)[N@@H+](C)CCCCCF ZINC000551696419 388636754 /nfs/dbraw/zinc/63/67/54/388636754.db2.gz AQVUMLYUQKKOCK-LBPRGKRZSA-N 1 1 241.325 3.958 20 0 BHADMO C[N@@H+](CCCCCF)Cc1cccc(Cl)c1 ZINC000551696468 388636722 /nfs/dbraw/zinc/63/67/22/388636722.db2.gz DZSBJHQIRQTZEU-UHFFFAOYSA-N 1 1 243.753 3.912 20 0 BHADMO Cc1ccsc1C[N@@H+](C)CCC(C)(C)C ZINC000551696768 388636531 /nfs/dbraw/zinc/63/65/31/388636531.db2.gz KDEKBTXVNBBDCS-UHFFFAOYSA-N 1 1 225.401 3.925 20 0 BHADMO C[N@@H+](CCCCCF)Cc1ccccc1Cl ZINC000551696956 388637130 /nfs/dbraw/zinc/63/71/30/388637130.db2.gz NJNVUNQYIBCSEQ-UHFFFAOYSA-N 1 1 243.753 3.912 20 0 BHADMO CC[N@@H+](CCCCCF)CCc1cccs1 ZINC000551698795 388637084 /nfs/dbraw/zinc/63/70/84/388637084.db2.gz DOPLUCICWUWTOP-UHFFFAOYSA-N 1 1 243.391 3.752 20 0 BHADMO CCC(CC)[N@@H+](CCCCCF)C1CC1 ZINC000551699150 388636850 /nfs/dbraw/zinc/63/68/50/388636850.db2.gz NBPCDZZISATQOP-UHFFFAOYSA-N 1 1 215.356 3.779 20 0 BHADMO C[C@@H]1c2ccccc2CC[N@@H+]1CCCCCF ZINC000551699223 388636729 /nfs/dbraw/zinc/63/67/29/388636729.db2.gz SPAHTCBJOCXMDG-CYBMUJFWSA-N 1 1 235.346 3.746 20 0 BHADMO C[C@H]1c2ccccc2CC[N@@H+]1CCCCCF ZINC000551699224 388637046 /nfs/dbraw/zinc/63/70/46/388637046.db2.gz SPAHTCBJOCXMDG-ZDUSSCGKSA-N 1 1 235.346 3.746 20 0 BHADMO CCC[C@@H]1CCC[N@@H+](CCCCCF)C1 ZINC000551703608 388638250 /nfs/dbraw/zinc/63/82/50/388638250.db2.gz DQBSJFPHBRVFDX-CYBMUJFWSA-N 1 1 215.356 3.638 20 0 BHADMO CCC[C@H]1CCC[N@@H+](CCCCCF)C1 ZINC000551703609 388637406 /nfs/dbraw/zinc/63/74/06/388637406.db2.gz DQBSJFPHBRVFDX-ZDUSSCGKSA-N 1 1 215.356 3.638 20 0 BHADMO CC[C@@H](C)[N@H+]1CCC=C(c2ccccc2)C1 ZINC000551711434 388637561 /nfs/dbraw/zinc/63/75/61/388637561.db2.gz XGIOXCZCBIELSR-CYBMUJFWSA-N 1 1 215.340 3.574 20 0 BHADMO CC[C@H](C)[N@H+]1CCC=C(c2ccccc2)C1 ZINC000551711435 388637893 /nfs/dbraw/zinc/63/78/93/388637893.db2.gz XGIOXCZCBIELSR-ZDUSSCGKSA-N 1 1 215.340 3.574 20 0 BHADMO Cc1ccc(C)c(C[N@@H+](C)CCCCCF)c1 ZINC000551734138 388637500 /nfs/dbraw/zinc/63/75/00/388637500.db2.gz PXYWKOLYIMCQIZ-UHFFFAOYSA-N 1 1 237.362 3.875 20 0 BHADMO C[N@@H+](CCCCCF)CC1(c2ccccc2)CC1 ZINC000551735735 388638243 /nfs/dbraw/zinc/63/82/43/388638243.db2.gz PYOPIWRUPJIUMK-UHFFFAOYSA-N 1 1 249.373 3.790 20 0 BHADMO CC(C)(C)CC[N@H+]1CCSC(C)(C)CC1 ZINC000551738914 388637778 /nfs/dbraw/zinc/63/77/78/388637778.db2.gz NZKSZARCRDHTMH-UHFFFAOYSA-N 1 1 229.433 3.640 20 0 BHADMO Cc1ccncc1C[N@H+](C)CC(C(C)C)C(C)C ZINC000551823431 388642394 /nfs/dbraw/zinc/64/23/94/388642394.db2.gz GJMDYBBZCYPQIO-UHFFFAOYSA-N 1 1 248.414 3.750 20 0 BHADMO CC[N@@H+](Cc1ccc(C)s1)C1CCCC1 ZINC000551824411 388642556 /nfs/dbraw/zinc/64/25/56/388642556.db2.gz FILWXBPMOVTQKY-UHFFFAOYSA-N 1 1 223.385 3.821 20 0 BHADMO CC[N@@H+](Cc1sccc1C)C1CCCC1 ZINC000551826548 388642582 /nfs/dbraw/zinc/64/25/82/388642582.db2.gz NHAZSQUVUWUFNJ-UHFFFAOYSA-N 1 1 223.385 3.821 20 0 BHADMO Cc1ccc([C@@H]2CC[N@H+](CC[C@H](C)F)C2)cc1 ZINC000551968078 388650473 /nfs/dbraw/zinc/65/04/73/388650473.db2.gz UUEYXEGVDOCNAN-DZGCQCFKSA-N 1 1 235.346 3.532 20 0 BHADMO Cc1ccc([C@H]2CC[N@H+](CC[C@@H](C)F)C2)cc1 ZINC000551968083 388650575 /nfs/dbraw/zinc/65/05/75/388650575.db2.gz UUEYXEGVDOCNAN-HIFRSBDPSA-N 1 1 235.346 3.532 20 0 BHADMO Cc1ccc([C@@H]2CC[N@H+](CC[C@@H](C)F)C2)cc1 ZINC000551968084 388650384 /nfs/dbraw/zinc/65/03/84/388650384.db2.gz UUEYXEGVDOCNAN-UKRRQHHQSA-N 1 1 235.346 3.532 20 0 BHADMO Cc1ccc([C@H]2CC[N@H+](CC[C@H](C)F)C2)cc1 ZINC000551968085 388650488 /nfs/dbraw/zinc/65/04/88/388650488.db2.gz UUEYXEGVDOCNAN-ZFWWWQNUSA-N 1 1 235.346 3.532 20 0 BHADMO CCCOc1ccc(C[N@@H+](C)C2CCCC2)cc1 ZINC000551987213 388652963 /nfs/dbraw/zinc/65/29/63/388652963.db2.gz LXEBPZSRRURRRR-UHFFFAOYSA-N 1 1 247.382 3.850 20 0 BHADMO CC[C@H]1CCC[N@H+]1Cc1ccnc2ccccc12 ZINC000551996549 388654906 /nfs/dbraw/zinc/65/49/06/388654906.db2.gz IDCQFJTUDRRYBK-AWEZNQCLSA-N 1 1 240.350 3.609 20 0 BHADMO CC[C@@H]1CCC[N@H+]1Cc1ccnc2ccccc12 ZINC000551996550 388655472 /nfs/dbraw/zinc/65/54/72/388655472.db2.gz IDCQFJTUDRRYBK-CQSZACIVSA-N 1 1 240.350 3.609 20 0 BHADMO Cc1sccc1C[N@H+](C)[C@H](C)C(C)(C)C ZINC000552023667 388661146 /nfs/dbraw/zinc/66/11/46/388661146.db2.gz WFFLAKXSQOTHMP-LLVKDONJSA-N 1 1 225.401 3.923 20 0 BHADMO Cc1sccc1C[N@H+](C)[C@@H](C)C(C)(C)C ZINC000552023668 388661429 /nfs/dbraw/zinc/66/14/29/388661429.db2.gz WFFLAKXSQOTHMP-NSHDSACASA-N 1 1 225.401 3.923 20 0 BHADMO CCC(C)(C)[N@@H+](C)Cc1cc(F)c(F)c(F)c1 ZINC000552043393 388664416 /nfs/dbraw/zinc/66/44/16/388664416.db2.gz LARFJBNLXKHCRE-UHFFFAOYSA-N 1 1 245.288 3.724 20 0 BHADMO Cc1cc(Cl)cc(C[N@H+]2CCC2(C)C)c1 ZINC000552050337 388663656 /nfs/dbraw/zinc/66/36/56/388663656.db2.gz XUGNFMUMYKQNDU-UHFFFAOYSA-N 1 1 223.747 3.633 20 0 BHADMO CC1=CC[C@H](Nc2cc(C3CC3)cc[nH+]2)CC1 ZINC000552051722 388663797 /nfs/dbraw/zinc/66/37/97/388663797.db2.gz CWEPYAUJPVIXQY-AWEZNQCLSA-N 1 1 228.339 3.870 20 0 BHADMO CC1=CC[C@@H](Nc2cc(C3CC3)cc[nH+]2)CC1 ZINC000552051723 388664219 /nfs/dbraw/zinc/66/42/19/388664219.db2.gz CWEPYAUJPVIXQY-CQSZACIVSA-N 1 1 228.339 3.870 20 0 BHADMO CCc1ccc([C@H]2CC[N@@H+](CC3(F)CC3)C2)cc1 ZINC000552060834 388664622 /nfs/dbraw/zinc/66/46/22/388664622.db2.gz LLGIZFJRZHSVIY-HNNXBMFYSA-N 1 1 247.357 3.540 20 0 BHADMO CCc1ccc([C@@H]2CC[N@@H+](CC3(F)CC3)C2)cc1 ZINC000552060835 388665108 /nfs/dbraw/zinc/66/51/08/388665108.db2.gz 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MLLHJMWLUKRXRB-VOMSXAGXSA-N 1 1 233.330 3.524 20 0 BHADMO C/C(=C/c1ccccc1)C[N@H+]1CCC[C@@H]1CF ZINC000552129362 388672391 /nfs/dbraw/zinc/67/23/91/388672391.db2.gz MLLHJMWLUKRXRB-VSKPTYQZSA-N 1 1 233.330 3.524 20 0 BHADMO C/C(=C/c1ccccc1)C[N@H+]1CCC[C@H]1CF ZINC000552129363 388671475 /nfs/dbraw/zinc/67/14/75/388671475.db2.gz MLLHJMWLUKRXRB-WVUXNXBLSA-N 1 1 233.330 3.524 20 0 BHADMO CCCC[C@@H](C)[N@@H+](CCCC)Cc1cocn1 ZINC000552129659 388672267 /nfs/dbraw/zinc/67/22/67/388672267.db2.gz CYXROEVEKGDXTO-CYBMUJFWSA-N 1 1 238.375 3.855 20 0 BHADMO CCCC[C@H](C)[N@@H+](CCCC)Cc1cocn1 ZINC000552129660 388672205 /nfs/dbraw/zinc/67/22/05/388672205.db2.gz CYXROEVEKGDXTO-ZDUSSCGKSA-N 1 1 238.375 3.855 20 0 BHADMO Cc1ccc(C[N@H+]2CC(C)(C)[C@H]3CCC[C@@H]32)o1 ZINC000552139501 388672802 /nfs/dbraw/zinc/67/28/02/388672802.db2.gz JMFJSVFHZQRFTJ-KBPBESRZSA-N 1 1 233.355 3.599 20 0 BHADMO Cc1ccc(C[N@H+]2CC(C)(C)[C@@H]3CCC[C@@H]32)o1 ZINC000552139502 388673256 /nfs/dbraw/zinc/67/32/56/388673256.db2.gz JMFJSVFHZQRFTJ-KGLIPLIRSA-N 1 1 233.355 3.599 20 0 BHADMO Cc1ccc(C[N@H+]2CC(C)(C)[C@H]3CCC[C@H]32)o1 ZINC000552139503 388673004 /nfs/dbraw/zinc/67/30/04/388673004.db2.gz JMFJSVFHZQRFTJ-UONOGXRCSA-N 1 1 233.355 3.599 20 0 BHADMO Cc1ccc(C[N@H+]2CC(C)(C)[C@@H]3CCC[C@H]32)o1 ZINC000552139504 388673475 /nfs/dbraw/zinc/67/34/75/388673475.db2.gz JMFJSVFHZQRFTJ-ZIAGYGMSSA-N 1 1 233.355 3.599 20 0 BHADMO CCc1ccc(C[N@@H+](C)CCC2CC2)s1 ZINC000552190320 388678988 /nfs/dbraw/zinc/67/89/88/388678988.db2.gz JTEPZJINKXFCRI-UHFFFAOYSA-N 1 1 223.385 3.542 20 0 BHADMO CC(C)=CC[N@H+]1CC[C@H](c2cccc(F)c2)C1 ZINC000552199133 388679825 /nfs/dbraw/zinc/67/98/25/388679825.db2.gz OEYWODAFZLFJGN-AWEZNQCLSA-N 1 1 233.330 3.581 20 0 BHADMO CC(C)=CC[N@H+]1CC[C@@H](c2cccc(F)c2)C1 ZINC000552199134 388679739 /nfs/dbraw/zinc/67/97/39/388679739.db2.gz OEYWODAFZLFJGN-CQSZACIVSA-N 1 1 233.330 3.581 20 0 BHADMO Clc1ccc([C@@H]2CC[N@H+](C3CCC3)C2)cc1 ZINC000552229180 388683121 /nfs/dbraw/zinc/68/31/21/388683121.db2.gz TZYONXCHLSHTLS-GFCCVEGCSA-N 1 1 235.758 3.682 20 0 BHADMO Clc1ccc([C@H]2CC[N@H+](C3CCC3)C2)cc1 ZINC000552229181 388683352 /nfs/dbraw/zinc/68/33/52/388683352.db2.gz TZYONXCHLSHTLS-LBPRGKRZSA-N 1 1 235.758 3.682 20 0 BHADMO Cc1ccoc1C[N@H+]1[C@H](C)C[C@@H]2CCCC[C@H]21 ZINC000552243031 388685083 /nfs/dbraw/zinc/68/50/83/388685083.db2.gz KMBIGYHDIYWXDG-HZSPNIEDSA-N 1 1 233.355 3.741 20 0 BHADMO Cc1ccoc1C[N@H+]1[C@H](C)C[C@H]2CCCC[C@@H]21 ZINC000552243032 388686046 /nfs/dbraw/zinc/68/60/46/388686046.db2.gz KMBIGYHDIYWXDG-MCIONIFRSA-N 1 1 233.355 3.741 20 0 BHADMO Cc1ccoc1C[N@H+]1[C@H](C)C[C@H]2CCCC[C@H]21 ZINC000552243033 388685625 /nfs/dbraw/zinc/68/56/25/388685625.db2.gz KMBIGYHDIYWXDG-MGPQQGTHSA-N 1 1 233.355 3.741 20 0 BHADMO Cc1ccoc1C[N@H+]1[C@H](C)C[C@@H]2CCCC[C@@H]21 ZINC000552243034 388685903 /nfs/dbraw/zinc/68/59/03/388685903.db2.gz KMBIGYHDIYWXDG-RDBSUJKOSA-N 1 1 233.355 3.741 20 0 BHADMO CC[C@@H]1CC[N@H+]1Cc1cc(C)cc(Cl)c1 ZINC000552256463 388687453 /nfs/dbraw/zinc/68/74/53/388687453.db2.gz LUZFHHXTWQGRHM-CYBMUJFWSA-N 1 1 223.747 3.633 20 0 BHADMO CC[C@H]1CC[N@H+]1Cc1cc(C)cc(Cl)c1 ZINC000552256464 388686691 /nfs/dbraw/zinc/68/66/91/388686691.db2.gz LUZFHHXTWQGRHM-ZDUSSCGKSA-N 1 1 223.747 3.633 20 0 BHADMO CCC(C)(C)[N@@H+](C)Cc1cc(F)c(F)cc1F ZINC000552256561 388687279 /nfs/dbraw/zinc/68/72/79/388687279.db2.gz QZYDVXUFLSUYFX-UHFFFAOYSA-N 1 1 245.288 3.724 20 0 BHADMO CC[N@@H+](Cc1ccsc1C)CC(C)(C)C ZINC000552256708 388687174 /nfs/dbraw/zinc/68/71/74/388687174.db2.gz ZVMZKHIBRIJUAW-UHFFFAOYSA-N 1 1 225.401 3.925 20 0 BHADMO CCSCC[N@H+]1CCC[C@H](c2ccccc2)C1 ZINC000552274211 388688864 /nfs/dbraw/zinc/68/88/64/388688864.db2.gz HCGWWUMNLRBAKB-HNNXBMFYSA-N 1 1 249.423 3.619 20 0 BHADMO CCSCC[N@H+]1CCC[C@@H](c2ccccc2)C1 ZINC000552274212 388687915 /nfs/dbraw/zinc/68/79/15/388687915.db2.gz HCGWWUMNLRBAKB-OAHLLOKOSA-N 1 1 249.423 3.619 20 0 BHADMO CC(C)[N@H+](Cc1ccccc1F)C[C@H]1C[C@@H]1C ZINC000552278147 388688653 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/nfs/dbraw/zinc/68/98/74/388689874.db2.gz AVKGLZUSMVYOTB-UHFFFAOYSA-N 1 1 235.346 3.633 20 0 BHADMO CS[C@@H]1CCCC[N@H+]([C@H](C)CC(C)C)C1 ZINC000552281105 388689343 /nfs/dbraw/zinc/68/93/43/388689343.db2.gz HLUCALSGMKEQKM-CHWSQXEVSA-N 1 1 229.433 3.639 20 0 BHADMO CS[C@H]1CCCC[N@H+]([C@H](C)CC(C)C)C1 ZINC000552281106 388689920 /nfs/dbraw/zinc/68/99/20/388689920.db2.gz HLUCALSGMKEQKM-OLZOCXBDSA-N 1 1 229.433 3.639 20 0 BHADMO CS[C@@H]1CCCC[N@H+]([C@@H](C)CC(C)C)C1 ZINC000552281107 388689503 /nfs/dbraw/zinc/68/95/03/388689503.db2.gz HLUCALSGMKEQKM-QWHCGFSZSA-N 1 1 229.433 3.639 20 0 BHADMO CS[C@H]1CCCC[N@H+]([C@@H](C)CC(C)C)C1 ZINC000552281108 388689867 /nfs/dbraw/zinc/68/98/67/388689867.db2.gz HLUCALSGMKEQKM-STQMWFEESA-N 1 1 229.433 3.639 20 0 BHADMO CC(C)C[C@@H](C)[N@H+]1CCc2cccc(F)c2C1 ZINC000552281118 388689847 /nfs/dbraw/zinc/68/98/47/388689847.db2.gz HRNQAFBHRJWIHH-GFCCVEGCSA-N 1 1 235.346 3.618 20 0 BHADMO CC(C)C[C@H](C)[N@H+]1CCc2cccc(F)c2C1 ZINC000552281119 388689750 /nfs/dbraw/zinc/68/97/50/388689750.db2.gz HRNQAFBHRJWIHH-LBPRGKRZSA-N 1 1 235.346 3.618 20 0 BHADMO Cc1ccc(C[N@H+](C)CCCOC(C)C)cc1C ZINC000552290224 388689564 /nfs/dbraw/zinc/68/95/64/388689564.db2.gz BNJKVKNWVYIQBI-UHFFFAOYSA-N 1 1 249.398 3.550 20 0 BHADMO Cc1cccc(C[N@H+](C)CCCOC(C)C)c1C ZINC000552290418 388689709 /nfs/dbraw/zinc/68/97/09/388689709.db2.gz INZLGPVPPBYYHM-UHFFFAOYSA-N 1 1 249.398 3.550 20 0 BHADMO COc1ccccc1C[N@H+]1CC(C)(C)[C@@H]1C(C)C ZINC000552292719 388691057 /nfs/dbraw/zinc/69/10/57/388691057.db2.gz CMPJJEOGHFPLNC-HNNXBMFYSA-N 1 1 247.382 3.562 20 0 BHADMO COc1ccccc1C[N@H+]1CC(C)(C)[C@H]1C(C)C ZINC000552292720 388691008 /nfs/dbraw/zinc/69/10/08/388691008.db2.gz CMPJJEOGHFPLNC-OAHLLOKOSA-N 1 1 247.382 3.562 20 0 BHADMO CC(C)C[N@H+]1CC2(CCC2)[C@@H]1c1ccccc1 ZINC000552316821 388693456 /nfs/dbraw/zinc/69/34/56/388693456.db2.gz NRMGOZXSZOZULU-HNNXBMFYSA-N 1 1 229.367 3.870 20 0 BHADMO CC(C)C[N@H+]1CC2(CCC2)[C@H]1c1ccccc1 ZINC000552316822 388693508 /nfs/dbraw/zinc/69/35/08/388693508.db2.gz NRMGOZXSZOZULU-OAHLLOKOSA-N 1 1 229.367 3.870 20 0 BHADMO Cc1ccc(C[N@@H+](C)CCOC(C)(C)C)cc1C ZINC000552343927 388695608 /nfs/dbraw/zinc/69/56/08/388695608.db2.gz TWKYZEVSGSNIBM-UHFFFAOYSA-N 1 1 249.398 3.550 20 0 BHADMO C[C@@H](CC[N@H+]1CCC[C@@H]1CF)c1ccccc1 ZINC000552392088 388701781 /nfs/dbraw/zinc/70/17/81/388701781.db2.gz GDNKBBZVKRVBMQ-DZGCQCFKSA-N 1 1 235.346 3.614 20 0 BHADMO C[C@H](CC[N@H+]1CCC[C@H]1CF)c1ccccc1 ZINC000552392089 388702031 /nfs/dbraw/zinc/70/20/31/388702031.db2.gz GDNKBBZVKRVBMQ-HIFRSBDPSA-N 1 1 235.346 3.614 20 0 BHADMO C[C@H](CC[N@H+]1CCC[C@@H]1CF)c1ccccc1 ZINC000552392090 388702171 /nfs/dbraw/zinc/70/21/71/388702171.db2.gz GDNKBBZVKRVBMQ-UKRRQHHQSA-N 1 1 235.346 3.614 20 0 BHADMO C[C@@H](CC[N@H+]1CCC[C@H]1CF)c1ccccc1 ZINC000552392091 388701852 /nfs/dbraw/zinc/70/18/52/388701852.db2.gz GDNKBBZVKRVBMQ-ZFWWWQNUSA-N 1 1 235.346 3.614 20 0 BHADMO Cc1ccsc1C[N@H+]1CC[C@H](CC2CC2)C1 ZINC000552408142 388704183 /nfs/dbraw/zinc/70/41/83/388704183.db2.gz YVTKQLTWPSAUFZ-CYBMUJFWSA-N 1 1 235.396 3.679 20 0 BHADMO Cc1ccsc1C[N@H+]1CC[C@@H](CC2CC2)C1 ZINC000552408143 388704406 /nfs/dbraw/zinc/70/44/06/388704406.db2.gz YVTKQLTWPSAUFZ-ZDUSSCGKSA-N 1 1 235.396 3.679 20 0 BHADMO CC[C@@H](C)[N@@H+](C)CCc1ccccc1Cl ZINC000552508366 388719896 /nfs/dbraw/zinc/71/98/96/388719896.db2.gz CWTHQJSXVJLGNQ-LLVKDONJSA-N 1 1 225.763 3.613 20 0 BHADMO CC[C@H](C)[N@@H+](C)CCc1ccccc1Cl ZINC000552508367 388719966 /nfs/dbraw/zinc/71/99/66/388719966.db2.gz CWTHQJSXVJLGNQ-NSHDSACASA-N 1 1 225.763 3.613 20 0 BHADMO COc1ccccc1CC[N@@H+](C)[C@@H](C)CC(C)C ZINC000552560084 388725260 /nfs/dbraw/zinc/72/52/60/388725260.db2.gz GNVQLXXHQYMARA-AWEZNQCLSA-N 1 1 249.398 3.604 20 0 BHADMO COc1ccccc1CC[N@@H+](C)[C@H](C)CC(C)C ZINC000552560085 388725542 /nfs/dbraw/zinc/72/55/42/388725542.db2.gz GNVQLXXHQYMARA-CQSZACIVSA-N 1 1 249.398 3.604 20 0 BHADMO CC(C)C[C@@H](C)[N@@H+](C)CCc1cccs1 ZINC000552577476 388728209 /nfs/dbraw/zinc/72/82/09/388728209.db2.gz FGMOHXOAAUMHDC-GFCCVEGCSA-N 1 1 225.401 3.657 20 0 BHADMO CC(C)C[C@H](C)[N@@H+](C)CCc1cccs1 ZINC000552577477 388728736 /nfs/dbraw/zinc/72/87/36/388728736.db2.gz FGMOHXOAAUMHDC-LBPRGKRZSA-N 1 1 225.401 3.657 20 0 BHADMO C[C@H](C1CC1)[N@@H+](C)CCc1ccccc1Cl ZINC000552578505 388729693 /nfs/dbraw/zinc/72/96/93/388729693.db2.gz MCIUZLAHGOFEAU-LLVKDONJSA-N 1 1 237.774 3.613 20 0 BHADMO COc1ccc(C[N@@H+](C)[C@H]2CCCC[C@@H]2C)cc1 ZINC000552579579 388729327 /nfs/dbraw/zinc/72/93/27/388729327.db2.gz MJSQIVVSZRRXTJ-BBRMVZONSA-N 1 1 247.382 3.706 20 0 BHADMO COc1ccc(C[N@@H+](C)[C@H]2CCCC[C@H]2C)cc1 ZINC000552579583 388729322 /nfs/dbraw/zinc/72/93/22/388729322.db2.gz MJSQIVVSZRRXTJ-CJNGLKHVSA-N 1 1 247.382 3.706 20 0 BHADMO COc1ccc(C[N@@H+](C)[C@@H]2CCCC[C@H]2C)cc1 ZINC000552579584 388730172 /nfs/dbraw/zinc/73/01/72/388730172.db2.gz MJSQIVVSZRRXTJ-CZUORRHYSA-N 1 1 247.382 3.706 20 0 BHADMO COc1ccc(C[N@@H+](C)[C@@H]2CCCC[C@@H]2C)cc1 ZINC000552579585 388729743 /nfs/dbraw/zinc/72/97/43/388729743.db2.gz MJSQIVVSZRRXTJ-XJKSGUPXSA-N 1 1 247.382 3.706 20 0 BHADMO CCOc1ccccc1C[N@@H+](C)[C@@H](C)CC(C)C ZINC000552828512 388737760 /nfs/dbraw/zinc/73/77/60/388737760.db2.gz WDOSQHOZNIECHI-AWEZNQCLSA-N 1 1 249.398 3.952 20 0 BHADMO CCOc1ccccc1C[N@@H+](C)[C@H](C)CC(C)C ZINC000552828529 388737391 /nfs/dbraw/zinc/73/73/91/388737391.db2.gz WDOSQHOZNIECHI-CQSZACIVSA-N 1 1 249.398 3.952 20 0 BHADMO CCOc1ccc(C[N@@H+](C)[C@@H](C)CC(C)C)cc1 ZINC000552852196 388738569 /nfs/dbraw/zinc/73/85/69/388738569.db2.gz MSPNWNSFKGVRLV-AWEZNQCLSA-N 1 1 249.398 3.952 20 0 BHADMO CCOc1ccc(C[N@@H+](C)[C@H](C)CC(C)C)cc1 ZINC000552852197 388738707 /nfs/dbraw/zinc/73/87/07/388738707.db2.gz MSPNWNSFKGVRLV-CQSZACIVSA-N 1 1 249.398 3.952 20 0 BHADMO CCSCC[N@H+]1CCc2ccccc2C1(C)C ZINC000553025614 388745722 /nfs/dbraw/zinc/74/57/22/388745722.db2.gz GXOUYBJJXSILES-UHFFFAOYSA-N 1 1 249.423 3.533 20 0 BHADMO CC[C@H](C)C[N@@H+](C)C[C@H](C)c1ccc(OC)cc1 ZINC000553133323 388749107 /nfs/dbraw/zinc/74/91/07/388749107.db2.gz DCSOBSZNJHKJFJ-KBPBESRZSA-N 1 1 249.398 3.777 20 0 BHADMO CC[C@@H](C)C[N@@H+](C)C[C@H](C)c1ccc(OC)cc1 ZINC000553133324 388749665 /nfs/dbraw/zinc/74/96/65/388749665.db2.gz DCSOBSZNJHKJFJ-KGLIPLIRSA-N 1 1 249.398 3.777 20 0 BHADMO CC[C@H](C)C[N@@H+](C)C[C@@H](C)c1ccc(OC)cc1 ZINC000553133325 388748796 /nfs/dbraw/zinc/74/87/96/388748796.db2.gz DCSOBSZNJHKJFJ-UONOGXRCSA-N 1 1 249.398 3.777 20 0 BHADMO CC[C@@H](C)C[N@@H+](C)C[C@@H](C)c1ccc(OC)cc1 ZINC000553133326 388749525 /nfs/dbraw/zinc/74/95/25/388749525.db2.gz DCSOBSZNJHKJFJ-ZIAGYGMSSA-N 1 1 249.398 3.777 20 0 BHADMO Cc1cccc(C)c1C[N@H+](C)[C@H](C)C1CC1 ZINC000553134738 388749718 /nfs/dbraw/zinc/74/97/18/388749718.db2.gz RAUTZDUKLNICAW-CYBMUJFWSA-N 1 1 217.356 3.534 20 0 BHADMO Cc1cccc(C)c1C[N@H+](C)[C@@H](C)C1CC1 ZINC000553134739 388749642 /nfs/dbraw/zinc/74/96/42/388749642.db2.gz RAUTZDUKLNICAW-ZDUSSCGKSA-N 1 1 217.356 3.534 20 0 BHADMO CCC[C@@H]1CCCCN1c1cc(C)[nH+]c(CC)n1 ZINC000553162487 325679068 /nfs/dbraw/zinc/67/90/68/325679068.db2.gz YDVVOGVPGBQQGV-CYBMUJFWSA-N 1 1 247.386 3.506 20 0 BHADMO CCC[C@H]1CCCCN1c1cc(C)[nH+]c(CC)n1 ZINC000553162488 325679070 /nfs/dbraw/zinc/67/90/70/325679070.db2.gz YDVVOGVPGBQQGV-ZDUSSCGKSA-N 1 1 247.386 3.506 20 0 BHADMO C/C(=C/c1ccccc1)C[N@@H+]1CC[C@H]1C(C)C ZINC000553165219 388750193 /nfs/dbraw/zinc/75/01/93/388750193.db2.gz PGFDXYVTVSSVQE-QBOMHBFWSA-N 1 1 229.367 3.820 20 0 BHADMO C/C(=C/c1ccccc1)C[N@@H+]1CC[C@@H]1C(C)C ZINC000553165220 388750613 /nfs/dbraw/zinc/75/06/13/388750613.db2.gz PGFDXYVTVSSVQE-SYCZXOQXSA-N 1 1 229.367 3.820 20 0 BHADMO C/C(=C\c1ccccc1)C[N@@H+]1CC[C@H]1C(C)C ZINC000553165221 388750778 /nfs/dbraw/zinc/75/07/78/388750778.db2.gz PGFDXYVTVSSVQE-UKYUDJEDSA-N 1 1 229.367 3.820 20 0 BHADMO C/C(=C\c1ccccc1)C[N@@H+]1CC[C@@H]1C(C)C ZINC000553165222 388750700 /nfs/dbraw/zinc/75/07/00/388750700.db2.gz PGFDXYVTVSSVQE-WSYSLRRZSA-N 1 1 229.367 3.820 20 0 BHADMO Cc1cccc(C)c1C[N@H+](C)CCCOC(C)C ZINC000553179393 388751754 /nfs/dbraw/zinc/75/17/54/388751754.db2.gz APYKMLNLHPLRMB-UHFFFAOYSA-N 1 1 249.398 3.550 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@@H](C)CC(C)C)cc1 ZINC000553181914 388751720 /nfs/dbraw/zinc/75/17/20/388751720.db2.gz FRFMTZWHKBBDHW-AWEZNQCLSA-N 1 1 219.372 3.861 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@H](C)CC(C)C)cc1 ZINC000553181915 388751856 /nfs/dbraw/zinc/75/18/56/388751856.db2.gz FRFMTZWHKBBDHW-CQSZACIVSA-N 1 1 219.372 3.861 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@H](C)C(C)(C)C)cc1 ZINC000553182141 388751821 /nfs/dbraw/zinc/75/18/21/388751821.db2.gz QHVSDSRTIABRIV-CYBMUJFWSA-N 1 1 219.372 3.861 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@@H](C)C(C)(C)C)cc1 ZINC000553182142 388751106 /nfs/dbraw/zinc/75/11/06/388751106.db2.gz QHVSDSRTIABRIV-ZDUSSCGKSA-N 1 1 219.372 3.861 20 0 BHADMO CC(C)[C@@H]1CC[N@H+]1C[C@H]1C[C@@H]1c1ccccc1 ZINC000553500071 388778482 /nfs/dbraw/zinc/77/84/82/388778482.db2.gz PAXJGEVYEAYLDW-OAGGEKHMSA-N 1 1 229.367 3.520 20 0 BHADMO CC(C)[C@@H]1CC[N@H+]1C[C@H]1C[C@H]1c1ccccc1 ZINC000553500072 388778102 /nfs/dbraw/zinc/77/81/02/388778102.db2.gz PAXJGEVYEAYLDW-PMPSAXMXSA-N 1 1 229.367 3.520 20 0 BHADMO CC(C)[C@@H]1CC[N@H+]1C[C@@H]1C[C@@H]1c1ccccc1 ZINC000553500073 388778973 /nfs/dbraw/zinc/77/89/73/388778973.db2.gz PAXJGEVYEAYLDW-XHSDSOJGSA-N 1 1 229.367 3.520 20 0 BHADMO CC[N@@H+](Cc1ccccc1)[C@H]1C=CCCC1 ZINC000553543518 388781315 /nfs/dbraw/zinc/78/13/15/388781315.db2.gz GSAKSEOUZSQOOD-HNNXBMFYSA-N 1 1 215.340 3.617 20 0 BHADMO CC[N@@H+](Cc1ccccc1)[C@@H]1C=CCCC1 ZINC000553543519 388781203 /nfs/dbraw/zinc/78/12/03/388781203.db2.gz GSAKSEOUZSQOOD-OAHLLOKOSA-N 1 1 215.340 3.617 20 0 BHADMO Fc1ccc(C[N@@H+](C2CC2)[C@H]2C=CCCC2)cc1 ZINC000553543758 388781057 /nfs/dbraw/zinc/78/10/57/388781057.db2.gz FDWHQONBURCTBH-HNNXBMFYSA-N 1 1 245.341 3.899 20 0 BHADMO Fc1ccc(C[N@@H+](C2CC2)[C@@H]2C=CCCC2)cc1 ZINC000553543760 388780969 /nfs/dbraw/zinc/78/09/69/388780969.db2.gz FDWHQONBURCTBH-OAHLLOKOSA-N 1 1 245.341 3.899 20 0 BHADMO CC[N@@H+](Cc1cc(F)ccc1F)[C@H](C)C(C)C ZINC000553640204 388784599 /nfs/dbraw/zinc/78/45/99/388784599.db2.gz QGYVBZKCGMYLGP-LLVKDONJSA-N 1 1 241.325 3.831 20 0 BHADMO CC[N@@H+](Cc1cc(F)ccc1F)[C@@H](C)C(C)C ZINC000553640205 388784998 /nfs/dbraw/zinc/78/49/98/388784998.db2.gz QGYVBZKCGMYLGP-NSHDSACASA-N 1 1 241.325 3.831 20 0 BHADMO CCC[N@H+](Cc1cc(F)ccc1F)CC(C)C ZINC000553828659 388791035 /nfs/dbraw/zinc/79/10/35/388791035.db2.gz JLQPDMDDWAVAQM-UHFFFAOYSA-N 1 1 241.325 3.833 20 0 BHADMO CCC[N@@H+](Cc1ccc(F)c(F)c1)C(C)C ZINC000553837207 388790871 /nfs/dbraw/zinc/79/08/71/388790871.db2.gz XRRRXMCFGPOPQZ-UHFFFAOYSA-N 1 1 227.298 3.585 20 0 BHADMO CC(C)C[N@@H+](C[C@@H]1Cc2ccccc21)C(C)C ZINC000553863976 388792358 /nfs/dbraw/zinc/79/23/58/388792358.db2.gz LDZKQJYOSXFLEZ-HNNXBMFYSA-N 1 1 231.383 3.693 20 0 BHADMO CC(C)C[N@@H+](C[C@H]1Cc2ccccc21)C(C)C ZINC000553863977 388792797 /nfs/dbraw/zinc/79/27/97/388792797.db2.gz LDZKQJYOSXFLEZ-OAHLLOKOSA-N 1 1 231.383 3.693 20 0 BHADMO CCC[N@@H+](CCc1ccccc1F)CC(C)C ZINC000553881455 388793509 /nfs/dbraw/zinc/79/35/09/388793509.db2.gz XCNXRUJBDPDBHP-UHFFFAOYSA-N 1 1 237.362 3.736 20 0 BHADMO CC(C)C[N@@H+](CCOC1CCC1)CC(C)(C)C ZINC000553884434 388793277 /nfs/dbraw/zinc/79/32/77/388793277.db2.gz ZDIAYIALKXPWDX-UHFFFAOYSA-N 1 1 241.419 3.560 20 0 BHADMO CCCCC[C@H]1CCC[N@H+]1CCOC1CCC1 ZINC000553884590 388793221 /nfs/dbraw/zinc/79/32/21/388793221.db2.gz IJAVXMXCSXYACV-AWEZNQCLSA-N 1 1 239.403 3.600 20 0 BHADMO CCCCC[C@@H]1CCC[N@H+]1CCOC1CCC1 ZINC000553884591 388792572 /nfs/dbraw/zinc/79/25/72/388792572.db2.gz IJAVXMXCSXYACV-CQSZACIVSA-N 1 1 239.403 3.600 20 0 BHADMO CCCC[N@@H+](C)[C@@H](CC)c1ccccc1OC ZINC000553987962 388796610 /nfs/dbraw/zinc/79/66/10/388796610.db2.gz UIIIZLYPRCHKJC-AWEZNQCLSA-N 1 1 235.371 3.878 20 0 BHADMO CCCC[N@@H+](C)[C@H](CC)c1ccccc1OC ZINC000553987963 388796548 /nfs/dbraw/zinc/79/65/48/388796548.db2.gz UIIIZLYPRCHKJC-CQSZACIVSA-N 1 1 235.371 3.878 20 0 BHADMO COCCCC[N@H+]1CC[C@H](C(C)(C)C)C[C@@H]1C ZINC000553990955 388795971 /nfs/dbraw/zinc/79/59/71/388795971.db2.gz BICIYMGPSROGIC-KBPBESRZSA-N 1 1 241.419 3.560 20 0 BHADMO COCCCC[N@H+]1CC[C@H](C(C)(C)C)C[C@H]1C ZINC000553990956 388796813 /nfs/dbraw/zinc/79/68/13/388796813.db2.gz BICIYMGPSROGIC-KGLIPLIRSA-N 1 1 241.419 3.560 20 0 BHADMO COCCCC[N@H+]1CC[C@@H](C(C)(C)C)C[C@@H]1C ZINC000553990957 388796329 /nfs/dbraw/zinc/79/63/29/388796329.db2.gz BICIYMGPSROGIC-UONOGXRCSA-N 1 1 241.419 3.560 20 0 BHADMO COCCCC[N@H+]1CC[C@@H](C(C)(C)C)C[C@H]1C ZINC000553990958 388796729 /nfs/dbraw/zinc/79/67/29/388796729.db2.gz BICIYMGPSROGIC-ZIAGYGMSSA-N 1 1 241.419 3.560 20 0 BHADMO CC[C@@H](c1ccccc1OC)[N@@H+](C)CCC1CC1 ZINC000553991865 388796463 /nfs/dbraw/zinc/79/64/63/388796463.db2.gz HJFZNQRQDHSHSR-HNNXBMFYSA-N 1 1 247.382 3.878 20 0 BHADMO CC[C@H](c1ccccc1OC)[N@@H+](C)CCC1CC1 ZINC000553991869 388796778 /nfs/dbraw/zinc/79/67/78/388796778.db2.gz HJFZNQRQDHSHSR-OAHLLOKOSA-N 1 1 247.382 3.878 20 0 BHADMO C[C@@H]1C[C@H](C(C)(C)C)CC[N@H+]1CCCCF ZINC000553992288 388796245 /nfs/dbraw/zinc/79/62/45/388796245.db2.gz QXOSGMJGHJORPI-CHWSQXEVSA-N 1 1 229.383 3.883 20 0 BHADMO C[C@@H]1C[C@@H](C(C)(C)C)CC[N@H+]1CCCCF ZINC000553992289 388796627 /nfs/dbraw/zinc/79/66/27/388796627.db2.gz QXOSGMJGHJORPI-OLZOCXBDSA-N 1 1 229.383 3.883 20 0 BHADMO C[C@H]1C[C@H](C(C)(C)C)CC[N@H+]1CCCCF ZINC000553992290 388795695 /nfs/dbraw/zinc/79/56/95/388795695.db2.gz QXOSGMJGHJORPI-QWHCGFSZSA-N 1 1 229.383 3.883 20 0 BHADMO C[C@H]1C[C@@H](C(C)(C)C)CC[N@H+]1CCCCF ZINC000553992291 388795774 /nfs/dbraw/zinc/79/57/74/388795774.db2.gz QXOSGMJGHJORPI-STQMWFEESA-N 1 1 229.383 3.883 20 0 BHADMO CC1(C)C[N@@H+](CC2CC2)[C@@H]1c1cccs1 ZINC000553992342 388796022 /nfs/dbraw/zinc/79/60/22/388796022.db2.gz SFKJZKHHGJRNNV-GFCCVEGCSA-N 1 1 221.369 3.541 20 0 BHADMO CC1(C)C[N@@H+](CC2CC2)[C@H]1c1cccs1 ZINC000553992349 388796122 /nfs/dbraw/zinc/79/61/22/388796122.db2.gz SFKJZKHHGJRNNV-LBPRGKRZSA-N 1 1 221.369 3.541 20 0 BHADMO CC1(C)C[N@@H+](CC2CCC2)[C@@H]1c1cccs1 ZINC000553992610 388796131 /nfs/dbraw/zinc/79/61/31/388796131.db2.gz MXHAVYXDFVKIJW-CYBMUJFWSA-N 1 1 235.396 3.931 20 0 BHADMO CC1(C)C[N@@H+](CC2CCC2)[C@H]1c1cccs1 ZINC000553992611 388795783 /nfs/dbraw/zinc/79/57/83/388795783.db2.gz MXHAVYXDFVKIJW-ZDUSSCGKSA-N 1 1 235.396 3.931 20 0 BHADMO CC[C@H](C)[N@H+]1CC(C)(C)[C@H]1c1cccs1 ZINC000553992915 388796071 /nfs/dbraw/zinc/79/60/71/388796071.db2.gz PRLRJVGBVKOVOJ-CMPLNLGQSA-N 1 1 223.385 3.930 20 0 BHADMO CC[C@H](C)[N@H+]1CC(C)(C)[C@@H]1c1cccs1 ZINC000553992917 388796155 /nfs/dbraw/zinc/79/61/55/388796155.db2.gz PRLRJVGBVKOVOJ-JQWIXIFHSA-N 1 1 223.385 3.930 20 0 BHADMO CC[C@@H](C)[N@H+]1CC(C)(C)[C@@H]1c1cccs1 ZINC000553992918 388796907 /nfs/dbraw/zinc/79/69/07/388796907.db2.gz PRLRJVGBVKOVOJ-PWSUYJOCSA-N 1 1 223.385 3.930 20 0 BHADMO CC[C@@H](C)[N@H+]1CC(C)(C)[C@H]1c1cccs1 ZINC000553992919 388796686 /nfs/dbraw/zinc/79/66/86/388796686.db2.gz PRLRJVGBVKOVOJ-ZYHUDNBSSA-N 1 1 223.385 3.930 20 0 BHADMO C/C=C/c1ccc(N[C@@H]2CC[N@@H+](C)[C@@H](C)C2)cc1 ZINC000554090100 388800114 /nfs/dbraw/zinc/80/01/14/388800114.db2.gz MHTGEIQRGZLUJI-KJJZUGDZSA-N 1 1 244.382 3.614 20 0 BHADMO C/C=C/c1ccc(N[C@@H]2CC[N@@H+](C)[C@H](C)C2)cc1 ZINC000554090102 388798951 /nfs/dbraw/zinc/79/89/51/388798951.db2.gz MHTGEIQRGZLUJI-LVQRLBQTSA-N 1 1 244.382 3.614 20 0 BHADMO C/C=C\c1ccc(N[C@@H]2CC[N@@H+](C)[C@@H](C)C2)cc1 ZINC000554090105 388799788 /nfs/dbraw/zinc/79/97/88/388799788.db2.gz MHTGEIQRGZLUJI-WAXTVWTQSA-N 1 1 244.382 3.614 20 0 BHADMO C/C=C\c1ccc(N[C@@H]2CC[N@@H+](C)[C@H](C)C2)cc1 ZINC000554090106 541475073 /nfs/dbraw/zinc/47/50/73/541475073.db2.gz MHTGEIQRGZLUJI-WSXGPOFGSA-N 1 1 244.382 3.614 20 0 BHADMO CCC[N@@H+](Cc1ccccc1C)C(C)C ZINC000554181168 388802938 /nfs/dbraw/zinc/80/29/38/388802938.db2.gz RMPODLXREHDFLV-UHFFFAOYSA-N 1 1 205.345 3.615 20 0 BHADMO CC[N@H+](Cc1ccc(C)cc1C)CC(C)C ZINC000554185196 388803521 /nfs/dbraw/zinc/80/35/21/388803521.db2.gz HGEVZUMSHVKXPT-UHFFFAOYSA-N 1 1 219.372 3.781 20 0 BHADMO CCC[N@@H+](Cc1ccc(CC)cc1)C(C)C ZINC000554185701 388803028 /nfs/dbraw/zinc/80/30/28/388803028.db2.gz VTZLWOGOEFRWBO-UHFFFAOYSA-N 1 1 219.372 3.869 20 0 BHADMO CC[C@@H](C)[N@@H+](CC)Cc1ccccc1C ZINC000554196345 388803611 /nfs/dbraw/zinc/80/36/11/388803611.db2.gz OBAHODJLRFZXSL-CYBMUJFWSA-N 1 1 205.345 3.615 20 0 BHADMO CC[C@H](C)[N@@H+](CC)Cc1ccccc1C ZINC000554196346 388803548 /nfs/dbraw/zinc/80/35/48/388803548.db2.gz OBAHODJLRFZXSL-ZDUSSCGKSA-N 1 1 205.345 3.615 20 0 BHADMO CC(C)[N@@H+](CCOC1CCC1)C1CCCCC1 ZINC000554241199 388805812 /nfs/dbraw/zinc/80/58/12/388805812.db2.gz FJDVCPYTVCJDQH-UHFFFAOYSA-N 1 1 239.403 3.599 20 0 BHADMO CC[N@@H+](C)[C@@H](C)Cc1ccccc1C(F)(F)F ZINC000554278170 388807789 /nfs/dbraw/zinc/80/77/89/388807789.db2.gz XCAQCDPZZUWIKL-JTQLQIEISA-N 1 1 245.288 3.588 20 0 BHADMO CC[N@@H+](C)[C@H](C)Cc1ccccc1C(F)(F)F ZINC000554278171 388806328 /nfs/dbraw/zinc/80/63/28/388806328.db2.gz XCAQCDPZZUWIKL-SNVBAGLBSA-N 1 1 245.288 3.588 20 0 BHADMO CC(C)C[N@H+]1CCCn2c(cc3ccccc32)C1 ZINC000554305714 388808862 /nfs/dbraw/zinc/80/88/62/388808862.db2.gz NPLJBVLSDQMWRS-UHFFFAOYSA-N 1 1 242.366 3.503 20 0 BHADMO CC[C@H](C)C[N@@H+](C)C1CCC(F)(F)CC1 ZINC000554308372 388808451 /nfs/dbraw/zinc/80/84/51/388808451.db2.gz WLDPDHYZZMDNGG-JTQLQIEISA-N 1 1 219.319 3.542 20 0 BHADMO CC[C@@H](C)C[N@@H+](C)C1CCC(F)(F)CC1 ZINC000554308373 388809029 /nfs/dbraw/zinc/80/90/29/388809029.db2.gz WLDPDHYZZMDNGG-SNVBAGLBSA-N 1 1 219.319 3.542 20 0 BHADMO CC[C@@H](c1ccccc1OC)[N@@H+](C)CC(C)C ZINC000554309493 388808927 /nfs/dbraw/zinc/80/89/27/388808927.db2.gz RXSRCLSGKORHIH-AWEZNQCLSA-N 1 1 235.371 3.734 20 0 BHADMO CC[C@H](c1ccccc1OC)[N@@H+](C)CC(C)C ZINC000554309494 388808478 /nfs/dbraw/zinc/80/84/78/388808478.db2.gz RXSRCLSGKORHIH-CQSZACIVSA-N 1 1 235.371 3.734 20 0 BHADMO CCC[N@H+]1CC(C)(C)[C@H]1c1cccs1 ZINC000554310283 388809438 /nfs/dbraw/zinc/80/94/38/388809438.db2.gz LSEPUCZHGZLHMI-LLVKDONJSA-N 1 1 209.358 3.541 20 0 BHADMO CCC[N@H+]1CC(C)(C)[C@@H]1c1cccs1 ZINC000554310285 388809385 /nfs/dbraw/zinc/80/93/85/388809385.db2.gz LSEPUCZHGZLHMI-NSHDSACASA-N 1 1 209.358 3.541 20 0 BHADMO CC1(C)C[N@@H+](C2CCC2)[C@@H]1c1cccs1 ZINC000554310424 388809186 /nfs/dbraw/zinc/80/91/86/388809186.db2.gz LODVFEKKSLIVJZ-GFCCVEGCSA-N 1 1 221.369 3.684 20 0 BHADMO CC1(C)C[N@@H+](C2CCC2)[C@H]1c1cccs1 ZINC000554310425 388808346 /nfs/dbraw/zinc/80/83/46/388808346.db2.gz LODVFEKKSLIVJZ-LBPRGKRZSA-N 1 1 221.369 3.684 20 0 BHADMO CC[C@@H](c1ccccc1OC)[N@@H+](C)CC1CCC1 ZINC000554310866 388809119 /nfs/dbraw/zinc/80/91/19/388809119.db2.gz STSQKJOPWYXJHE-HNNXBMFYSA-N 1 1 247.382 3.878 20 0 BHADMO CC[C@H](c1ccccc1OC)[N@@H+](C)CC1CCC1 ZINC000554310868 388808362 /nfs/dbraw/zinc/80/83/62/388808362.db2.gz STSQKJOPWYXJHE-OAHLLOKOSA-N 1 1 247.382 3.878 20 0 BHADMO CC(C)C[N@@H+](Cc1ccc(Cl)cn1)C(C)C ZINC000554316525 388808201 /nfs/dbraw/zinc/80/82/01/388808201.db2.gz IGPRPEBORPGDKI-UHFFFAOYSA-N 1 1 240.778 3.601 20 0 BHADMO CC[C@@H]1CC[C@H]1Nc1cccc2cc[nH+]cc21 ZINC000554385640 388813926 /nfs/dbraw/zinc/81/39/26/388813926.db2.gz GIFVZXYRVWUNRT-BXUZGUMPSA-N 1 1 226.323 3.835 20 0 BHADMO CC[C@H]1CC[C@@H]1Nc1cccc2cc[nH+]cc21 ZINC000554385641 325717904 /nfs/dbraw/zinc/71/79/04/325717904.db2.gz GIFVZXYRVWUNRT-FZMZJTMJSA-N 1 1 226.323 3.835 20 0 BHADMO CC[C@@H]1CC[C@@H]1Nc1cccc2cc[nH+]cc21 ZINC000554385642 325717835 /nfs/dbraw/zinc/71/78/35/325717835.db2.gz GIFVZXYRVWUNRT-RISCZKNCSA-N 1 1 226.323 3.835 20 0 BHADMO CC[C@H]1CC[C@H]1Nc1cccc2cc[nH+]cc21 ZINC000554385643 325717637 /nfs/dbraw/zinc/71/76/37/325717637.db2.gz GIFVZXYRVWUNRT-SMDDNHRTSA-N 1 1 226.323 3.835 20 0 BHADMO CCCCOCC[N@@H+](CC)Cc1ccc(C)cc1 ZINC000554454733 388815707 /nfs/dbraw/zinc/81/57/07/388815707.db2.gz SEMLLWRDYZXAAW-UHFFFAOYSA-N 1 1 249.398 3.634 20 0 BHADMO Cc1cccc(CCC[N@H+](C)[C@@H](C)C2CC2)c1 ZINC000554494705 388817262 /nfs/dbraw/zinc/81/72/62/388817262.db2.gz KYEJKSPKLUSRNO-AWEZNQCLSA-N 1 1 231.383 3.658 20 0 BHADMO Cc1cccc(CCC[N@H+](C)[C@H](C)C2CC2)c1 ZINC000554494706 388817203 /nfs/dbraw/zinc/81/72/03/388817203.db2.gz KYEJKSPKLUSRNO-CQSZACIVSA-N 1 1 231.383 3.658 20 0 BHADMO CC(C)[N@@H+](C[C@H](C)c1ccccc1)CC1CC1 ZINC000554726311 388829653 /nfs/dbraw/zinc/82/96/53/388829653.db2.gz UNHAKLAOXWUVFZ-AWEZNQCLSA-N 1 1 231.383 3.911 20 0 BHADMO CC(C)[N@@H+](C[C@@H](C)c1ccccc1)CC1CC1 ZINC000554726314 388829538 /nfs/dbraw/zinc/82/95/38/388829538.db2.gz UNHAKLAOXWUVFZ-CQSZACIVSA-N 1 1 231.383 3.911 20 0 BHADMO c1ccc([C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3C2CCC2)cc1 ZINC000554836056 388832953 /nfs/dbraw/zinc/83/29/53/388832953.db2.gz XSFIWASFFCKJDZ-ACHSLPGTSA-N 1 1 241.378 3.950 20 0 BHADMO CCC[C@@H](C)[N@H+]1CCC(C)=C(c2ccco2)C1 ZINC000554837563 388832347 /nfs/dbraw/zinc/83/23/47/388832347.db2.gz PEZIPXMRDAYPNM-CYBMUJFWSA-N 1 1 233.355 3.947 20 0 BHADMO CCC[C@H](C)[N@H+]1CCC(C)=C(c2ccco2)C1 ZINC000554837564 388832761 /nfs/dbraw/zinc/83/27/61/388832761.db2.gz PEZIPXMRDAYPNM-ZDUSSCGKSA-N 1 1 233.355 3.947 20 0 BHADMO C[C@H](C1CCCCC1)[N@@H+](C)CCc1cccnc1 ZINC000554837578 388833468 /nfs/dbraw/zinc/83/34/68/388833468.db2.gz QFWHTOUSQYTFBR-CQSZACIVSA-N 1 1 246.398 3.525 20 0 BHADMO CC[C@@H](F)C[N@@H+](C)[C@H](C)C1CCCCC1 ZINC000554839252 388832739 /nfs/dbraw/zinc/83/27/39/388832739.db2.gz IWJVOLMWZLMNTK-DGCLKSJQSA-N 1 1 215.356 3.635 20 0 BHADMO CC[C@H](F)C[N@@H+](C)[C@H](C)C1CCCCC1 ZINC000554839259 388833805 /nfs/dbraw/zinc/83/38/05/388833805.db2.gz IWJVOLMWZLMNTK-YPMHNXCESA-N 1 1 215.356 3.635 20 0 BHADMO CCC[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](c1ccccc1)C2 ZINC000554846414 388833032 /nfs/dbraw/zinc/83/30/32/388833032.db2.gz VVGMNHGELZACOY-MUJYYYPQSA-N 1 1 229.367 3.807 20 0 BHADMO CC(C)SCC[N@@H+](CC1CC1)CC1CCC1 ZINC000554848858 388833162 /nfs/dbraw/zinc/83/31/62/388833162.db2.gz SCRPZAGLTIMKPU-UHFFFAOYSA-N 1 1 241.444 3.640 20 0 BHADMO Fc1ccc(/C=C/C[N@H+]2CCC23CCC3)cc1F ZINC000554854761 388833858 /nfs/dbraw/zinc/83/38/58/388833858.db2.gz WJVOQMZLRSXWFZ-HNQUOIGGSA-N 1 1 249.304 3.606 20 0 BHADMO Fc1ccc(/C=C\C[N@H+]2CCC23CCC3)cc1F ZINC000554854762 388833308 /nfs/dbraw/zinc/83/33/08/388833308.db2.gz WJVOQMZLRSXWFZ-IWQZZHSRSA-N 1 1 249.304 3.606 20 0 BHADMO CC[N@@H+](CCC1CC1)Cc1cc(C)c(O)c(C)c1 ZINC000554862293 388835023 /nfs/dbraw/zinc/83/50/23/388835023.db2.gz FDDZTFROUVMIPL-UHFFFAOYSA-N 1 1 247.382 3.631 20 0 BHADMO CCC[N@@H+](CCCC(C)C)CCc1ccccn1 ZINC000554881814 388834867 /nfs/dbraw/zinc/83/48/67/388834867.db2.gz DMCMMHKABWKOPO-UHFFFAOYSA-N 1 1 248.414 3.772 20 0 BHADMO CCC(CC)[N@@H+](CC)Cc1ccc(Cl)o1 ZINC000554885498 397974339 /nfs/dbraw/zinc/97/43/39/397974339.db2.gz CIIFUPPIARNLIL-UHFFFAOYSA-N 1 1 229.751 3.944 20 0 BHADMO C[C@@H]1c2ccsc2CC[N@@H+]1CC1(C)CCC1 ZINC000554885634 397974272 /nfs/dbraw/zinc/97/42/72/397974272.db2.gz DFRJHSYNOUNQBG-LLVKDONJSA-N 1 1 235.396 3.857 20 0 BHADMO C[C@H]1c2ccsc2CC[N@@H+]1CC1(C)CCC1 ZINC000554885635 397974861 /nfs/dbraw/zinc/97/48/61/397974861.db2.gz DFRJHSYNOUNQBG-NSHDSACASA-N 1 1 235.396 3.857 20 0 BHADMO CCC[C@H](C)C[N@@H+](CC)[C@@H](C)c1cccnc1 ZINC000554888274 397974369 /nfs/dbraw/zinc/97/43/69/397974369.db2.gz BCNMWWFEFKRIBK-KBPBESRZSA-N 1 1 234.387 3.901 20 0 BHADMO CCC[C@@H](C)C[N@@H+](CC)[C@@H](C)c1cccnc1 ZINC000554888276 397974515 /nfs/dbraw/zinc/97/45/15/397974515.db2.gz BCNMWWFEFKRIBK-KGLIPLIRSA-N 1 1 234.387 3.901 20 0 BHADMO CCC[C@H](C)C[N@@H+](CC)[C@H](C)c1cccnc1 ZINC000554888277 397974285 /nfs/dbraw/zinc/97/42/85/397974285.db2.gz BCNMWWFEFKRIBK-UONOGXRCSA-N 1 1 234.387 3.901 20 0 BHADMO CCC[C@@H](C)C[N@@H+](CC)[C@H](C)c1cccnc1 ZINC000554888280 397974987 /nfs/dbraw/zinc/97/49/87/397974987.db2.gz BCNMWWFEFKRIBK-ZIAGYGMSSA-N 1 1 234.387 3.901 20 0 BHADMO CC[C@@H]1CC[C@H](C)[N@H+]1C[C@@H]1CC=CCC1 ZINC000554889568 397975949 /nfs/dbraw/zinc/97/59/49/397975949.db2.gz PEBBSQCKMLKFBB-BFHYXJOUSA-N 1 1 207.361 3.606 20 0 BHADMO CC[C@@H]1CC[C@@H](C)[N@H+]1C[C@H]1CC=CCC1 ZINC000554889572 397975491 /nfs/dbraw/zinc/97/54/91/397975491.db2.gz PEBBSQCKMLKFBB-HZSPNIEDSA-N 1 1 207.361 3.606 20 0 BHADMO CC[C@@H]1CC[C@H](C)[N@H+]1C[C@H]1CC=CCC1 ZINC000554889574 397976027 /nfs/dbraw/zinc/97/60/27/397976027.db2.gz PEBBSQCKMLKFBB-MELADBBJSA-N 1 1 207.361 3.606 20 0 BHADMO CC[C@@H]1CC[C@@H](C)[N@H+]1C[C@@H]1CC=CCC1 ZINC000554889576 397975468 /nfs/dbraw/zinc/97/54/68/397975468.db2.gz PEBBSQCKMLKFBB-MGPQQGTHSA-N 1 1 207.361 3.606 20 0 BHADMO C[N@@H+](C[C@@H]1CC=CCC1)C1CCC(F)(F)CC1 ZINC000554889902 397975670 /nfs/dbraw/zinc/97/56/70/397975670.db2.gz ZVJKBDKDGVXKMI-GFCCVEGCSA-N 1 1 243.341 3.852 20 0 BHADMO C[N@@H+](C[C@H]1CC=CCC1)C1CCC(F)(F)CC1 ZINC000554889903 397976116 /nfs/dbraw/zinc/97/61/16/397976116.db2.gz ZVJKBDKDGVXKMI-LBPRGKRZSA-N 1 1 243.341 3.852 20 0 BHADMO CCCC[C@@H](C)[N@@H+](C)Cc1cccc(OC)c1 ZINC000554961574 388835739 /nfs/dbraw/zinc/83/57/39/388835739.db2.gz VKTYQZNVABUAQG-CYBMUJFWSA-N 1 1 235.371 3.706 20 0 BHADMO CCCC[C@H](C)[N@@H+](C)Cc1cccc(OC)c1 ZINC000554961575 388835997 /nfs/dbraw/zinc/83/59/97/388835997.db2.gz VKTYQZNVABUAQG-ZDUSSCGKSA-N 1 1 235.371 3.706 20 0 BHADMO CC(C)[C@@H]1CC[C@@H]1Nc1cc(C2CC2)cc[nH+]1 ZINC000554994685 388837283 /nfs/dbraw/zinc/83/72/83/388837283.db2.gz SJRKARBCUUXTFQ-KBPBESRZSA-N 1 1 230.355 3.806 20 0 BHADMO CC(C)[C@H]1CC[C@@H]1Nc1cc(C2CC2)cc[nH+]1 ZINC000554994687 325741705 /nfs/dbraw/zinc/74/17/05/325741705.db2.gz SJRKARBCUUXTFQ-KGLIPLIRSA-N 1 1 230.355 3.806 20 0 BHADMO CC(C)[C@@H]1CC[C@H]1Nc1cc(C2CC2)cc[nH+]1 ZINC000554994688 388837310 /nfs/dbraw/zinc/83/73/10/388837310.db2.gz SJRKARBCUUXTFQ-UONOGXRCSA-N 1 1 230.355 3.806 20 0 BHADMO CC(C)[C@H]1CC[C@H]1Nc1cc(C2CC2)cc[nH+]1 ZINC000554994689 388837344 /nfs/dbraw/zinc/83/73/44/388837344.db2.gz SJRKARBCUUXTFQ-ZIAGYGMSSA-N 1 1 230.355 3.806 20 0 BHADMO CO[C@@H](C[N@@H+](C)C1(C)CCCC1)c1ccccc1 ZINC000555006849 397987838 /nfs/dbraw/zinc/98/78/38/397987838.db2.gz LBJLYJJUNTWUSG-HNNXBMFYSA-N 1 1 247.382 3.639 20 0 BHADMO CO[C@H](C[N@@H+](C)C1(C)CCCC1)c1ccccc1 ZINC000555006850 397987859 /nfs/dbraw/zinc/98/78/59/397987859.db2.gz LBJLYJJUNTWUSG-OAHLLOKOSA-N 1 1 247.382 3.639 20 0 BHADMO CO[C@H](C[N@@H+](C)[C@@H](C)C(C)(C)C)c1ccccc1 ZINC000555014500 397988668 /nfs/dbraw/zinc/98/86/68/397988668.db2.gz DDYGDVWQHYCVHR-DZGCQCFKSA-N 1 1 249.398 3.741 20 0 BHADMO CO[C@@H](C[N@@H+](C)[C@H](C)C(C)(C)C)c1ccccc1 ZINC000555014505 397988608 /nfs/dbraw/zinc/98/86/08/397988608.db2.gz DDYGDVWQHYCVHR-HIFRSBDPSA-N 1 1 249.398 3.741 20 0 BHADMO CO[C@H](C[N@@H+](C)[C@H](C)C(C)(C)C)c1ccccc1 ZINC000555014506 397988691 /nfs/dbraw/zinc/98/86/91/397988691.db2.gz DDYGDVWQHYCVHR-UKRRQHHQSA-N 1 1 249.398 3.741 20 0 BHADMO CO[C@@H](C[N@@H+](C)[C@@H](C)C(C)(C)C)c1ccccc1 ZINC000555014507 397988330 /nfs/dbraw/zinc/98/83/30/397988330.db2.gz DDYGDVWQHYCVHR-ZFWWWQNUSA-N 1 1 249.398 3.741 20 0 BHADMO CC[C@@H](C)C[N@@H+](C)Cc1sccc1Cl ZINC000555014514 397988103 /nfs/dbraw/zinc/98/81/03/397988103.db2.gz DSDSPAMSGLLPNE-SECBINFHSA-N 1 1 231.792 3.879 20 0 BHADMO CC[C@H](C)C[N@@H+](C)Cc1sccc1Cl ZINC000555014515 397988232 /nfs/dbraw/zinc/98/82/32/397988232.db2.gz DSDSPAMSGLLPNE-VIFPVBQESA-N 1 1 231.792 3.879 20 0 BHADMO CC(C)[C@H]1CC[N@@H+](Cc2sccc2Cl)C1 ZINC000555016350 397989460 /nfs/dbraw/zinc/98/94/60/397989460.db2.gz YMSXCBYHELHLGO-JTQLQIEISA-N 1 1 243.803 3.879 20 0 BHADMO CC(C)[C@@H]1CC[N@@H+](Cc2sccc2Cl)C1 ZINC000555016351 397989534 /nfs/dbraw/zinc/98/95/34/397989534.db2.gz YMSXCBYHELHLGO-SNVBAGLBSA-N 1 1 243.803 3.879 20 0 BHADMO CC1(C)CC[N@H+]1CCc1ccc(F)cc1Cl ZINC000555092614 397992685 /nfs/dbraw/zinc/99/26/85/397992685.db2.gz LLTBHRFPZXSSJG-UHFFFAOYSA-N 1 1 241.737 3.506 20 0 BHADMO Cc1ccc(C[N@H+]2CC(C)(C)[C@@H]2C2CC2)cc1 ZINC000555099916 397993334 /nfs/dbraw/zinc/99/33/34/397993334.db2.gz SDZANAZKUQMVOK-HNNXBMFYSA-N 1 1 229.367 3.615 20 0 BHADMO Cc1ccc(C[N@H+]2CC(C)(C)[C@H]2C2CC2)cc1 ZINC000555099917 397993444 /nfs/dbraw/zinc/99/34/44/397993444.db2.gz SDZANAZKUQMVOK-OAHLLOKOSA-N 1 1 229.367 3.615 20 0 BHADMO C[N@@H+](CC1Cc2ccccc2C1)C1(C)CCCC1 ZINC000555104633 487770038 /nfs/dbraw/zinc/77/00/38/487770038.db2.gz NVEZRDYQDHQINN-UHFFFAOYSA-N 1 1 243.394 3.666 20 0 BHADMO C[N@@H+](CCCCOc1ccccc1)CC(C)(C)C ZINC000555140122 487770172 /nfs/dbraw/zinc/77/01/72/487770172.db2.gz WKXVZPNMWDQCFY-UHFFFAOYSA-N 1 1 249.398 3.824 20 0 BHADMO CC(C)Oc1ccccc1C[N@H+]1CCCC[C@@H]1C ZINC000555210029 388842714 /nfs/dbraw/zinc/84/27/14/388842714.db2.gz SEUMVYBFGKTVMX-AWEZNQCLSA-N 1 1 247.382 3.848 20 0 BHADMO CC(C)Oc1ccccc1C[N@H+]1CCCC[C@H]1C ZINC000555210030 388842341 /nfs/dbraw/zinc/84/23/41/388842341.db2.gz SEUMVYBFGKTVMX-CQSZACIVSA-N 1 1 247.382 3.848 20 0 BHADMO CCC[C@@H]1[C@@H](C)CCC[N@H+]1CC1CCC1 ZINC000555282586 388844631 /nfs/dbraw/zinc/84/46/31/388844631.db2.gz HQRXPGZPXVZQKG-GXTWGEPZSA-N 1 1 209.377 3.687 20 0 BHADMO CCC[C@H]1[C@@H](C)CCC[N@H+]1CC1CCC1 ZINC000555282587 388845008 /nfs/dbraw/zinc/84/50/08/388845008.db2.gz HQRXPGZPXVZQKG-JSGCOSHPSA-N 1 1 209.377 3.687 20 0 BHADMO CCC[C@H]1[C@H](C)CCC[N@H+]1CC1CCC1 ZINC000555282588 388844521 /nfs/dbraw/zinc/84/45/21/388844521.db2.gz HQRXPGZPXVZQKG-OCCSQVGLSA-N 1 1 209.377 3.687 20 0 BHADMO CCC[C@@H]1[C@H](C)CCC[N@H+]1CC1CCC1 ZINC000555282589 388845082 /nfs/dbraw/zinc/84/50/82/388845082.db2.gz HQRXPGZPXVZQKG-TZMCWYRMSA-N 1 1 209.377 3.687 20 0 BHADMO CCC(CC)[N@@H+](Cc1cccc(C)n1)C1CC1 ZINC000555290222 388844761 /nfs/dbraw/zinc/84/47/61/388844761.db2.gz KSVURLFAPHZYNI-UHFFFAOYSA-N 1 1 232.371 3.543 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@@H]2CC[C@H](C)C2)cc1 ZINC000555298423 388844795 /nfs/dbraw/zinc/84/47/95/388844795.db2.gz MBLLTKRGXCBJAJ-DZGCQCFKSA-N 1 1 217.356 3.615 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@H]2CC[C@@H](C)C2)cc1 ZINC000555298424 388845051 /nfs/dbraw/zinc/84/50/51/388845051.db2.gz MBLLTKRGXCBJAJ-HIFRSBDPSA-N 1 1 217.356 3.615 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@@H]2CC[C@@H](C)C2)cc1 ZINC000555298425 388844958 /nfs/dbraw/zinc/84/49/58/388844958.db2.gz MBLLTKRGXCBJAJ-UKRRQHHQSA-N 1 1 217.356 3.615 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@H]2CC[C@H](C)C2)cc1 ZINC000555298426 388845340 /nfs/dbraw/zinc/84/53/40/388845340.db2.gz MBLLTKRGXCBJAJ-ZFWWWQNUSA-N 1 1 217.356 3.615 20 0 BHADMO CCCC[N@@H+](C)Cc1ccc(C(C)C)nc1CC ZINC000555301504 487774452 /nfs/dbraw/zinc/77/44/52/487774452.db2.gz HWGGKBKRCXSYDD-UHFFFAOYSA-N 1 1 248.414 3.999 20 0 BHADMO C[C@@H]1CC[C@@H]([N@@H+](C)CCCc2ccccc2)C1 ZINC000555314575 398002630 /nfs/dbraw/zinc/00/26/30/398002630.db2.gz DFYCITJUCJBNFD-GDBMZVCRSA-N 1 1 231.383 3.740 20 0 BHADMO C[C@H]1CC[C@@H]([N@@H+](C)CCCc2ccccc2)C1 ZINC000555314580 398003154 /nfs/dbraw/zinc/00/31/54/398003154.db2.gz DFYCITJUCJBNFD-GOEBONIOSA-N 1 1 231.383 3.740 20 0 BHADMO C[C@H]1CC[C@H]([N@@H+](C)CCCc2ccccc2)C1 ZINC000555314582 388845148 /nfs/dbraw/zinc/84/51/48/388845148.db2.gz DFYCITJUCJBNFD-HOCLYGCPSA-N 1 1 231.383 3.740 20 0 BHADMO C[C@@H]1CC[C@H]([N@@H+](C)CCCc2ccccc2)C1 ZINC000555314583 388844898 /nfs/dbraw/zinc/84/48/98/388844898.db2.gz DFYCITJUCJBNFD-ZBFHGGJFSA-N 1 1 231.383 3.740 20 0 BHADMO CC(C)[N@@H+](Cc1cccc(F)c1Cl)C1CC1 ZINC000555314867 398002642 /nfs/dbraw/zinc/00/26/42/398002642.db2.gz RJEHDPPEBHVOFY-UHFFFAOYSA-N 1 1 241.737 3.852 20 0 BHADMO CCCCC[N@@H+](CCC1(OC)CCC1)C(C)C ZINC000555315086 398003065 /nfs/dbraw/zinc/00/30/65/398003065.db2.gz YZSKPCHAAKJJKG-UHFFFAOYSA-N 1 1 241.419 3.846 20 0 BHADMO c1cc2c(s1)CC[N@H+]([C@H]1C=CCCCCC1)C2 ZINC000555315854 398002620 /nfs/dbraw/zinc/00/26/20/398002620.db2.gz WUFFUXFXARRRAI-AWEZNQCLSA-N 1 1 247.407 3.995 20 0 BHADMO c1cc2c(s1)CC[N@H+]([C@@H]1C=CCCCCC1)C2 ZINC000555315855 398002789 /nfs/dbraw/zinc/00/27/89/398002789.db2.gz WUFFUXFXARRRAI-CQSZACIVSA-N 1 1 247.407 3.995 20 0 BHADMO CCC[N@@H+](CC)Cc1ccccc1OCC(C)C ZINC000555321724 398003488 /nfs/dbraw/zinc/00/34/88/398003488.db2.gz BFZBOAIJECRMFL-UHFFFAOYSA-N 1 1 249.398 3.953 20 0 BHADMO CC(C)COc1ccccc1C[N@H+]1CC[C@H](C)C1 ZINC000555322226 398003960 /nfs/dbraw/zinc/00/39/60/398003960.db2.gz VEXSULZMLLDDBX-AWEZNQCLSA-N 1 1 247.382 3.563 20 0 BHADMO CC(C)COc1ccccc1C[N@H+]1CC[C@@H](C)C1 ZINC000555322229 398003813 /nfs/dbraw/zinc/00/38/13/398003813.db2.gz VEXSULZMLLDDBX-CQSZACIVSA-N 1 1 247.382 3.563 20 0 BHADMO CCc1ccc(C[N@H+]2CCC[C@H]2CC(C)C)nc1 ZINC000555334321 388846672 /nfs/dbraw/zinc/84/66/72/388846672.db2.gz ONRUFPFOUJLHLJ-INIZCTEOSA-N 1 1 246.398 3.655 20 0 BHADMO CCc1ccc(C[N@H+]2CCC[C@@H]2CC(C)C)nc1 ZINC000555334322 398002989 /nfs/dbraw/zinc/00/29/89/398002989.db2.gz ONRUFPFOUJLHLJ-MRXNPFEDSA-N 1 1 246.398 3.655 20 0 BHADMO CC(C)C[C@H](C)[N@@H+](C)CCCc1ccccc1 ZINC000555334675 388846482 /nfs/dbraw/zinc/84/64/82/388846482.db2.gz BSGNDTAGFSVDJH-HNNXBMFYSA-N 1 1 233.399 3.986 20 0 BHADMO CC(C)C[C@@H](C)[N@@H+](C)CCCc1ccccc1 ZINC000555334676 388847290 /nfs/dbraw/zinc/84/72/90/388847290.db2.gz BSGNDTAGFSVDJH-OAHLLOKOSA-N 1 1 233.399 3.986 20 0 BHADMO CCc1ccc(C[N@H+](C(CC)CC)C2CC2)nc1 ZINC000555336777 388846455 /nfs/dbraw/zinc/84/64/55/388846455.db2.gz GDURRHQTMVHUKL-UHFFFAOYSA-N 1 1 246.398 3.797 20 0 BHADMO CCC(CC)[N@@H+](CCC1(OC)CCC1)C1CC1 ZINC000555336897 388847070 /nfs/dbraw/zinc/84/70/70/388847070.db2.gz JZKSMLXNZFDXHA-UHFFFAOYSA-N 1 1 239.403 3.599 20 0 BHADMO C[C@H](C1CCCCC1)[N@@H+](C)C[C@H]1CCSC1 ZINC000555339578 388847607 /nfs/dbraw/zinc/84/76/07/388847607.db2.gz CCOUNBGDUOBRJV-CHWSQXEVSA-N 1 1 241.444 3.640 20 0 BHADMO C[C@H](C1CCCCC1)[N@@H+](C)C[C@@H]1CCSC1 ZINC000555339580 388846781 /nfs/dbraw/zinc/84/67/81/388846781.db2.gz CCOUNBGDUOBRJV-OLZOCXBDSA-N 1 1 241.444 3.640 20 0 BHADMO CC[N@H+](Cc1cccc(F)c1Cl)CC1CC1 ZINC000555364781 388847454 /nfs/dbraw/zinc/84/74/54/388847454.db2.gz UTBBLMHBWDMZPI-UHFFFAOYSA-N 1 1 241.737 3.711 20 0 BHADMO C[N@@H+](CCC1CC1)Cc1cccc(F)c1Cl ZINC000555415167 388848774 /nfs/dbraw/zinc/84/87/74/388848774.db2.gz HMINSSMJFNDFAW-UHFFFAOYSA-N 1 1 241.737 3.711 20 0 BHADMO CCc1ccc(C[N@@H+](C(C)C)C2CCCC2)nc1 ZINC000555417059 388848016 /nfs/dbraw/zinc/84/80/16/388848016.db2.gz RQGHZQMYKXOMQT-UHFFFAOYSA-N 1 1 246.398 3.797 20 0 BHADMO CC1=CC[N@H+]([C@H]2C=CCCCCC2)CC1 ZINC000555418216 388848727 /nfs/dbraw/zinc/84/87/27/388848727.db2.gz FYSVDDHESTZZEH-AWEZNQCLSA-N 1 1 205.345 3.527 20 0 BHADMO CC1=CC[N@H+]([C@@H]2C=CCCCCC2)CC1 ZINC000555418217 388849234 /nfs/dbraw/zinc/84/92/34/388849234.db2.gz FYSVDDHESTZZEH-CQSZACIVSA-N 1 1 205.345 3.527 20 0 BHADMO CC1=C(C)C[N@@H+](Cc2cnc(C3CC3)s2)CC1 ZINC000555419892 388848241 /nfs/dbraw/zinc/84/82/41/388848241.db2.gz AMFIYOYTGUNLLX-UHFFFAOYSA-N 1 1 248.395 3.563 20 0 BHADMO CCc1ccc(C[N@H+]2CC[C@H](C(C)(C)C)C2)nc1 ZINC000555422934 388850657 /nfs/dbraw/zinc/85/06/57/388850657.db2.gz PAMFXPAUQVVYHK-AWEZNQCLSA-N 1 1 246.398 3.512 20 0 BHADMO CCc1ccc(C[N@H+]2CC[C@@H](C(C)(C)C)C2)nc1 ZINC000555422935 388849906 /nfs/dbraw/zinc/84/99/06/388849906.db2.gz PAMFXPAUQVVYHK-CQSZACIVSA-N 1 1 246.398 3.512 20 0 BHADMO CCOc1ccccc1C[N@@H+](CC1CC1)C(C)C ZINC000555429327 388850843 /nfs/dbraw/zinc/85/08/43/388850843.db2.gz CAIUJCQZZQATEI-UHFFFAOYSA-N 1 1 247.382 3.706 20 0 BHADMO CCc1ccc(C[N@H+]2CCC[C@H](C(C)C)C2)nc1 ZINC000555461099 388850829 /nfs/dbraw/zinc/85/08/29/388850829.db2.gz NMKYJSUPWMFJSE-HNNXBMFYSA-N 1 1 246.398 3.512 20 0 BHADMO CCc1ccc(C[N@H+]2CCC[C@@H](C(C)C)C2)nc1 ZINC000555461100 388850488 /nfs/dbraw/zinc/85/04/88/388850488.db2.gz NMKYJSUPWMFJSE-OAHLLOKOSA-N 1 1 246.398 3.512 20 0 BHADMO C[C@@H]1CSCC[N@H+]([C@H]2C=CCCCCC2)C1 ZINC000555461251 388850302 /nfs/dbraw/zinc/85/03/02/388850302.db2.gz WSHCQMAJPLRGAL-KBPBESRZSA-N 1 1 239.428 3.560 20 0 BHADMO C[C@H]1CSCC[N@H+]([C@H]2C=CCCCCC2)C1 ZINC000555461252 388850952 /nfs/dbraw/zinc/85/09/52/388850952.db2.gz WSHCQMAJPLRGAL-KGLIPLIRSA-N 1 1 239.428 3.560 20 0 BHADMO C[C@@H]1CSCC[N@H+]([C@@H]2C=CCCCCC2)C1 ZINC000555461253 388850180 /nfs/dbraw/zinc/85/01/80/388850180.db2.gz WSHCQMAJPLRGAL-UONOGXRCSA-N 1 1 239.428 3.560 20 0 BHADMO C[C@H]1CSCC[N@H+]([C@@H]2C=CCCCCC2)C1 ZINC000555461254 388850704 /nfs/dbraw/zinc/85/07/04/388850704.db2.gz WSHCQMAJPLRGAL-ZIAGYGMSSA-N 1 1 239.428 3.560 20 0 BHADMO Cc1ccncc1C[N@H+](C)[C@H]1C=CCCCCC1 ZINC000555462998 388850077 /nfs/dbraw/zinc/85/00/77/388850077.db2.gz VOURVXUHXFQGTC-INIZCTEOSA-N 1 1 244.382 3.711 20 0 BHADMO Cc1ccncc1C[N@H+](C)[C@@H]1C=CCCCCC1 ZINC000555462999 388850425 /nfs/dbraw/zinc/85/04/25/388850425.db2.gz VOURVXUHXFQGTC-MRXNPFEDSA-N 1 1 244.382 3.711 20 0 BHADMO CSCCC[N@@H+](C)[C@@H]1C=CCCCCC1 ZINC000555499980 388852318 /nfs/dbraw/zinc/85/23/18/388852318.db2.gz KJHALVRWXYAFBF-CYBMUJFWSA-N 1 1 227.417 3.560 20 0 BHADMO CSCCC[N@@H+](C)[C@H]1C=CCCCCC1 ZINC000555499981 388852134 /nfs/dbraw/zinc/85/21/34/388852134.db2.gz KJHALVRWXYAFBF-ZDUSSCGKSA-N 1 1 227.417 3.560 20 0 BHADMO Cc1cc(Cl)cc(CNc2[nH+]cccc2C)c1 ZINC000555524911 388852401 /nfs/dbraw/zinc/85/24/01/388852401.db2.gz SUWYEVNIOTWTBL-UHFFFAOYSA-N 1 1 246.741 3.964 20 0 BHADMO C[N@@H+](CCc1ccc(Cl)cc1)CC1(C)CC1 ZINC000555595090 388855172 /nfs/dbraw/zinc/85/51/72/388855172.db2.gz KQSXJJDPZVLSKU-UHFFFAOYSA-N 1 1 237.774 3.614 20 0 BHADMO CC(C)[N@@H+](Cc1cccs1)CC1(C)CC1 ZINC000555596288 388855534 /nfs/dbraw/zinc/85/55/34/388855534.db2.gz COTHKFBGANLDNE-UHFFFAOYSA-N 1 1 223.385 3.759 20 0 BHADMO COc1cccc([C@@H]2CCC[N@H+]2CC2(C)CC2)c1 ZINC000555596454 388855216 /nfs/dbraw/zinc/85/52/16/388855216.db2.gz RFGQCKZPQIPHJE-HNNXBMFYSA-N 1 1 245.366 3.632 20 0 BHADMO COc1cccc([C@H]2CCC[N@H+]2CC2(C)CC2)c1 ZINC000555596455 388854993 /nfs/dbraw/zinc/85/49/93/388854993.db2.gz RFGQCKZPQIPHJE-OAHLLOKOSA-N 1 1 245.366 3.632 20 0 BHADMO C[C@H](c1cccc(Cl)c1)[N@H+]1C[C@@H](C)[C@H]1C ZINC000555634835 388857155 /nfs/dbraw/zinc/85/71/55/388857155.db2.gz HRNVQHHZZQZYGX-GMTAPVOTSA-N 1 1 223.747 3.741 20 0 BHADMO C[C@@H](c1cccc(Cl)c1)[N@H+]1C[C@@H](C)[C@H]1C ZINC000555634836 388856543 /nfs/dbraw/zinc/85/65/43/388856543.db2.gz HRNVQHHZZQZYGX-MXWKQRLJSA-N 1 1 223.747 3.741 20 0 BHADMO C[C@H](c1cccc(Cl)c1)[N@H+]1C[C@@H](C)[C@@H]1C ZINC000555634837 388856485 /nfs/dbraw/zinc/85/64/85/388856485.db2.gz HRNVQHHZZQZYGX-OUAUKWLOSA-N 1 1 223.747 3.741 20 0 BHADMO C[C@@H](c1cccc(Cl)c1)[N@H+]1C[C@@H](C)[C@@H]1C ZINC000555634838 388856335 /nfs/dbraw/zinc/85/63/35/388856335.db2.gz HRNVQHHZZQZYGX-VWYCJHECSA-N 1 1 223.747 3.741 20 0 BHADMO C[C@H]1C[N@@H+](CCc2ccc3ccccc3c2)[C@H]1C ZINC000555634979 388857112 /nfs/dbraw/zinc/85/71/12/388857112.db2.gz UWCFGAUTTPRWAU-KBPBESRZSA-N 1 1 239.362 3.723 20 0 BHADMO C[C@@H]1C[N@@H+](CCc2ccc3ccccc3c2)[C@H]1C ZINC000555634980 388856276 /nfs/dbraw/zinc/85/62/76/388856276.db2.gz UWCFGAUTTPRWAU-KGLIPLIRSA-N 1 1 239.362 3.723 20 0 BHADMO C[C@@H]1[C@@H](C)C[N@H+]1CCc1ccc2ccccc2c1 ZINC000555634981 388856452 /nfs/dbraw/zinc/85/64/52/388856452.db2.gz UWCFGAUTTPRWAU-UONOGXRCSA-N 1 1 239.362 3.723 20 0 BHADMO C[C@@H]1C[N@@H+](CCc2ccc3ccccc3c2)[C@@H]1C ZINC000555634982 388856429 /nfs/dbraw/zinc/85/64/29/388856429.db2.gz UWCFGAUTTPRWAU-ZIAGYGMSSA-N 1 1 239.362 3.723 20 0 BHADMO C[C@@H]1C[N@@H+](CCCc2ccc(Cl)cc2)[C@H]1C ZINC000555635210 388856245 /nfs/dbraw/zinc/85/62/45/388856245.db2.gz SKVYXKGFYHSJNN-NEPJUHHUSA-N 1 1 237.774 3.613 20 0 BHADMO C[C@@H]1[C@@H](C)C[N@H+]1CCCc1ccc(Cl)cc1 ZINC000555635211 388856903 /nfs/dbraw/zinc/85/69/03/388856903.db2.gz SKVYXKGFYHSJNN-NWDGAFQWSA-N 1 1 237.774 3.613 20 0 BHADMO C[C@H]1C[N@@H+](CCCc2ccc(Cl)cc2)[C@H]1C ZINC000555635212 388856534 /nfs/dbraw/zinc/85/65/34/388856534.db2.gz SKVYXKGFYHSJNN-RYUDHWBXSA-N 1 1 237.774 3.613 20 0 BHADMO C[C@@H]1C[N@@H+](CCCc2ccc(Cl)cc2)[C@@H]1C ZINC000555635213 388857053 /nfs/dbraw/zinc/85/70/53/388857053.db2.gz SKVYXKGFYHSJNN-VXGBXAGGSA-N 1 1 237.774 3.613 20 0 BHADMO C[C@H]1C[N@@H+](CCCSCc2ccccc2)[C@H]1C ZINC000555642574 388859026 /nfs/dbraw/zinc/85/90/26/388859026.db2.gz YKFKDLQMAXKYOP-KBPBESRZSA-N 1 1 249.423 3.650 20 0 BHADMO C[C@@H]1C[N@@H+](CCCSCc2ccccc2)[C@H]1C ZINC000555642575 388858500 /nfs/dbraw/zinc/85/85/00/388858500.db2.gz YKFKDLQMAXKYOP-KGLIPLIRSA-N 1 1 249.423 3.650 20 0 BHADMO C[C@@H]1[C@@H](C)C[N@H+]1CCCSCc1ccccc1 ZINC000555642576 388858976 /nfs/dbraw/zinc/85/89/76/388858976.db2.gz YKFKDLQMAXKYOP-UONOGXRCSA-N 1 1 249.423 3.650 20 0 BHADMO C[C@@H]1C[N@@H+](CCCSCc2ccccc2)[C@@H]1C ZINC000555642577 388858931 /nfs/dbraw/zinc/85/89/31/388858931.db2.gz YKFKDLQMAXKYOP-ZIAGYGMSSA-N 1 1 249.423 3.650 20 0 BHADMO C[C@@H]1C[N@H+]([C@H]2CCCc3ccc(F)cc32)[C@@H]1C ZINC000555642590 388858125 /nfs/dbraw/zinc/85/81/25/388858125.db2.gz ZWGIBCSCOCGLCH-HFAKWTLXSA-N 1 1 233.330 3.543 20 0 BHADMO C[C@@H]1C[N@H+]([C@@H]2CCCc3ccc(F)cc32)[C@H]1C ZINC000555642591 388858715 /nfs/dbraw/zinc/85/87/15/388858715.db2.gz ZWGIBCSCOCGLCH-JRPNMDOOSA-N 1 1 233.330 3.543 20 0 BHADMO C[C@@H]1C[N@H+]([C@@H]2CCCc3ccc(F)cc32)[C@@H]1C ZINC000555642592 388859082 /nfs/dbraw/zinc/85/90/82/388859082.db2.gz ZWGIBCSCOCGLCH-UEKVPHQBSA-N 1 1 233.330 3.543 20 0 BHADMO C[C@@H]1C[N@H+]([C@H]2CCCc3ccc(F)cc32)[C@H]1C ZINC000555642593 388858418 /nfs/dbraw/zinc/85/84/18/388858418.db2.gz ZWGIBCSCOCGLCH-ZETOZRRWSA-N 1 1 233.330 3.543 20 0 BHADMO C[N@@H+](Cc1c(F)cccc1F)[C@@H]1C=CCCC1 ZINC000555649838 388858096 /nfs/dbraw/zinc/85/80/96/388858096.db2.gz AFLZPLILXKFCHB-LLVKDONJSA-N 1 1 237.293 3.505 20 0 BHADMO C[N@H+](Cc1c(F)cccc1F)[C@@H]1C=CCCC1 ZINC000555649838 388858093 /nfs/dbraw/zinc/85/80/93/388858093.db2.gz AFLZPLILXKFCHB-LLVKDONJSA-N 1 1 237.293 3.505 20 0 BHADMO C[N@@H+](Cc1c(F)cccc1F)[C@H]1C=CCCC1 ZINC000555649839 388857888 /nfs/dbraw/zinc/85/78/88/388857888.db2.gz AFLZPLILXKFCHB-NSHDSACASA-N 1 1 237.293 3.505 20 0 BHADMO C[N@H+](Cc1c(F)cccc1F)[C@H]1C=CCCC1 ZINC000555649839 388857884 /nfs/dbraw/zinc/85/78/84/388857884.db2.gz AFLZPLILXKFCHB-NSHDSACASA-N 1 1 237.293 3.505 20 0 BHADMO FC[C@@H]1CCC[N@H+]1Cc1cccc2ccccc21 ZINC000555696641 388860357 /nfs/dbraw/zinc/86/03/57/388860357.db2.gz KAQFBCRJXICSSW-HNNXBMFYSA-N 1 1 243.325 3.774 20 0 BHADMO FC[C@H]1CCC[N@H+]1Cc1cccc2ccccc21 ZINC000555696642 388860189 /nfs/dbraw/zinc/86/01/89/388860189.db2.gz KAQFBCRJXICSSW-OAHLLOKOSA-N 1 1 243.325 3.774 20 0 BHADMO C[C@@H](c1ccccc1)[N@H+]1CC[C@H](CC2CC2)C1 ZINC000555697316 388859662 /nfs/dbraw/zinc/85/96/62/388859662.db2.gz MVQHZORACTUPSI-DZGCQCFKSA-N 1 1 229.367 3.870 20 0 BHADMO C[C@H](c1ccccc1)[N@H+]1CC[C@@H](CC2CC2)C1 ZINC000555697431 388860632 /nfs/dbraw/zinc/86/06/32/388860632.db2.gz MVQHZORACTUPSI-HIFRSBDPSA-N 1 1 229.367 3.870 20 0 BHADMO C[C@H](c1ccccc1)[N@H+]1CC[C@H](CC2CC2)C1 ZINC000555697432 388860669 /nfs/dbraw/zinc/86/06/69/388860669.db2.gz MVQHZORACTUPSI-UKRRQHHQSA-N 1 1 229.367 3.870 20 0 BHADMO C[C@@H](c1ccccc1)[N@H+]1CC[C@@H](CC2CC2)C1 ZINC000555697434 388859966 /nfs/dbraw/zinc/85/99/66/388859966.db2.gz MVQHZORACTUPSI-ZFWWWQNUSA-N 1 1 229.367 3.870 20 0 BHADMO CC1(C)C[N@@H+](Cc2cccs2)[C@@H]2CCC[C@H]21 ZINC000555720967 364695952 /nfs/dbraw/zinc/69/59/52/364695952.db2.gz BVRINZWKRQQOGM-CHWSQXEVSA-N 1 1 235.396 3.759 20 0 BHADMO CC1(C)C[N@@H+](Cc2cccs2)[C@H]2CCC[C@H]21 ZINC000555720968 364695723 /nfs/dbraw/zinc/69/57/23/364695723.db2.gz BVRINZWKRQQOGM-OLZOCXBDSA-N 1 1 235.396 3.759 20 0 BHADMO CC1(C)C[N@@H+](Cc2cccs2)[C@@H]2CCC[C@@H]21 ZINC000555720969 364695803 /nfs/dbraw/zinc/69/58/03/364695803.db2.gz BVRINZWKRQQOGM-QWHCGFSZSA-N 1 1 235.396 3.759 20 0 BHADMO CC1(C)C[N@@H+](Cc2cccs2)[C@H]2CCC[C@@H]21 ZINC000555720970 388860270 /nfs/dbraw/zinc/86/02/70/388860270.db2.gz BVRINZWKRQQOGM-STQMWFEESA-N 1 1 235.396 3.759 20 0 BHADMO CCCC[N@@H+](Cc1ccon1)C1CCCCC1 ZINC000555774530 388862280 /nfs/dbraw/zinc/86/22/80/388862280.db2.gz ARQNMDPSKMWHEY-UHFFFAOYSA-N 1 1 236.359 3.609 20 0 BHADMO CCCC[N@@H+](CCCF)C1CCCCC1 ZINC000555774941 388861311 /nfs/dbraw/zinc/86/13/11/388861311.db2.gz OJEUIKJDKWBNEP-UHFFFAOYSA-N 1 1 215.356 3.781 20 0 BHADMO CCCC[N@@H+](CCCCOC)C1CCCCC1 ZINC000555775113 388861611 /nfs/dbraw/zinc/86/16/11/388861611.db2.gz WIOQGWSXLRDGDM-UHFFFAOYSA-N 1 1 241.419 3.848 20 0 BHADMO CC[C@H](F)C[N@H+]1CC[C@@H](c2ccc(C)cc2)C1 ZINC000555926261 388863105 /nfs/dbraw/zinc/86/31/05/388863105.db2.gz VZIFFDFROGHSRE-CABCVRRESA-N 1 1 235.346 3.532 20 0 BHADMO CC[C@H](F)C[N@H+]1CC[C@H](c2ccc(C)cc2)C1 ZINC000555926263 388863625 /nfs/dbraw/zinc/86/36/25/388863625.db2.gz VZIFFDFROGHSRE-GJZGRUSLSA-N 1 1 235.346 3.532 20 0 BHADMO CC[C@@H](F)C[N@H+]1CC[C@@H](c2ccc(C)cc2)C1 ZINC000555926265 388863457 /nfs/dbraw/zinc/86/34/57/388863457.db2.gz VZIFFDFROGHSRE-HUUCEWRRSA-N 1 1 235.346 3.532 20 0 BHADMO CC[C@@H](F)C[N@H+]1CC[C@H](c2ccc(C)cc2)C1 ZINC000555926266 388863504 /nfs/dbraw/zinc/86/35/04/388863504.db2.gz VZIFFDFROGHSRE-LSDHHAIUSA-N 1 1 235.346 3.532 20 0 BHADMO COc1cc(C[N@@H+](CC2CC2)C(C)C)ccc1C ZINC000556082300 388866735 /nfs/dbraw/zinc/86/67/35/388866735.db2.gz RHTZZLCZVJLEOR-UHFFFAOYSA-N 1 1 247.382 3.624 20 0 BHADMO CC1(C)CCC(C[N@H+]2Cc3cccnc3C2)CC1 ZINC000556087986 388867123 /nfs/dbraw/zinc/86/71/23/388867123.db2.gz HUXDUHXAOWEUAM-UHFFFAOYSA-N 1 1 244.382 3.614 20 0 BHADMO CCCC[N@@H+](CC)C[C@@H]1CCC(F)(F)C1 ZINC000556104843 388867116 /nfs/dbraw/zinc/86/71/16/388867116.db2.gz LZUOCFCILOGQLH-LLVKDONJSA-N 1 1 219.319 3.544 20 0 BHADMO CCCC[N@@H+](CC)C[C@H]1CCC(F)(F)C1 ZINC000556104846 388866702 /nfs/dbraw/zinc/86/67/02/388866702.db2.gz LZUOCFCILOGQLH-NSHDSACASA-N 1 1 219.319 3.544 20 0 BHADMO CCC[N@@H+](CC1CC1)C[C@@H]1CCC(F)(F)C1 ZINC000556104951 388866732 /nfs/dbraw/zinc/86/67/32/388866732.db2.gz NKPXNXYNAHHRHL-GFCCVEGCSA-N 1 1 231.330 3.544 20 0 BHADMO CCC[N@@H+](CC1CC1)C[C@H]1CCC(F)(F)C1 ZINC000556104952 388866481 /nfs/dbraw/zinc/86/64/81/388866481.db2.gz NKPXNXYNAHHRHL-LBPRGKRZSA-N 1 1 231.330 3.544 20 0 BHADMO C[N@@H+](C[C@H]1CCC(F)(F)C1)C(C1CC1)C1CC1 ZINC000556104963 388866431 /nfs/dbraw/zinc/86/64/31/388866431.db2.gz NPFPQGPIGDOVOR-JTQLQIEISA-N 1 1 243.341 3.542 20 0 BHADMO C[N@@H+](C[C@@H]1CCC(F)(F)C1)C(C1CC1)C1CC1 ZINC000556104964 388866786 /nfs/dbraw/zinc/86/67/86/388866786.db2.gz NPFPQGPIGDOVOR-SNVBAGLBSA-N 1 1 243.341 3.542 20 0 BHADMO CC[N@@H+](CCCCCF)Cc1ccccc1C ZINC000556113030 388868596 /nfs/dbraw/zinc/86/85/96/388868596.db2.gz RGBRYJWPBCPDET-UHFFFAOYSA-N 1 1 237.362 3.957 20 0 BHADMO Cc1ccc(CC[C@@H](C)[NH2+]CC(C)(F)F)cc1 ZINC000556229182 325785939 /nfs/dbraw/zinc/78/59/39/325785939.db2.gz GJQJMGVKRVMFDY-GFCCVEGCSA-N 1 1 241.325 3.561 20 0 BHADMO Cc1ccc(CC[C@H](C)[NH2+]CC(C)(F)F)cc1 ZINC000556229189 388871806 /nfs/dbraw/zinc/87/18/06/388871806.db2.gz GJQJMGVKRVMFDY-LBPRGKRZSA-N 1 1 241.325 3.561 20 0 BHADMO C[C@@H]([NH2+][C@H]1CCC[C@H]1F)c1cccc(F)c1F ZINC000556256827 388873604 /nfs/dbraw/zinc/87/36/04/388873604.db2.gz QLVDTFVWMHRJJK-UISBYWKRSA-N 1 1 243.272 3.506 20 0 BHADMO CCCC[N@H+]1CCC[C@H]1Cc1ccc(F)cc1 ZINC000556270231 388873211 /nfs/dbraw/zinc/87/32/11/388873211.db2.gz YRPSPIUEFXZBCN-HNNXBMFYSA-N 1 1 235.346 3.633 20 0 BHADMO CCCC[N@H+]1CCC[C@@H]1Cc1ccc(F)cc1 ZINC000556270232 388873674 /nfs/dbraw/zinc/87/36/74/388873674.db2.gz YRPSPIUEFXZBCN-OAHLLOKOSA-N 1 1 235.346 3.633 20 0 BHADMO C[C@@H]1C[C@H](C)[N@@H+]1CC/C=C\c1ccccc1 ZINC000556271364 388873595 /nfs/dbraw/zinc/87/35/95/388873595.db2.gz ASQFIYKUUUCQKE-CEIYIRBKSA-N 1 1 215.340 3.573 20 0 BHADMO C[C@@H]1C[C@H](C)[N@@H+]1CC/C=C/c1ccccc1 ZINC000556271366 388873274 /nfs/dbraw/zinc/87/32/74/388873274.db2.gz ASQFIYKUUUCQKE-LQESKWSZSA-N 1 1 215.340 3.573 20 0 BHADMO CCCC[N@@H+](CCOC)Cc1ccc(C)cc1C ZINC000556490519 384409964 /nfs/dbraw/zinc/40/99/64/384409964.db2.gz RDZHABPIDMNWBO-UHFFFAOYSA-N 1 1 249.398 3.552 20 0 BHADMO C[C@H](c1ccccc1)[N@@H+](C)CCCCCF ZINC000556492175 384412454 /nfs/dbraw/zinc/41/24/54/384412454.db2.gz IRTOEBJNKKNKRD-CYBMUJFWSA-N 1 1 223.335 3.819 20 0 BHADMO C[C@@H](c1ccccc1)[N@@H+](C)CCCCCF ZINC000556492187 384411624 /nfs/dbraw/zinc/41/16/24/384411624.db2.gz IRTOEBJNKKNKRD-ZDUSSCGKSA-N 1 1 223.335 3.819 20 0 BHADMO CC[N@@H+](CCCCCF)CCc1ccccc1 ZINC000556494647 384411414 /nfs/dbraw/zinc/41/14/14/384411414.db2.gz BGJJHXQWIMPDIW-UHFFFAOYSA-N 1 1 237.362 3.691 20 0 BHADMO CC[N@@H+](CCCCCF)C1CCCCC1 ZINC000556495003 384411619 /nfs/dbraw/zinc/41/16/19/384411619.db2.gz HYPVAUCTANSJLX-UHFFFAOYSA-N 1 1 215.356 3.781 20 0 BHADMO FCCCCC[N@H+]1CCC[C@H]1Cc1ccccc1 ZINC000556495182 384411525 /nfs/dbraw/zinc/41/15/25/384411525.db2.gz NKKKEDPADXTOHK-INIZCTEOSA-N 1 1 249.373 3.833 20 0 BHADMO FCCCCC[N@H+]1CCC[C@@H]1Cc1ccccc1 ZINC000556495186 384412062 /nfs/dbraw/zinc/41/20/62/384412062.db2.gz NKKKEDPADXTOHK-MRXNPFEDSA-N 1 1 249.373 3.833 20 0 BHADMO CC[N@@H+](CCCCCF)Cc1ccc(C)cc1 ZINC000556495190 384412442 /nfs/dbraw/zinc/41/24/42/384412442.db2.gz NLBUZNPWEOTVHB-UHFFFAOYSA-N 1 1 237.362 3.957 20 0 BHADMO FCCCCC[N@H+]1CCC[C@H]1C1CCCC1 ZINC000556495888 384411829 /nfs/dbraw/zinc/41/18/29/384411829.db2.gz XSFZRRLEQIPLKL-AWEZNQCLSA-N 1 1 227.367 3.781 20 0 BHADMO FCCCCC[N@H+]1CCC[C@@H]1C1CCCC1 ZINC000556495893 384412099 /nfs/dbraw/zinc/41/20/99/384412099.db2.gz XSFZRRLEQIPLKL-CQSZACIVSA-N 1 1 227.367 3.781 20 0 BHADMO C[N@@H+](CCCCCF)[C@H]1CCc2ccccc2C1 ZINC000556497801 384414791 /nfs/dbraw/zinc/41/47/91/384414791.db2.gz NCVAZVYAPSHMIQ-INIZCTEOSA-N 1 1 249.373 3.616 20 0 BHADMO C[N@@H+](CCCCCF)[C@@H]1CCc2ccccc2C1 ZINC000556497803 384414943 /nfs/dbraw/zinc/41/49/43/384414943.db2.gz NCVAZVYAPSHMIQ-MRXNPFEDSA-N 1 1 249.373 3.616 20 0 BHADMO C[C@]1(c2ccccc2)CC[N@@H+](CCCCCF)C1 ZINC000556497823 384415117 /nfs/dbraw/zinc/41/51/17/384415117.db2.gz UPHCSRIQQGMNAT-INIZCTEOSA-N 1 1 249.373 3.790 20 0 BHADMO C[C@@]1(c2ccccc2)CC[N@@H+](CCCCCF)C1 ZINC000556497825 384415195 /nfs/dbraw/zinc/41/51/95/384415195.db2.gz UPHCSRIQQGMNAT-MRXNPFEDSA-N 1 1 249.373 3.790 20 0 BHADMO FCCCCC[N@H+]1CCCC12CCCCC2 ZINC000556501861 384414699 /nfs/dbraw/zinc/41/46/99/384414699.db2.gz HVHOUUHCNFGMRK-UHFFFAOYSA-N 1 1 227.367 3.925 20 0 BHADMO CC[N@@H+](Cc1ccccc1N(C)C)C1CCCC1 ZINC000556508016 384418997 /nfs/dbraw/zinc/41/89/97/384418997.db2.gz ZLJQSUABUOWYSP-UHFFFAOYSA-N 1 1 246.398 3.517 20 0 BHADMO C[C@@H]1CC2(CCC2)C[N@H+]1CCC(C)(C)C ZINC000556528999 384423335 /nfs/dbraw/zinc/42/33/35/384423335.db2.gz BDBYCRPHDLGEDV-GFCCVEGCSA-N 1 1 209.377 3.687 20 0 BHADMO C[C@H]1CC2(CCC2)C[N@H+]1CCC(C)(C)C ZINC000556529000 384423713 /nfs/dbraw/zinc/42/37/13/384423713.db2.gz BDBYCRPHDLGEDV-LBPRGKRZSA-N 1 1 209.377 3.687 20 0 BHADMO FCCCCC[N@@H+](CC1CC1)CC1CCC1 ZINC000556536645 384424650 /nfs/dbraw/zinc/42/46/50/384424650.db2.gz ZJWUVZHCYIMFHB-UHFFFAOYSA-N 1 1 227.367 3.638 20 0 BHADMO CC[N@@H+](Cc1ccc(C)c(OC)c1)C1CCCC1 ZINC000556617853 384439330 /nfs/dbraw/zinc/43/93/30/384439330.db2.gz DYFMGFYPYPKSID-UHFFFAOYSA-N 1 1 247.382 3.768 20 0 BHADMO CCc1ccc(C[N@H+](CC)C2CCCC2)o1 ZINC000556618244 384438892 /nfs/dbraw/zinc/43/88/92/384438892.db2.gz JOUWPPWQTDEXSP-UHFFFAOYSA-N 1 1 221.344 3.607 20 0 BHADMO CC[N@@H+](Cc1ccc(OC)c(C)c1)C1CCCC1 ZINC000556619131 384438741 /nfs/dbraw/zinc/43/87/41/384438741.db2.gz NOPKEIVXXVDSLJ-UHFFFAOYSA-N 1 1 247.382 3.768 20 0 BHADMO CCCCC[N@@H+](Cc1cnccn1)[C@@H](C)CCC ZINC000556773415 384477958 /nfs/dbraw/zinc/47/79/58/384477958.db2.gz JIUAQPMYVKQYRL-AWEZNQCLSA-N 1 1 249.402 3.657 20 0 BHADMO CCCCC[N@@H+](Cc1cnccn1)[C@H](C)CCC ZINC000556773416 384476625 /nfs/dbraw/zinc/47/66/25/384476625.db2.gz JIUAQPMYVKQYRL-CQSZACIVSA-N 1 1 249.402 3.657 20 0 BHADMO Cc1sccc1C[N@H+](CC1CC1)C(C)C ZINC000556800527 384487132 /nfs/dbraw/zinc/48/71/32/384487132.db2.gz SHBODICZFOODMM-UHFFFAOYSA-N 1 1 223.385 3.677 20 0 BHADMO CC(C)[N@@H+](CC1CC1)C[C@@H]1C[C@@H]1c1ccccc1 ZINC000556804760 384492492 /nfs/dbraw/zinc/49/24/92/384492492.db2.gz BFNPOQVKHUGAPS-DLBZAZTESA-N 1 1 243.394 3.911 20 0 BHADMO CC(C)[N@@H+](CC1CC1)C[C@H]1C[C@@H]1c1ccccc1 ZINC000556804765 384491376 /nfs/dbraw/zinc/49/13/76/384491376.db2.gz BFNPOQVKHUGAPS-IAGOWNOFSA-N 1 1 243.394 3.911 20 0 BHADMO CC(C)[N@@H+](CC1CC1)C[C@@H]1C[C@H]1c1ccccc1 ZINC000556804766 384492205 /nfs/dbraw/zinc/49/22/05/384492205.db2.gz BFNPOQVKHUGAPS-IRXDYDNUSA-N 1 1 243.394 3.911 20 0 BHADMO CC(C)[N@@H+](CC1CC1)C[C@H]1C[C@H]1c1ccccc1 ZINC000556804767 384493048 /nfs/dbraw/zinc/49/30/48/384493048.db2.gz BFNPOQVKHUGAPS-SJORKVTESA-N 1 1 243.394 3.911 20 0 BHADMO C[C@@H](F)CC[N@@H+](C)[C@H]1CCCc2ccccc21 ZINC000556813627 384503736 /nfs/dbraw/zinc/50/37/36/384503736.db2.gz DCXKDPPXGSNYDI-DOMZBBRYSA-N 1 1 235.346 3.744 20 0 BHADMO C[C@@H](F)CC[N@@H+](C)[C@@H]1CCCc2ccccc21 ZINC000556813628 384501830 /nfs/dbraw/zinc/50/18/30/384501830.db2.gz DCXKDPPXGSNYDI-IUODEOHRSA-N 1 1 235.346 3.744 20 0 BHADMO C[C@H](F)CC[N@@H+](C)[C@@H]1CCCc2ccccc21 ZINC000556813629 384502060 /nfs/dbraw/zinc/50/20/60/384502060.db2.gz DCXKDPPXGSNYDI-SWLSCSKDSA-N 1 1 235.346 3.744 20 0 BHADMO C[C@H](F)CC[N@@H+](C)[C@H]1CCCc2ccccc21 ZINC000556813630 384502142 /nfs/dbraw/zinc/50/21/42/384502142.db2.gz DCXKDPPXGSNYDI-WFASDCNBSA-N 1 1 235.346 3.744 20 0 BHADMO C[C@H](F)CC[N@H+]1CC[C@H](C)[C@H]2CCCC[C@@H]21 ZINC000556813777 384502663 /nfs/dbraw/zinc/50/26/63/384502663.db2.gz QHZYQZBJYRSNLC-FQUUOJAGSA-N 1 1 227.367 3.635 20 0 BHADMO C[C@H](F)CC[N@H+]1CC[C@H](C)[C@H]2CCCC[C@H]21 ZINC000556813781 384501886 /nfs/dbraw/zinc/50/18/86/384501886.db2.gz QHZYQZBJYRSNLC-IGQOVBAYSA-N 1 1 227.367 3.635 20 0 BHADMO C[C@H](F)CC[N@H+]1CC[C@H](C)[C@@H]2CCCC[C@H]21 ZINC000556813782 384503325 /nfs/dbraw/zinc/50/33/25/384503325.db2.gz QHZYQZBJYRSNLC-XDQVBPFNSA-N 1 1 227.367 3.635 20 0 BHADMO C[C@H](F)CC[N@H+]1CC[C@H](C)[C@@H]2CCCC[C@@H]21 ZINC000556813783 384502720 /nfs/dbraw/zinc/50/27/20/384502720.db2.gz QHZYQZBJYRSNLC-XUXIUFHCSA-N 1 1 227.367 3.635 20 0 BHADMO CCC[N@@H+](CCCCF)Cc1ccc(C)cc1 ZINC000556814824 384505522 /nfs/dbraw/zinc/50/55/22/384505522.db2.gz FRWHHKCPZUVBTA-UHFFFAOYSA-N 1 1 237.362 3.957 20 0 BHADMO Cc1cc(Cl)cc(C[N@@H+]2[C@H](C)C[C@@H]2C)c1 ZINC000556853732 384531382 /nfs/dbraw/zinc/53/13/82/384531382.db2.gz JPZTWJDHOSBOTB-PHIMTYICSA-N 1 1 223.747 3.631 20 0 BHADMO CC[C@@H](C[N@H+]1CCSC[C@@H]1C)c1ccccc1 ZINC000556866635 384556158 /nfs/dbraw/zinc/55/61/58/384556158.db2.gz DPBOQRUSHCSTLU-KBPBESRZSA-N 1 1 249.423 3.618 20 0 BHADMO CC[C@@H](C[N@H+]1CCSC[C@H]1C)c1ccccc1 ZINC000556866636 384556775 /nfs/dbraw/zinc/55/67/75/384556775.db2.gz DPBOQRUSHCSTLU-KGLIPLIRSA-N 1 1 249.423 3.618 20 0 BHADMO CC[C@H](C[N@H+]1CCSC[C@@H]1C)c1ccccc1 ZINC000556866637 384558493 /nfs/dbraw/zinc/55/84/93/384558493.db2.gz DPBOQRUSHCSTLU-UONOGXRCSA-N 1 1 249.423 3.618 20 0 BHADMO CC[C@H](C[N@H+]1CCSC[C@H]1C)c1ccccc1 ZINC000556866638 384556636 /nfs/dbraw/zinc/55/66/36/384556636.db2.gz DPBOQRUSHCSTLU-ZIAGYGMSSA-N 1 1 249.423 3.618 20 0 BHADMO CC(C)C[N@H+]1CCC[C@H](c2ccccc2)C1 ZINC000556883476 384598540 /nfs/dbraw/zinc/59/85/40/384598540.db2.gz GOWSLRBXXVNXCD-HNNXBMFYSA-N 1 1 217.356 3.522 20 0 BHADMO CC(C)C[N@H+]1CCC[C@@H](c2ccccc2)C1 ZINC000556883477 384596990 /nfs/dbraw/zinc/59/69/90/384596990.db2.gz GOWSLRBXXVNXCD-OAHLLOKOSA-N 1 1 217.356 3.522 20 0 BHADMO C[C@@H]1C[C@H]1C[N@H+]1CCC[C@@H](c2ccccc2)C1 ZINC000556885873 384600937 /nfs/dbraw/zinc/60/09/37/384600937.db2.gz PZPIJFQVZPPLAL-BMFZPTHFSA-N 1 1 229.367 3.522 20 0 BHADMO C[C@@H]1C[C@@H]1C[N@H+]1CCC[C@@H](c2ccccc2)C1 ZINC000556885874 384600223 /nfs/dbraw/zinc/60/02/23/384600223.db2.gz PZPIJFQVZPPLAL-FVQBIDKESA-N 1 1 229.367 3.522 20 0 BHADMO C[C@@H]1C[C@H]1C[N@H+]1CCC[C@H](c2ccccc2)C1 ZINC000556885875 384601945 /nfs/dbraw/zinc/60/19/45/384601945.db2.gz PZPIJFQVZPPLAL-KBMXLJTQSA-N 1 1 229.367 3.522 20 0 BHADMO C[C@@H]1C[C@@H]1C[N@H+]1CCC[C@H](c2ccccc2)C1 ZINC000556885876 384601301 /nfs/dbraw/zinc/60/13/01/384601301.db2.gz PZPIJFQVZPPLAL-VNQPRFMTSA-N 1 1 229.367 3.522 20 0 BHADMO CC[N@@H+](Cc1ccc(C)c(C)c1)C1CCC1 ZINC000556900635 384627792 /nfs/dbraw/zinc/62/77/92/384627792.db2.gz BIXZNDZPDPMHHM-UHFFFAOYSA-N 1 1 217.356 3.678 20 0 BHADMO C/C(=C\c1ccccc1)C[N@H+]1CC[C@@H](C2CC2)C1 ZINC000556925939 384660019 /nfs/dbraw/zinc/66/00/19/384660019.db2.gz OCCBDVHHYILABT-GWKQRERASA-N 1 1 241.378 3.822 20 0 BHADMO C/C(=C/c1ccccc1)C[N@H+]1CC[C@H](C2CC2)C1 ZINC000556925940 384658277 /nfs/dbraw/zinc/65/82/77/384658277.db2.gz OCCBDVHHYILABT-IFCKCIONSA-N 1 1 241.378 3.822 20 0 BHADMO C/C(=C/c1ccccc1)C[N@H+]1CC[C@@H](C2CC2)C1 ZINC000556925941 384657959 /nfs/dbraw/zinc/65/79/59/384657959.db2.gz OCCBDVHHYILABT-VWILAXROSA-N 1 1 241.378 3.822 20 0 BHADMO C/C(=C\c1ccccc1)C[N@H+]1CC[C@H](C2CC2)C1 ZINC000556925942 384658365 /nfs/dbraw/zinc/65/83/65/384658365.db2.gz OCCBDVHHYILABT-WKOYGUFESA-N 1 1 241.378 3.822 20 0 BHADMO Fc1ccc(/C=C/C[N@H+]2CC[C@@H](C3CC3)C2)cc1 ZINC000556926024 384658035 /nfs/dbraw/zinc/65/80/35/384658035.db2.gz SQSFPRNUXWYNCY-BGTMTDRBSA-N 1 1 245.341 3.571 20 0 BHADMO Fc1ccc(/C=C\C[N@H+]2CC[C@@H](C3CC3)C2)cc1 ZINC000556926025 384658917 /nfs/dbraw/zinc/65/89/17/384658917.db2.gz SQSFPRNUXWYNCY-DJYNDVHFSA-N 1 1 245.341 3.571 20 0 BHADMO Fc1ccc(/C=C\C[N@H+]2CC[C@H](C3CC3)C2)cc1 ZINC000556926026 384658455 /nfs/dbraw/zinc/65/84/55/384658455.db2.gz SQSFPRNUXWYNCY-OYADATRGSA-N 1 1 245.341 3.571 20 0 BHADMO Fc1ccc(/C=C/C[N@H+]2CC[C@H](C3CC3)C2)cc1 ZINC000556926027 384659126 /nfs/dbraw/zinc/65/91/26/384659126.db2.gz SQSFPRNUXWYNCY-YLSAJCSVSA-N 1 1 245.341 3.571 20 0 BHADMO CC(C)c1ccc(CC[NH2+]CC(C)(F)F)cc1 ZINC000556932664 384660923 /nfs/dbraw/zinc/66/09/23/384660923.db2.gz CQOAPKQYQJVHTM-UHFFFAOYSA-N 1 1 241.325 3.597 20 0 BHADMO CC[C@@H](C[N@H+]1CCC[C@@H]1CF)c1ccccc1 ZINC000556950556 384679324 /nfs/dbraw/zinc/67/93/24/384679324.db2.gz CWPMYDPZPIYABP-DZGCQCFKSA-N 1 1 235.346 3.614 20 0 BHADMO CC[C@H](C[N@H+]1CCC[C@H]1CF)c1ccccc1 ZINC000556950557 384679774 /nfs/dbraw/zinc/67/97/74/384679774.db2.gz CWPMYDPZPIYABP-HIFRSBDPSA-N 1 1 235.346 3.614 20 0 BHADMO CC[C@H](C[N@H+]1CCC[C@@H]1CF)c1ccccc1 ZINC000556950558 384678243 /nfs/dbraw/zinc/67/82/43/384678243.db2.gz CWPMYDPZPIYABP-UKRRQHHQSA-N 1 1 235.346 3.614 20 0 BHADMO CC[C@@H](C[N@H+]1CCC[C@H]1CF)c1ccccc1 ZINC000556950559 384678790 /nfs/dbraw/zinc/67/87/90/384678790.db2.gz CWPMYDPZPIYABP-ZFWWWQNUSA-N 1 1 235.346 3.614 20 0 BHADMO C[C@H](CCc1ccccc1)C[N@H+]1CCC[C@@H]1CF ZINC000556950571 384678702 /nfs/dbraw/zinc/67/87/02/384678702.db2.gz FCJSWYWDEIETQL-GDBMZVCRSA-N 1 1 249.373 3.689 20 0 BHADMO C[C@@H](CCc1ccccc1)C[N@H+]1CCC[C@@H]1CF ZINC000556950572 384679224 /nfs/dbraw/zinc/67/92/24/384679224.db2.gz FCJSWYWDEIETQL-GOEBONIOSA-N 1 1 249.373 3.689 20 0 BHADMO C[C@@H](CCc1ccccc1)C[N@H+]1CCC[C@H]1CF ZINC000556950573 384678636 /nfs/dbraw/zinc/67/86/36/384678636.db2.gz FCJSWYWDEIETQL-HOCLYGCPSA-N 1 1 249.373 3.689 20 0 BHADMO C[C@H](CCc1ccccc1)C[N@H+]1CCC[C@H]1CF ZINC000556950574 384679442 /nfs/dbraw/zinc/67/94/42/384679442.db2.gz FCJSWYWDEIETQL-ZBFHGGJFSA-N 1 1 249.373 3.689 20 0 BHADMO CCCC[N@@H+](Cc1cc[nH]n1)[C@@H]1CCC[C@H](C)C1 ZINC000556950783 384678263 /nfs/dbraw/zinc/67/82/63/384678263.db2.gz RCQBUIFRFWUJQQ-DZGCQCFKSA-N 1 1 249.402 3.591 20 0 BHADMO CCCC[N@@H+](Cc1cc[nH]n1)[C@H]1CCC[C@@H](C)C1 ZINC000556950784 384679898 /nfs/dbraw/zinc/67/98/98/384679898.db2.gz RCQBUIFRFWUJQQ-HIFRSBDPSA-N 1 1 249.402 3.591 20 0 BHADMO CCCC[N@@H+](Cc1cc[nH]n1)[C@@H]1CCC[C@@H](C)C1 ZINC000556950785 384678430 /nfs/dbraw/zinc/67/84/30/384678430.db2.gz RCQBUIFRFWUJQQ-UKRRQHHQSA-N 1 1 249.402 3.591 20 0 BHADMO CCCC[N@@H+](Cc1cc[nH]n1)[C@H]1CCC[C@H](C)C1 ZINC000556950786 384677691 /nfs/dbraw/zinc/67/76/91/384677691.db2.gz RCQBUIFRFWUJQQ-ZFWWWQNUSA-N 1 1 249.402 3.591 20 0 BHADMO C[C@@H](Cc1ccsc1)[N@H+]1CC[C@H](CC2CC2)C1 ZINC000556958573 384688005 /nfs/dbraw/zinc/68/80/05/384688005.db2.gz HUBWEGGJKJRQKL-GXTWGEPZSA-N 1 1 249.423 3.801 20 0 BHADMO C[C@@H](Cc1ccsc1)[N@H+]1CC[C@@H](CC2CC2)C1 ZINC000556958575 384687946 /nfs/dbraw/zinc/68/79/46/384687946.db2.gz HUBWEGGJKJRQKL-JSGCOSHPSA-N 1 1 249.423 3.801 20 0 BHADMO C[C@H](Cc1ccsc1)[N@H+]1CC[C@@H](CC2CC2)C1 ZINC000556958579 384686964 /nfs/dbraw/zinc/68/69/64/384686964.db2.gz HUBWEGGJKJRQKL-OCCSQVGLSA-N 1 1 249.423 3.801 20 0 BHADMO C[C@H](Cc1ccsc1)[N@H+]1CC[C@H](CC2CC2)C1 ZINC000556958581 384686529 /nfs/dbraw/zinc/68/65/29/384686529.db2.gz HUBWEGGJKJRQKL-TZMCWYRMSA-N 1 1 249.423 3.801 20 0 BHADMO C[C@H](C1CCCCC1)[N@@H+](C)CCOC(C)(C)C ZINC000556958604 384686986 /nfs/dbraw/zinc/68/69/86/384686986.db2.gz OYCHUGXJDJILGH-CYBMUJFWSA-N 1 1 241.419 3.702 20 0 BHADMO Cc1ccoc1C[N@H+]1CC(C)(C)[C@@H]2CCC[C@H]21 ZINC000556959840 384692660 /nfs/dbraw/zinc/69/26/60/384692660.db2.gz GOPVIFPPFLNBES-CHWSQXEVSA-N 1 1 233.355 3.599 20 0 BHADMO Cc1ccoc1C[N@H+]1CC(C)(C)[C@@H]2CCC[C@@H]21 ZINC000556959841 384694942 /nfs/dbraw/zinc/69/49/42/384694942.db2.gz GOPVIFPPFLNBES-OLZOCXBDSA-N 1 1 233.355 3.599 20 0 BHADMO Cc1ccoc1C[N@H+]1CC(C)(C)[C@H]2CCC[C@H]21 ZINC000556959842 384694248 /nfs/dbraw/zinc/69/42/48/384694248.db2.gz GOPVIFPPFLNBES-QWHCGFSZSA-N 1 1 233.355 3.599 20 0 BHADMO Cc1ccoc1C[N@H+]1CC(C)(C)[C@H]2CCC[C@@H]21 ZINC000556959843 384693771 /nfs/dbraw/zinc/69/37/71/384693771.db2.gz GOPVIFPPFLNBES-STQMWFEESA-N 1 1 233.355 3.599 20 0 BHADMO CCC[N@@H+](C)Cc1ccccc1OCC(C)C ZINC000556989494 384734625 /nfs/dbraw/zinc/73/46/25/384734625.db2.gz DDYUDKWFKKFIPV-UHFFFAOYSA-N 1 1 235.371 3.563 20 0 BHADMO CCc1ccc(C[N@H+]2CC[C@@H](C)C(C)(C)C2)nc1 ZINC000557025956 384754348 /nfs/dbraw/zinc/75/43/48/384754348.db2.gz VRKDRBISXMIOBM-CYBMUJFWSA-N 1 1 246.398 3.512 20 0 BHADMO CCc1ccc(C[N@H+]2CC[C@H](C)C(C)(C)C2)nc1 ZINC000557025957 384753407 /nfs/dbraw/zinc/75/34/07/384753407.db2.gz VRKDRBISXMIOBM-ZDUSSCGKSA-N 1 1 246.398 3.512 20 0 BHADMO C[C@@H]1C[N@@H+](Cc2ccc(C(F)(F)F)cc2)[C@@H]1C ZINC000557046679 384769329 /nfs/dbraw/zinc/76/93/29/384769329.db2.gz XHODTSPBOGMVNE-NXEZZACHSA-N 1 1 243.272 3.546 20 0 BHADMO C[C@H]1C[N@@H+](Cc2ccc(C(F)(F)F)cc2)[C@H]1C ZINC000557046681 384770568 /nfs/dbraw/zinc/77/05/68/384770568.db2.gz XHODTSPBOGMVNE-UWVGGRQHSA-N 1 1 243.272 3.546 20 0 BHADMO C[C@@H]1[C@@H](C)C[N@H+]1Cc1ccc(C(F)(F)F)cc1 ZINC000557046682 384769929 /nfs/dbraw/zinc/76/99/29/384769929.db2.gz XHODTSPBOGMVNE-VHSXEESVSA-N 1 1 243.272 3.546 20 0 BHADMO C[C@@H]1C[N@@H+](Cc2ccc(C(F)(F)F)cc2)[C@H]1C ZINC000557046684 384768707 /nfs/dbraw/zinc/76/87/07/384768707.db2.gz XHODTSPBOGMVNE-ZJUUUORDSA-N 1 1 243.272 3.546 20 0 BHADMO CC(C)C[C@H](C)[N@@H+](C)CCOCc1ccccc1 ZINC000557084252 384803748 /nfs/dbraw/zinc/80/37/48/384803748.db2.gz NJXHLMXYSXIBPW-HNNXBMFYSA-N 1 1 249.398 3.570 20 0 BHADMO CC(C)C[C@@H](C)[N@@H+](C)CCOCc1ccccc1 ZINC000557084253 384802837 /nfs/dbraw/zinc/80/28/37/384802837.db2.gz NJXHLMXYSXIBPW-OAHLLOKOSA-N 1 1 249.398 3.570 20 0 BHADMO CCC[N@@H+](Cc1ccc(C)cc1)C(C)C ZINC000557202488 384881328 /nfs/dbraw/zinc/88/13/28/384881328.db2.gz USYIPGOWJOBZIS-UHFFFAOYSA-N 1 1 205.345 3.615 20 0 BHADMO CC[C@@H]1CCC[N@@H+](C[C@H]2CCC(F)(F)C2)C1 ZINC000557336420 384914821 /nfs/dbraw/zinc/91/48/21/384914821.db2.gz RRZQIWXKJOPMFQ-NEPJUHHUSA-N 1 1 231.330 3.544 20 0 BHADMO CC[C@H]1CCC[N@@H+](C[C@@H]2CCC(F)(F)C2)C1 ZINC000557336421 384913925 /nfs/dbraw/zinc/91/39/25/384913925.db2.gz RRZQIWXKJOPMFQ-NWDGAFQWSA-N 1 1 231.330 3.544 20 0 BHADMO CC[C@H]1CCC[N@@H+](C[C@H]2CCC(F)(F)C2)C1 ZINC000557336422 384914232 /nfs/dbraw/zinc/91/42/32/384914232.db2.gz RRZQIWXKJOPMFQ-RYUDHWBXSA-N 1 1 231.330 3.544 20 0 BHADMO CC[C@@H]1CCC[N@@H+](C[C@@H]2CCC(F)(F)C2)C1 ZINC000557336423 384914613 /nfs/dbraw/zinc/91/46/13/384914613.db2.gz RRZQIWXKJOPMFQ-VXGBXAGGSA-N 1 1 231.330 3.544 20 0 BHADMO CSCCC[N@H+]1CCc2ccccc2C1(C)C ZINC000557340486 384915643 /nfs/dbraw/zinc/91/56/43/384915643.db2.gz SFNIBRVDGXPQOL-UHFFFAOYSA-N 1 1 249.423 3.533 20 0 BHADMO Cc1ccc([C@H]2CC[N@@H+](CCCCF)C2)cc1 ZINC000557385316 384925125 /nfs/dbraw/zinc/92/51/25/384925125.db2.gz RZOGGQBYBXNSDA-HNNXBMFYSA-N 1 1 235.346 3.534 20 0 BHADMO Cc1ccc([C@@H]2CC[N@@H+](CCCCF)C2)cc1 ZINC000557385317 384925701 /nfs/dbraw/zinc/92/57/01/384925701.db2.gz RZOGGQBYBXNSDA-OAHLLOKOSA-N 1 1 235.346 3.534 20 0 BHADMO Cc1cccc(OCC[N@H+](C)[C@@H](C)CC(C)C)c1 ZINC000557436073 384944476 /nfs/dbraw/zinc/94/44/76/384944476.db2.gz MPGJLRHDKRIRCK-HNNXBMFYSA-N 1 1 249.398 3.740 20 0 BHADMO Cc1cccc(OCC[N@H+](C)[C@H](C)CC(C)C)c1 ZINC000557436076 384942590 /nfs/dbraw/zinc/94/25/90/384942590.db2.gz MPGJLRHDKRIRCK-OAHLLOKOSA-N 1 1 249.398 3.740 20 0 BHADMO Cc1ccc(OCC[N@H+](C)[C@@H](C)CC(C)C)cc1 ZINC000557436391 384943900 /nfs/dbraw/zinc/94/39/00/384943900.db2.gz PJQAGWHAKOMWOG-HNNXBMFYSA-N 1 1 249.398 3.740 20 0 BHADMO Cc1ccc(OCC[N@H+](C)[C@H](C)CC(C)C)cc1 ZINC000557436396 384942966 /nfs/dbraw/zinc/94/29/66/384942966.db2.gz PJQAGWHAKOMWOG-OAHLLOKOSA-N 1 1 249.398 3.740 20 0 BHADMO CC(C)OCC[N@H+]1CCCC[C@H]1c1ccccc1 ZINC000557549338 385014018 /nfs/dbraw/zinc/01/40/18/385014018.db2.gz FAIKWIPDLSLUJV-INIZCTEOSA-N 1 1 247.382 3.639 20 0 BHADMO CC(C)OCC[N@H+]1CCCC[C@@H]1c1ccccc1 ZINC000557549339 385014697 /nfs/dbraw/zinc/01/46/97/385014697.db2.gz FAIKWIPDLSLUJV-MRXNPFEDSA-N 1 1 247.382 3.639 20 0 BHADMO CCC[N@@H+](CC)Cc1c(C)cccc1C ZINC000557619145 385047375 /nfs/dbraw/zinc/04/73/75/385047375.db2.gz LQCSKQRDEOGFNA-UHFFFAOYSA-N 1 1 205.345 3.535 20 0 BHADMO Clc1cccc2c1C[N@H+]([C@@H]1C=CCCC1)C2 ZINC000558143973 385333529 /nfs/dbraw/zinc/33/35/29/385333529.db2.gz DZQLUYLXOQMOHH-GFCCVEGCSA-N 1 1 233.742 3.764 20 0 BHADMO Clc1cccc2c1C[N@H+]([C@H]1C=CCCC1)C2 ZINC000558143974 385333248 /nfs/dbraw/zinc/33/32/48/385333248.db2.gz DZQLUYLXOQMOHH-LBPRGKRZSA-N 1 1 233.742 3.764 20 0 BHADMO CC(C)C[N@H+]1CC(C)(C)[C@H]1c1cccs1 ZINC000558177698 383833168 /nfs/dbraw/zinc/83/31/68/383833168.db2.gz MSZLKQSHGVAYPB-GFCCVEGCSA-N 1 1 223.385 3.787 20 0 BHADMO CC(C)C[N@H+]1CC(C)(C)[C@@H]1c1cccs1 ZINC000558177699 383831855 /nfs/dbraw/zinc/83/18/55/383831855.db2.gz MSZLKQSHGVAYPB-LBPRGKRZSA-N 1 1 223.385 3.787 20 0 BHADMO CC[C@H]1CC[C@@H]1[NH2+]CC(F)(F)c1ccccc1 ZINC000558254572 383883749 /nfs/dbraw/zinc/88/37/49/383883749.db2.gz JIOFOARNOAZCAL-AAEUAGOBSA-N 1 1 239.309 3.557 20 0 BHADMO CC[C@@H]1CC[C@H]1[NH2+]CC(F)(F)c1ccccc1 ZINC000558254573 322948105 /nfs/dbraw/zinc/94/81/05/322948105.db2.gz JIOFOARNOAZCAL-DGCLKSJQSA-N 1 1 239.309 3.557 20 0 BHADMO CC[C@H]1CC[C@H]1[NH2+]CC(F)(F)c1ccccc1 ZINC000558254574 383884201 /nfs/dbraw/zinc/88/42/01/383884201.db2.gz JIOFOARNOAZCAL-WCQYABFASA-N 1 1 239.309 3.557 20 0 BHADMO CC[C@@H]1CC[C@@H]1[NH2+]CC(F)(F)c1ccccc1 ZINC000558254575 383884061 /nfs/dbraw/zinc/88/40/61/383884061.db2.gz JIOFOARNOAZCAL-YPMHNXCESA-N 1 1 239.309 3.557 20 0 BHADMO c1cc2cc[nH+]cc2c(N[C@H]2CC[C@H]2C2CC2)c1 ZINC000558273593 343884246 /nfs/dbraw/zinc/88/42/46/343884246.db2.gz SGJLLGINRIXJAO-BBRMVZONSA-N 1 1 238.334 3.835 20 0 BHADMO c1cc2cc[nH+]cc2c(N[C@H]2CC[C@@H]2C2CC2)c1 ZINC000558273595 343884405 /nfs/dbraw/zinc/88/44/05/343884405.db2.gz SGJLLGINRIXJAO-CJNGLKHVSA-N 1 1 238.334 3.835 20 0 BHADMO c1cc2cc[nH+]cc2c(N[C@@H]2CC[C@@H]2C2CC2)c1 ZINC000558273597 343884286 /nfs/dbraw/zinc/88/42/86/343884286.db2.gz SGJLLGINRIXJAO-CZUORRHYSA-N 1 1 238.334 3.835 20 0 BHADMO c1cc2cc[nH+]cc2c(N[C@@H]2CC[C@H]2C2CC2)c1 ZINC000558273599 343884581 /nfs/dbraw/zinc/88/45/81/343884581.db2.gz SGJLLGINRIXJAO-XJKSGUPXSA-N 1 1 238.334 3.835 20 0 BHADMO CCc1ccc(C[N@H+](C(CC)CC)C2CC2)cn1 ZINC000558393840 383978272 /nfs/dbraw/zinc/97/82/72/383978272.db2.gz RCHDKOQHFHBAMB-UHFFFAOYSA-N 1 1 246.398 3.797 20 0 BHADMO Cc1cccc([C@H](C)[NH+]2CC(C(F)(F)F)C2)c1 ZINC000558397512 322949340 /nfs/dbraw/zinc/94/93/40/322949340.db2.gz PFLSQPMCZMZJBB-JTQLQIEISA-N 1 1 243.272 3.550 20 0 BHADMO Cc1cccc([C@@H](C)[NH+]2CC(C(F)(F)F)C2)c1 ZINC000558397513 383981672 /nfs/dbraw/zinc/98/16/72/383981672.db2.gz PFLSQPMCZMZJBB-SNVBAGLBSA-N 1 1 243.272 3.550 20 0 BHADMO Cc1cc(C[N@@H+]2CCCC[C@@H](C)C2)cc(C)c1O ZINC000558405712 383990934 /nfs/dbraw/zinc/99/09/34/383990934.db2.gz YLOZSEIVLGFQHC-GFCCVEGCSA-N 1 1 247.382 3.631 20 0 BHADMO Cc1cc(C[N@@H+]2CCCC[C@H](C)C2)cc(C)c1O ZINC000558405713 383989302 /nfs/dbraw/zinc/98/93/02/383989302.db2.gz YLOZSEIVLGFQHC-LBPRGKRZSA-N 1 1 247.382 3.631 20 0 BHADMO CCC[N@H+](Cc1ccc(Cl)cn1)CC(C)C ZINC000558407931 383994554 /nfs/dbraw/zinc/99/45/54/383994554.db2.gz MDZTXKMBMMYZJY-UHFFFAOYSA-N 1 1 240.778 3.603 20 0 BHADMO C[C@H]([N@@H+](C)Cc1ccc(Cl)cn1)C(C)(C)C ZINC000558408406 383990085 /nfs/dbraw/zinc/99/00/85/383990085.db2.gz IYZJWCRHIYLCDB-JTQLQIEISA-N 1 1 240.778 3.601 20 0 BHADMO C[C@@H]([N@@H+](C)Cc1ccc(Cl)cn1)C(C)(C)C ZINC000558408408 383989269 /nfs/dbraw/zinc/98/92/69/383989269.db2.gz IYZJWCRHIYLCDB-SNVBAGLBSA-N 1 1 240.778 3.601 20 0 BHADMO CC[C@@H](C)C[N@@H+](CC)Cc1ccc(Cl)cn1 ZINC000558410313 383993409 /nfs/dbraw/zinc/99/34/09/383993409.db2.gz PVWHDQSRLMXKRY-LLVKDONJSA-N 1 1 240.778 3.603 20 0 BHADMO CC[C@H](C)C[N@@H+](CC)Cc1ccc(Cl)cn1 ZINC000558410315 383992460 /nfs/dbraw/zinc/99/24/60/383992460.db2.gz PVWHDQSRLMXKRY-NSHDSACASA-N 1 1 240.778 3.603 20 0 BHADMO CC[N@H+](Cc1ccncc1)CC(C(C)C)C(C)C ZINC000558416820 383992562 /nfs/dbraw/zinc/99/25/62/383992562.db2.gz JGOSSBNPLCEVQA-UHFFFAOYSA-N 1 1 248.414 3.832 20 0 BHADMO CCC(C)(C)CC[N@H+]1CCC(F)(F)[C@H](C)C1 ZINC000558467056 398100449 /nfs/dbraw/zinc/10/04/49/398100449.db2.gz SQEXHDKCWYOQFG-LLVKDONJSA-N 1 1 233.346 3.790 20 0 BHADMO CCC(C)(C)CC[N@H+]1CCC(F)(F)[C@@H](C)C1 ZINC000558467072 398100425 /nfs/dbraw/zinc/10/04/25/398100425.db2.gz SQEXHDKCWYOQFG-NSHDSACASA-N 1 1 233.346 3.790 20 0 BHADMO C[C@@H]1C[N@@H+](CCCC2CCCC2)CCC1(F)F ZINC000558467275 398100330 /nfs/dbraw/zinc/10/03/30/398100330.db2.gz VRYLUIWLDSOSIY-GFCCVEGCSA-N 1 1 245.357 3.934 20 0 BHADMO C[C@H]1C[N@@H+](CCCC2CCCC2)CCC1(F)F ZINC000558467276 398100462 /nfs/dbraw/zinc/10/04/62/398100462.db2.gz VRYLUIWLDSOSIY-LBPRGKRZSA-N 1 1 245.357 3.934 20 0 BHADMO CC[C@@H](C)C[N@@H+](CC)CC1(SC)CCC1 ZINC000558566792 384188950 /nfs/dbraw/zinc/18/89/50/384188950.db2.gz LVDFEASYKPHXLJ-GFCCVEGCSA-N 1 1 229.433 3.640 20 0 BHADMO CC[C@H](C)C[N@@H+](CC)CC1(SC)CCC1 ZINC000558566799 384187813 /nfs/dbraw/zinc/18/78/13/384187813.db2.gz LVDFEASYKPHXLJ-LBPRGKRZSA-N 1 1 229.433 3.640 20 0 BHADMO CC[N@@H+](CCc1ccc(F)cc1Cl)C1CC1 ZINC000558569444 384188496 /nfs/dbraw/zinc/18/84/96/384188496.db2.gz KZOCTTNTEQSLCQ-UHFFFAOYSA-N 1 1 241.737 3.506 20 0 BHADMO CC1(C)[C@@H]2C[N@@H+]([C@@H]3CCCc4ccccc43)C[C@@H]21 ZINC000558602543 384196487 /nfs/dbraw/zinc/19/64/87/384196487.db2.gz WHTDVZUNXQVENQ-OWCLPIDISA-N 1 1 241.378 3.652 20 0 BHADMO CC1(C)[C@@H]2C[N@@H+]([C@H]3CCCc4ccccc43)C[C@@H]21 ZINC000558602546 384196025 /nfs/dbraw/zinc/19/60/25/384196025.db2.gz WHTDVZUNXQVENQ-XHSDSOJGSA-N 1 1 241.378 3.652 20 0 BHADMO CC[C@]1(C)CCC[N@@H+](CCSC(C)C)C1 ZINC000558724269 384261893 /nfs/dbraw/zinc/26/18/93/384261893.db2.gz BJORHUGFNGVUDV-CYBMUJFWSA-N 1 1 229.433 3.640 20 0 BHADMO CC[C@@]1(C)CCC[N@@H+](CCSC(C)C)C1 ZINC000558724280 384260977 /nfs/dbraw/zinc/26/09/77/384260977.db2.gz BJORHUGFNGVUDV-ZDUSSCGKSA-N 1 1 229.433 3.640 20 0 BHADMO CCCC[N@H+]1CCC(C)=C(c2ccco2)C1 ZINC000558733453 398199898 /nfs/dbraw/zinc/19/98/98/398199898.db2.gz BPOABFUJKXQBHY-UHFFFAOYSA-N 1 1 219.328 3.559 20 0 BHADMO c1ccc([C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3CC2CC2)cc1 ZINC000558733988 398200329 /nfs/dbraw/zinc/20/03/29/398200329.db2.gz JZEQMLYTUGJGKU-BJWYYQGGSA-N 1 1 241.378 3.807 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@H](C)C2CCCCC2)nc1 ZINC000558734146 398200059 /nfs/dbraw/zinc/20/00/59/398200059.db2.gz NJPCPGZDDYDYLI-CQSZACIVSA-N 1 1 246.398 3.791 20 0 BHADMO COC(C)(C)CC[N@@H+](C)[C@H](C)C1CCCCC1 ZINC000558734716 398200347 /nfs/dbraw/zinc/20/03/47/398200347.db2.gz RUALECYGEYTEGA-CYBMUJFWSA-N 1 1 241.419 3.702 20 0 BHADMO CC1=C(c2ccco2)C[N@H+]([C@H]2C=CCCC2)CC1 ZINC000558734949 384268222 /nfs/dbraw/zinc/26/82/22/384268222.db2.gz XNDUVHKCCOIPIO-AWEZNQCLSA-N 1 1 243.350 3.868 20 0 BHADMO CC1=C(c2ccco2)C[N@H+]([C@@H]2C=CCCC2)CC1 ZINC000558734972 384266573 /nfs/dbraw/zinc/26/65/73/384266573.db2.gz XNDUVHKCCOIPIO-CQSZACIVSA-N 1 1 243.350 3.868 20 0 BHADMO CC[C@@H](C)[N@H+]1CC[C@@H](C(F)(F)F)C2(CCC2)C1 ZINC000558737219 384268686 /nfs/dbraw/zinc/26/86/86/384268686.db2.gz XPCFEORFRFJXCH-GHMZBOCLSA-N 1 1 249.320 3.839 20 0 BHADMO CC[C@@H](C)[N@H+]1CC[C@H](C(F)(F)F)C2(CCC2)C1 ZINC000558737220 384267649 /nfs/dbraw/zinc/26/76/49/384267649.db2.gz XPCFEORFRFJXCH-MNOVXSKESA-N 1 1 249.320 3.839 20 0 BHADMO CC[C@H](C)[N@H+]1CC[C@H](C(F)(F)F)C2(CCC2)C1 ZINC000558737221 384266831 /nfs/dbraw/zinc/26/68/31/384266831.db2.gz XPCFEORFRFJXCH-QWRGUYRKSA-N 1 1 249.320 3.839 20 0 BHADMO CC[C@H](C)[N@H+]1CC[C@@H](C(F)(F)F)C2(CCC2)C1 ZINC000558737222 384268319 /nfs/dbraw/zinc/26/83/19/384268319.db2.gz XPCFEORFRFJXCH-WDEREUQCSA-N 1 1 249.320 3.839 20 0 BHADMO CCC[N@H+]1CC[C@](F)(c2cccc(Cl)c2)C1 ZINC000558745045 384269797 /nfs/dbraw/zinc/26/97/97/384269797.db2.gz XSXRVFONWQLGTI-CYBMUJFWSA-N 1 1 241.737 3.621 20 0 BHADMO CCC[N@@H+]1CC[C@](F)(c2cccc(Cl)c2)C1 ZINC000558745045 384269792 /nfs/dbraw/zinc/26/97/92/384269792.db2.gz XSXRVFONWQLGTI-CYBMUJFWSA-N 1 1 241.737 3.621 20 0 BHADMO CCC[N@H+]1CC[C@@](F)(c2cccc(Cl)c2)C1 ZINC000558745046 384271082 /nfs/dbraw/zinc/27/10/82/384271082.db2.gz XSXRVFONWQLGTI-ZDUSSCGKSA-N 1 1 241.737 3.621 20 0 BHADMO CCC[N@@H+]1CC[C@@](F)(c2cccc(Cl)c2)C1 ZINC000558745046 384271076 /nfs/dbraw/zinc/27/10/76/384271076.db2.gz XSXRVFONWQLGTI-ZDUSSCGKSA-N 1 1 241.737 3.621 20 0 BHADMO CC1=C(C)C[N@@H+](Cc2sccc2Cl)CC1 ZINC000558830833 398216837 /nfs/dbraw/zinc/21/68/37/398216837.db2.gz FYZRBHAYBAKWEO-UHFFFAOYSA-N 1 1 241.787 3.944 20 0 BHADMO CO[C@H](C[N@H+]1CCCCC[C@H]1C)c1ccccc1 ZINC000558832119 384320975 /nfs/dbraw/zinc/32/09/75/384320975.db2.gz ZDIXPVHHJZWTQK-GDBMZVCRSA-N 1 1 247.382 3.639 20 0 BHADMO CO[C@H](C[N@H+]1CCCCC[C@@H]1C)c1ccccc1 ZINC000558832122 384320955 /nfs/dbraw/zinc/32/09/55/384320955.db2.gz ZDIXPVHHJZWTQK-GOEBONIOSA-N 1 1 247.382 3.639 20 0 BHADMO CO[C@@H](C[N@H+]1CCCCC[C@@H]1C)c1ccccc1 ZINC000558832123 384320964 /nfs/dbraw/zinc/32/09/64/384320964.db2.gz ZDIXPVHHJZWTQK-HOCLYGCPSA-N 1 1 247.382 3.639 20 0 BHADMO CO[C@@H](C[N@H+]1CCCCC[C@H]1C)c1ccccc1 ZINC000558832126 384321078 /nfs/dbraw/zinc/32/10/78/384321078.db2.gz ZDIXPVHHJZWTQK-ZBFHGGJFSA-N 1 1 247.382 3.639 20 0 BHADMO Clc1ccsc1C[N@H+]1CC[C@H](C2CC2)C1 ZINC000558851089 631268199 /nfs/dbraw/zinc/26/81/99/631268199.db2.gz PSARVIHOIGEMSS-JTQLQIEISA-N 1 1 241.787 3.633 20 0 BHADMO Clc1ccsc1C[N@H+]1CC[C@@H](C2CC2)C1 ZINC000558851090 631268047 /nfs/dbraw/zinc/26/80/47/631268047.db2.gz PSARVIHOIGEMSS-SNVBAGLBSA-N 1 1 241.787 3.633 20 0 BHADMO CCCC[C@@H](CC)C[N@H+]1CC[C@H](OC(F)F)C1 ZINC000558864775 384345021 /nfs/dbraw/zinc/34/50/21/384345021.db2.gz BDHSVEHSEQKICC-NEPJUHHUSA-N 1 1 249.345 3.516 20 0 BHADMO CCCC[C@H](CC)C[N@H+]1CC[C@H](OC(F)F)C1 ZINC000558864777 384344950 /nfs/dbraw/zinc/34/49/50/384344950.db2.gz BDHSVEHSEQKICC-RYUDHWBXSA-N 1 1 249.345 3.516 20 0 BHADMO C[N@@H+](Cc1cccc(F)c1Cl)C1CCCC1 ZINC000559037789 384494425 /nfs/dbraw/zinc/49/44/25/384494425.db2.gz WPNFRSMIPBDURE-UHFFFAOYSA-N 1 1 241.737 3.854 20 0 BHADMO CCc1nc(C(C)C)ccc1C[N@@H+](C)CC(C)C ZINC000559049092 384500679 /nfs/dbraw/zinc/50/06/79/384500679.db2.gz FKAHBBMLDVWUIR-UHFFFAOYSA-N 1 1 248.414 3.855 20 0 BHADMO CCC[N@@H+](CC)Cc1cccc(F)c1Cl ZINC000559049196 384503023 /nfs/dbraw/zinc/50/30/23/384503023.db2.gz HNIPTLMLQYIQQB-UHFFFAOYSA-N 1 1 229.726 3.711 20 0 BHADMO CC[N@@H+](CCC1(OC)CCC1)C1CCCCC1 ZINC000559049345 384503222 /nfs/dbraw/zinc/50/32/22/384503222.db2.gz LQGWAJHNCXFWQY-UHFFFAOYSA-N 1 1 239.403 3.600 20 0 BHADMO COc1ccc(C[N@@H+](C)[C@H]2CC[C@@H](C)C2)cc1C ZINC000559071237 384513645 /nfs/dbraw/zinc/51/36/45/384513645.db2.gz MSOJRONZWNYWJG-DOMZBBRYSA-N 1 1 247.382 3.624 20 0 BHADMO COc1ccc(C[N@@H+](C)[C@@H]2CC[C@@H](C)C2)cc1C ZINC000559071241 384514773 /nfs/dbraw/zinc/51/47/73/384514773.db2.gz MSOJRONZWNYWJG-IUODEOHRSA-N 1 1 247.382 3.624 20 0 BHADMO COc1ccc(C[N@@H+](C)[C@@H]2CC[C@H](C)C2)cc1C ZINC000559071242 384513119 /nfs/dbraw/zinc/51/31/19/384513119.db2.gz MSOJRONZWNYWJG-SWLSCSKDSA-N 1 1 247.382 3.624 20 0 BHADMO COc1ccc(C[N@@H+](C)[C@H]2CC[C@H](C)C2)cc1C ZINC000559071243 384513499 /nfs/dbraw/zinc/51/34/99/384513499.db2.gz MSOJRONZWNYWJG-WFASDCNBSA-N 1 1 247.382 3.624 20 0 BHADMO CC1=C(c2ccco2)C[N@@H+](CC2(C)CC2)CC1 ZINC000559072274 398264073 /nfs/dbraw/zinc/26/40/73/398264073.db2.gz ATLYLMMHBVZSPC-UHFFFAOYSA-N 1 1 231.339 3.559 20 0 BHADMO CC1=C(c2ccco2)C[N@@H+](CC(C)(C)C)CC1 ZINC000559072608 398263840 /nfs/dbraw/zinc/26/38/40/398263840.db2.gz HMYGCXVJOMOGRT-UHFFFAOYSA-N 1 1 233.355 3.805 20 0 BHADMO C[C@H](C1CCCCC1)[N@@H+](C)Cc1cncs1 ZINC000559072801 398264139 /nfs/dbraw/zinc/26/41/39/398264139.db2.gz LTSALYLNRABYDP-LLVKDONJSA-N 1 1 238.400 3.544 20 0 BHADMO CC1(C[N@@H+](Cc2ccc(F)cc2)C2CC2)CC1 ZINC000559085724 384525767 /nfs/dbraw/zinc/52/57/67/384525767.db2.gz FYTVWOZQBCFYQQ-UHFFFAOYSA-N 1 1 233.330 3.590 20 0 BHADMO CC[C@@H](C)C[N@@H+](C)Cc1ccc(C(C)C)nc1C ZINC000559094902 384535272 /nfs/dbraw/zinc/53/52/72/384535272.db2.gz QGNLMHPTMHUZJW-CYBMUJFWSA-N 1 1 248.414 3.991 20 0 BHADMO CC[C@H](C)C[N@@H+](C)Cc1ccc(C(C)C)nc1C ZINC000559094903 384533340 /nfs/dbraw/zinc/53/33/40/384533340.db2.gz QGNLMHPTMHUZJW-ZDUSSCGKSA-N 1 1 248.414 3.991 20 0 BHADMO CC(C)OCCC[N@@H+](C)[C@H]1C=CCCCCC1 ZINC000559106587 344127660 /nfs/dbraw/zinc/12/76/60/344127660.db2.gz ZPTHSXZQARBELR-HNNXBMFYSA-N 1 1 239.403 3.622 20 0 BHADMO CC(C)OCCC[N@@H+](C)[C@@H]1C=CCCCCC1 ZINC000559106588 344127979 /nfs/dbraw/zinc/12/79/79/344127979.db2.gz ZPTHSXZQARBELR-OAHLLOKOSA-N 1 1 239.403 3.622 20 0 BHADMO CC[C@H]1CC[N@H+]([C@H]2C=CCCCCC2)C1 ZINC000559107326 384557630 /nfs/dbraw/zinc/55/76/30/384557630.db2.gz JSRKHSOMEXDQCT-KBPBESRZSA-N 1 1 207.361 3.607 20 0 BHADMO CC[C@@H]1CC[N@H+]([C@H]2C=CCCCCC2)C1 ZINC000559107328 384559038 /nfs/dbraw/zinc/55/90/38/384559038.db2.gz JSRKHSOMEXDQCT-KGLIPLIRSA-N 1 1 207.361 3.607 20 0 BHADMO CC[C@H]1CC[N@H+]([C@@H]2C=CCCCCC2)C1 ZINC000559107329 384559117 /nfs/dbraw/zinc/55/91/17/384559117.db2.gz JSRKHSOMEXDQCT-UONOGXRCSA-N 1 1 207.361 3.607 20 0 BHADMO CC[C@@H]1CC[N@H+]([C@@H]2C=CCCCCC2)C1 ZINC000559107330 384557688 /nfs/dbraw/zinc/55/76/88/384557688.db2.gz JSRKHSOMEXDQCT-ZIAGYGMSSA-N 1 1 207.361 3.607 20 0 BHADMO C1=C[C@H]([N@H+]2CCC3(CCC3)C2)CCCCC1 ZINC000559107348 384556956 /nfs/dbraw/zinc/55/69/56/384556956.db2.gz KNJHFERDWOXOPG-AWEZNQCLSA-N 1 1 219.372 3.751 20 0 BHADMO C1=C[C@@H]([N@H+]2CCC3(CCC3)C2)CCCCC1 ZINC000559107356 384559076 /nfs/dbraw/zinc/55/90/76/384559076.db2.gz KNJHFERDWOXOPG-CQSZACIVSA-N 1 1 219.372 3.751 20 0 BHADMO CC1(C[N@H+]2CCC[C@@]3(CC=CCC3)C2)CC1 ZINC000559108901 384559256 /nfs/dbraw/zinc/55/92/56/384559256.db2.gz RGVRTMIPOHKODS-HNNXBMFYSA-N 1 1 219.372 3.609 20 0 BHADMO CC1(C[N@H+]2CCC[C@]3(CC=CCC3)C2)CC1 ZINC000559108903 384556207 /nfs/dbraw/zinc/55/62/07/384556207.db2.gz RGVRTMIPOHKODS-OAHLLOKOSA-N 1 1 219.372 3.609 20 0 BHADMO CC[C@@H](C)[N@@H+](C)Cc1cccc(F)c1Cl ZINC000559144689 384603467 /nfs/dbraw/zinc/60/34/67/384603467.db2.gz SRJCJPRWQCJRFX-SECBINFHSA-N 1 1 229.726 3.709 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1cccc(F)c1Cl ZINC000559144690 384604567 /nfs/dbraw/zinc/60/45/67/384604567.db2.gz SRJCJPRWQCJRFX-VIFPVBQESA-N 1 1 229.726 3.709 20 0 BHADMO c1cc2c(s1)C[N@@H+]([C@H]1C=CCCCCC1)CC2 ZINC000559145679 384603827 /nfs/dbraw/zinc/60/38/27/384603827.db2.gz PLXFCHFFMPMUDC-AWEZNQCLSA-N 1 1 247.407 3.995 20 0 BHADMO c1cc2c(s1)C[N@@H+]([C@@H]1C=CCCCCC1)CC2 ZINC000559145682 384605293 /nfs/dbraw/zinc/60/52/93/384605293.db2.gz PLXFCHFFMPMUDC-CQSZACIVSA-N 1 1 247.407 3.995 20 0 BHADMO CCC[C@H]1CCCC[N@H+]1CCC1(OC)CCC1 ZINC000559149518 384606566 /nfs/dbraw/zinc/60/65/66/384606566.db2.gz HATBDTLJWMHRIB-AWEZNQCLSA-N 1 1 239.403 3.600 20 0 BHADMO CCC[C@@H]1CCCC[N@H+]1CCC1(OC)CCC1 ZINC000559149519 384606953 /nfs/dbraw/zinc/60/69/53/384606953.db2.gz HATBDTLJWMHRIB-CQSZACIVSA-N 1 1 239.403 3.600 20 0 BHADMO CCOc1ccccc1C[N@@H+](CC)C1CCCC1 ZINC000559152074 398266562 /nfs/dbraw/zinc/26/65/62/398266562.db2.gz XQHDBSLQSZLCFC-UHFFFAOYSA-N 1 1 247.382 3.850 20 0 BHADMO CCCC[C@@H](C)[N@@H+](C)Cc1ccc(CC)cn1 ZINC000559247909 384866907 /nfs/dbraw/zinc/86/69/07/384866907.db2.gz NGGDPJUVMLGNED-CYBMUJFWSA-N 1 1 234.387 3.655 20 0 BHADMO CCCC[C@H](C)[N@@H+](C)Cc1ccc(CC)cn1 ZINC000559247911 384867399 /nfs/dbraw/zinc/86/73/99/384867399.db2.gz NGGDPJUVMLGNED-ZDUSSCGKSA-N 1 1 234.387 3.655 20 0 BHADMO c1cc2c(o1)CCC[N@H+]([C@H]1C=CCCCCC1)C2 ZINC000559247948 384866331 /nfs/dbraw/zinc/86/63/31/384866331.db2.gz JLFOZBRCPQJUMR-HNNXBMFYSA-N 1 1 245.366 3.917 20 0 BHADMO c1cc2c(o1)CCC[N@H+]([C@@H]1C=CCCCCC1)C2 ZINC000559247949 384866992 /nfs/dbraw/zinc/86/69/92/384866992.db2.gz JLFOZBRCPQJUMR-OAHLLOKOSA-N 1 1 245.366 3.917 20 0 BHADMO CCCC[C@H](C)[N@@H+](C)Cc1ccc(COC)cc1 ZINC000559248258 384868522 /nfs/dbraw/zinc/86/85/22/384868522.db2.gz QHULFDVTXVIWGH-AWEZNQCLSA-N 1 1 249.398 3.844 20 0 BHADMO CCCC[C@@H](C)[N@@H+](C)Cc1ccc(COC)cc1 ZINC000559248260 384869485 /nfs/dbraw/zinc/86/94/85/384869485.db2.gz QHULFDVTXVIWGH-CQSZACIVSA-N 1 1 249.398 3.844 20 0 BHADMO Cc1ccoc1C[N@H+](C)[C@H]1C=CCCCCC1 ZINC000559248673 384875571 /nfs/dbraw/zinc/87/55/71/384875571.db2.gz XZJLSHXEDQXYJK-AWEZNQCLSA-N 1 1 233.355 3.909 20 0 BHADMO Cc1ccoc1C[N@H+](C)[C@@H]1C=CCCCCC1 ZINC000559248674 384880748 /nfs/dbraw/zinc/88/07/48/384880748.db2.gz XZJLSHXEDQXYJK-CQSZACIVSA-N 1 1 233.355 3.909 20 0 BHADMO Fc1ccccc1[C@H]1CC[N@H+]([C@H]2C=CCCC2)C1 ZINC000559302336 385008573 /nfs/dbraw/zinc/00/85/73/385008573.db2.gz JVDDWRYZYUJNDP-KBPBESRZSA-N 1 1 245.341 3.724 20 0 BHADMO Fc1ccccc1[C@@H]1CC[N@H+]([C@H]2C=CCCC2)C1 ZINC000559302369 385008335 /nfs/dbraw/zinc/00/83/35/385008335.db2.gz JVDDWRYZYUJNDP-KGLIPLIRSA-N 1 1 245.341 3.724 20 0 BHADMO Fc1ccccc1[C@H]1CC[N@H+]([C@@H]2C=CCCC2)C1 ZINC000559302371 385005876 /nfs/dbraw/zinc/00/58/76/385005876.db2.gz JVDDWRYZYUJNDP-UONOGXRCSA-N 1 1 245.341 3.724 20 0 BHADMO Fc1ccccc1[C@@H]1CC[N@H+]([C@@H]2C=CCCC2)C1 ZINC000559302372 385006959 /nfs/dbraw/zinc/00/69/59/385006959.db2.gz JVDDWRYZYUJNDP-ZIAGYGMSSA-N 1 1 245.341 3.724 20 0 BHADMO C[C@@H]1C[N@@H+](C/C=C\c2ccc(Cl)cc2)[C@H]1C ZINC000559349957 383898575 /nfs/dbraw/zinc/89/85/75/383898575.db2.gz VYYZRVOZFVIOJJ-BKGLOODYSA-N 1 1 235.758 3.693 20 0 BHADMO C[C@@H]1C[N@@H+](C/C=C/c2ccc(Cl)cc2)[C@@H]1C ZINC000559349958 383898691 /nfs/dbraw/zinc/89/86/91/383898691.db2.gz VYYZRVOZFVIOJJ-BLDJZWNYSA-N 1 1 235.758 3.693 20 0 BHADMO C[C@@H]1C[N@@H+](C/C=C/c2ccc(Cl)cc2)[C@H]1C ZINC000559349959 383899868 /nfs/dbraw/zinc/89/98/68/383899868.db2.gz VYYZRVOZFVIOJJ-LXYZTQFVSA-N 1 1 235.758 3.693 20 0 BHADMO C[C@@H]1C[N@@H+](C/C=C\c2ccc(Cl)cc2)[C@@H]1C ZINC000559349960 383899949 /nfs/dbraw/zinc/89/99/49/383899949.db2.gz VYYZRVOZFVIOJJ-OPVGQWETSA-N 1 1 235.758 3.693 20 0 BHADMO C[C@H](c1ccccc1Cl)[N@H+]1C[C@@H](C)[C@H]1C ZINC000559350515 383919332 /nfs/dbraw/zinc/91/93/32/383919332.db2.gz NDNBNEBIKSSQKM-GMTAPVOTSA-N 1 1 223.747 3.741 20 0 BHADMO C[C@@H](c1ccccc1Cl)[N@H+]1C[C@@H](C)[C@H]1C ZINC000559350519 383918700 /nfs/dbraw/zinc/91/87/00/383918700.db2.gz NDNBNEBIKSSQKM-MXWKQRLJSA-N 1 1 223.747 3.741 20 0 BHADMO C[C@H](c1ccccc1Cl)[N@H+]1C[C@@H](C)[C@@H]1C ZINC000559350520 383918260 /nfs/dbraw/zinc/91/82/60/383918260.db2.gz NDNBNEBIKSSQKM-OUAUKWLOSA-N 1 1 223.747 3.741 20 0 BHADMO C[C@@H](c1ccccc1Cl)[N@H+]1C[C@@H](C)[C@@H]1C ZINC000559350521 383919137 /nfs/dbraw/zinc/91/91/37/383919137.db2.gz NDNBNEBIKSSQKM-VWYCJHECSA-N 1 1 223.747 3.741 20 0 BHADMO C[C@@H]1C[N@@H+](Cc2cccc(C(F)(F)F)c2)[C@@H]1C ZINC000559352708 384042927 /nfs/dbraw/zinc/04/29/27/384042927.db2.gz IDFAVRIOWAYBCC-NXEZZACHSA-N 1 1 243.272 3.546 20 0 BHADMO C[C@H]1C[N@@H+](Cc2cccc(C(F)(F)F)c2)[C@H]1C ZINC000559352709 384042252 /nfs/dbraw/zinc/04/22/52/384042252.db2.gz IDFAVRIOWAYBCC-UWVGGRQHSA-N 1 1 243.272 3.546 20 0 BHADMO C[C@@H]1[C@@H](C)C[N@H+]1Cc1cccc(C(F)(F)F)c1 ZINC000559352710 384042811 /nfs/dbraw/zinc/04/28/11/384042811.db2.gz IDFAVRIOWAYBCC-VHSXEESVSA-N 1 1 243.272 3.546 20 0 BHADMO C[C@@H]1C[N@@H+](Cc2cccc(C(F)(F)F)c2)[C@H]1C ZINC000559352711 384042552 /nfs/dbraw/zinc/04/25/52/384042552.db2.gz IDFAVRIOWAYBCC-ZJUUUORDSA-N 1 1 243.272 3.546 20 0 BHADMO CCc1nocc1C[N@@H+](C)[C@H]1C=CCCCCC1 ZINC000559371416 384222643 /nfs/dbraw/zinc/22/26/43/384222643.db2.gz QFAOKDPVYGKSHZ-AWEZNQCLSA-N 1 1 248.370 3.558 20 0 BHADMO CCc1nocc1C[N@@H+](C)[C@@H]1C=CCCCCC1 ZINC000559371421 384223423 /nfs/dbraw/zinc/22/34/23/384223423.db2.gz QFAOKDPVYGKSHZ-CQSZACIVSA-N 1 1 248.370 3.558 20 0 BHADMO C[N@@H+](C[C@H]1CCC2(CCCCC2)O1)C(C)(C)C ZINC000559374681 384240175 /nfs/dbraw/zinc/24/01/75/384240175.db2.gz NNKKAGGCTUABGZ-CYBMUJFWSA-N 1 1 239.403 3.599 20 0 BHADMO C[N@@H+](C[C@@H]1CCC2(CCCCC2)O1)C(C)(C)C ZINC000559374682 384240208 /nfs/dbraw/zinc/24/02/08/384240208.db2.gz NNKKAGGCTUABGZ-ZDUSSCGKSA-N 1 1 239.403 3.599 20 0 BHADMO CCCC[C@@H](C)[N@@H+](CCCC)Cc1ccon1 ZINC000559385599 384269019 /nfs/dbraw/zinc/26/90/19/384269019.db2.gz BQRIFOQOEBNWKV-CYBMUJFWSA-N 1 1 238.375 3.855 20 0 BHADMO CCCC[C@H](C)[N@@H+](CCCC)Cc1ccon1 ZINC000559385602 384270049 /nfs/dbraw/zinc/27/00/49/384270049.db2.gz BQRIFOQOEBNWKV-ZDUSSCGKSA-N 1 1 238.375 3.855 20 0 BHADMO CCCC[C@H](C)[N@@H+](CCCC)CCC1(O)CC1 ZINC000559388958 384511816 /nfs/dbraw/zinc/51/18/16/384511816.db2.gz WRKLPWXUBIKSQS-AWEZNQCLSA-N 1 1 241.419 3.582 20 0 BHADMO CCCC[C@@H](C)[N@@H+](CCCC)CCC1(O)CC1 ZINC000559388960 384511662 /nfs/dbraw/zinc/51/16/62/384511662.db2.gz WRKLPWXUBIKSQS-CQSZACIVSA-N 1 1 241.419 3.582 20 0 BHADMO FC[C@@H]1CCC[N@H+]1Cc1ccc(C2CCC2)cc1 ZINC000559410410 384899040 /nfs/dbraw/zinc/89/90/40/384899040.db2.gz CHLDIYDGIHABJL-INIZCTEOSA-N 1 1 247.357 3.888 20 0 BHADMO FC[C@H]1CCC[N@H+]1Cc1ccc(C2CCC2)cc1 ZINC000559410412 384899098 /nfs/dbraw/zinc/89/90/98/384899098.db2.gz CHLDIYDGIHABJL-MRXNPFEDSA-N 1 1 247.357 3.888 20 0 BHADMO CC(C)c1ccc(C[N@H+]2CCC[C@H]2CF)cc1 ZINC000559411850 384901325 /nfs/dbraw/zinc/90/13/25/384901325.db2.gz YWGBRKJWPBWTTA-HNNXBMFYSA-N 1 1 235.346 3.744 20 0 BHADMO CC(C)c1ccc(C[N@H+]2CCC[C@@H]2CF)cc1 ZINC000559411852 384900866 /nfs/dbraw/zinc/90/08/66/384900866.db2.gz YWGBRKJWPBWTTA-OAHLLOKOSA-N 1 1 235.346 3.744 20 0 BHADMO CCCC[N@@H+](CCC[C@H](C)O)C1CCCCC1 ZINC000559479708 384955116 /nfs/dbraw/zinc/95/51/16/384955116.db2.gz MMGPGUIAPALZQT-AWEZNQCLSA-N 1 1 241.419 3.582 20 0 BHADMO CCCC[N@@H+](CCC[C@@H](C)O)C1CCCCC1 ZINC000559479709 344480285 /nfs/dbraw/zinc/48/02/85/344480285.db2.gz MMGPGUIAPALZQT-CQSZACIVSA-N 1 1 241.419 3.582 20 0 BHADMO CC(C)[C@@H]1C[N@@H+](CCCC(C)(C)C)CCCO1 ZINC000559496604 384970950 /nfs/dbraw/zinc/97/09/50/384970950.db2.gz DNBYEDMNUDSDNU-AWEZNQCLSA-N 1 1 241.419 3.560 20 0 BHADMO CC(C)[C@H]1C[N@@H+](CCCC(C)(C)C)CCCO1 ZINC000559496606 384969951 /nfs/dbraw/zinc/96/99/51/384969951.db2.gz DNBYEDMNUDSDNU-CQSZACIVSA-N 1 1 241.419 3.560 20 0 BHADMO CCc1cnc(C[N@H+]2CCCC23CCCCC3)o1 ZINC000559753499 385154480 /nfs/dbraw/zinc/15/44/80/385154480.db2.gz JJKMDDJFXQWHCG-UHFFFAOYSA-N 1 1 248.370 3.536 20 0 BHADMO CC[N@@H+](Cc1ccccn1)[C@H]1C=CCCCCC1 ZINC000559793805 385177822 /nfs/dbraw/zinc/17/78/22/385177822.db2.gz PNLOGFACZFVCBZ-INIZCTEOSA-N 1 1 244.382 3.792 20 0 BHADMO CC[N@@H+](Cc1ccccn1)[C@@H]1C=CCCCCC1 ZINC000559793806 385176464 /nfs/dbraw/zinc/17/64/64/385176464.db2.gz PNLOGFACZFVCBZ-MRXNPFEDSA-N 1 1 244.382 3.792 20 0 BHADMO CC(F)(F)C[NH2+][C@H](CC1CC1)c1ccccc1 ZINC000559878119 385211833 /nfs/dbraw/zinc/21/18/33/385211833.db2.gz JZCYMNAYXWFQHU-CYBMUJFWSA-N 1 1 239.309 3.773 20 0 BHADMO CC(F)(F)C[NH2+][C@@H](CC1CC1)c1ccccc1 ZINC000559878145 385210860 /nfs/dbraw/zinc/21/08/60/385210860.db2.gz JZCYMNAYXWFQHU-ZDUSSCGKSA-N 1 1 239.309 3.773 20 0 BHADMO C[C@@H]([NH2+][C@@H]1CCC[C@@H]1F)c1cccc(F)c1F ZINC000559918058 322981063 /nfs/dbraw/zinc/98/10/63/322981063.db2.gz QLVDTFVWMHRJJK-UBHAPETDSA-N 1 1 243.272 3.506 20 0 BHADMO C[N@H+]1CCCC[C@H]1CCSCc1ccccc1 ZINC000559946524 385248962 /nfs/dbraw/zinc/24/89/62/385248962.db2.gz DNJPNNJYGDDVCG-HNNXBMFYSA-N 1 1 249.423 3.794 20 0 BHADMO C[N@H+]1CCCC[C@@H]1CCSCc1ccccc1 ZINC000559946529 385249990 /nfs/dbraw/zinc/24/99/90/385249990.db2.gz DNJPNNJYGDDVCG-OAHLLOKOSA-N 1 1 249.423 3.794 20 0 BHADMO CC(C)C[N@@H+](C)[C@@H](C)c1ccc(F)cc1F ZINC000559978889 385273052 /nfs/dbraw/zinc/27/30/52/385273052.db2.gz IAEPKTOOIHVOBZ-JTQLQIEISA-N 1 1 227.298 3.614 20 0 BHADMO CC(C)C[N@@H+](C)[C@H](C)c1ccc(F)cc1F ZINC000559978890 385274550 /nfs/dbraw/zinc/27/45/50/385274550.db2.gz IAEPKTOOIHVOBZ-SNVBAGLBSA-N 1 1 227.298 3.614 20 0 BHADMO CCC(CC)SCC[C@H]1CCCC[N@H+]1C ZINC000559981908 385275894 /nfs/dbraw/zinc/27/58/94/385275894.db2.gz GVPPQBYDEJLFJM-GFCCVEGCSA-N 1 1 229.433 3.783 20 0 BHADMO CCC(CC)SCC[C@@H]1CCCC[N@H+]1C ZINC000559981911 385276909 /nfs/dbraw/zinc/27/69/09/385276909.db2.gz GVPPQBYDEJLFJM-LBPRGKRZSA-N 1 1 229.433 3.783 20 0 BHADMO CC(C)=CCSCC[C@H]1CCCC[N@@H+]1C ZINC000560002172 383838311 /nfs/dbraw/zinc/83/83/11/383838311.db2.gz LXVDGAHMJSVTHX-CYBMUJFWSA-N 1 1 227.417 3.560 20 0 BHADMO CC(C)=CCSCC[C@@H]1CCCC[N@@H+]1C ZINC000560002173 383838152 /nfs/dbraw/zinc/83/81/52/383838152.db2.gz LXVDGAHMJSVTHX-ZDUSSCGKSA-N 1 1 227.417 3.560 20 0 BHADMO C[N@H+]1CCCC[C@@H]1CCSCC(C)(C)C ZINC000560002458 383836892 /nfs/dbraw/zinc/83/68/92/383836892.db2.gz WICXRBXGQUOMIA-GFCCVEGCSA-N 1 1 229.433 3.640 20 0 BHADMO C[N@H+]1CCCC[C@H]1CCSCC(C)(C)C ZINC000560002460 383835945 /nfs/dbraw/zinc/83/59/45/383835945.db2.gz WICXRBXGQUOMIA-LBPRGKRZSA-N 1 1 229.433 3.640 20 0 BHADMO CCCCC[N@@H+](Cc1ccncc1C)C(C)C ZINC000560103395 383899953 /nfs/dbraw/zinc/89/99/53/383899953.db2.gz OOWULZWZSNTHOB-UHFFFAOYSA-N 1 1 234.387 3.791 20 0 BHADMO C[N@@H+](CCCCCF)Cc1ccc(Cl)s1 ZINC000560156781 383934201 /nfs/dbraw/zinc/93/42/01/383934201.db2.gz AYUPRKLZOSCWQE-UHFFFAOYSA-N 1 1 249.782 3.973 20 0 BHADMO FCCCCC[N@H+]1CCC[C@H]1c1ccccc1 ZINC000560156890 383934611 /nfs/dbraw/zinc/93/46/11/383934611.db2.gz GGFLCONVVDGVLF-HNNXBMFYSA-N 1 1 235.346 3.963 20 0 BHADMO FCCCCC[N@H+]1CCC[C@@H]1c1ccccc1 ZINC000560156891 383933990 /nfs/dbraw/zinc/93/39/90/383933990.db2.gz GGFLCONVVDGVLF-OAHLLOKOSA-N 1 1 235.346 3.963 20 0 BHADMO CC(C)[N@@H+](CCCCCF)C1CCCC1 ZINC000560158876 383937681 /nfs/dbraw/zinc/93/76/81/383937681.db2.gz FFCWZMWULSDURC-UHFFFAOYSA-N 1 1 215.356 3.779 20 0 BHADMO FCCCCC[N@H+]1CCC[C@@]2(CC=CCC2)C1 ZINC000560159128 383936526 /nfs/dbraw/zinc/93/65/26/383936526.db2.gz JMRLTDLULMVGBG-HNNXBMFYSA-N 1 1 239.378 3.949 20 0 BHADMO FCCCCC[N@H+]1CCC[C@]2(CC=CCC2)C1 ZINC000560159134 383938835 /nfs/dbraw/zinc/93/88/35/383938835.db2.gz JMRLTDLULMVGBG-OAHLLOKOSA-N 1 1 239.378 3.949 20 0 BHADMO C[C@@H](C[N@@H+](C)CCCCCF)c1ccccc1 ZINC000560159368 383933910 /nfs/dbraw/zinc/93/39/10/383933910.db2.gz JQNSVLGYRIYNIV-AWEZNQCLSA-N 1 1 237.362 3.862 20 0 BHADMO C[C@H](C[N@@H+](C)CCCCCF)c1ccccc1 ZINC000560159369 383934792 /nfs/dbraw/zinc/93/47/92/383934792.db2.gz JQNSVLGYRIYNIV-CQSZACIVSA-N 1 1 237.362 3.862 20 0 BHADMO FCCCCC[N@H+]1CCC2(C1)CCCCC2 ZINC000560159806 383948226 /nfs/dbraw/zinc/94/82/26/383948226.db2.gz PXIYPQGOVFNBJD-UHFFFAOYSA-N 1 1 227.367 3.782 20 0 BHADMO C[C@@H]1C[C@@H]2CCCC[C@H]2[N@H+]1CCCCCF ZINC000560159810 383949151 /nfs/dbraw/zinc/94/91/51/383949151.db2.gz SMYHSFUPTPCMPB-HZSPNIEDSA-N 1 1 227.367 3.779 20 0 BHADMO C[C@@H]1C[C@H]2CCCC[C@@H]2[N@H+]1CCCCCF ZINC000560159812 383949932 /nfs/dbraw/zinc/94/99/32/383949932.db2.gz SMYHSFUPTPCMPB-MCIONIFRSA-N 1 1 227.367 3.779 20 0 BHADMO C[C@@H]1C[C@H]2CCCC[C@H]2[N@H+]1CCCCCF ZINC000560159814 383948062 /nfs/dbraw/zinc/94/80/62/383948062.db2.gz SMYHSFUPTPCMPB-MGPQQGTHSA-N 1 1 227.367 3.779 20 0 BHADMO C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@H+]1CCCCCF ZINC000560159815 383950180 /nfs/dbraw/zinc/95/01/80/383950180.db2.gz SMYHSFUPTPCMPB-RDBSUJKOSA-N 1 1 227.367 3.779 20 0 BHADMO Cc1ccccc1[C@H]1CC[N@@H+](CCCCCF)C1 ZINC000560159845 383948781 /nfs/dbraw/zinc/94/87/81/383948781.db2.gz UPDDXQYBGLBJBF-HNNXBMFYSA-N 1 1 249.373 3.924 20 0 BHADMO Cc1ccccc1[C@@H]1CC[N@@H+](CCCCCF)C1 ZINC000560159847 383949899 /nfs/dbraw/zinc/94/98/99/383949899.db2.gz UPDDXQYBGLBJBF-OAHLLOKOSA-N 1 1 249.373 3.924 20 0 BHADMO CC(C)C[C@H]1CCC[N@H+]1CCCCCF ZINC000560160288 383947592 /nfs/dbraw/zinc/94/75/92/383947592.db2.gz ZEGGYDRIEKJYNL-CYBMUJFWSA-N 1 1 215.356 3.637 20 0 BHADMO CC(C)C[C@@H]1CCC[N@H+]1CCCCCF ZINC000560160290 383949446 /nfs/dbraw/zinc/94/94/46/383949446.db2.gz ZEGGYDRIEKJYNL-ZDUSSCGKSA-N 1 1 215.356 3.637 20 0 BHADMO C[C@@H]1C[N@@H+](CCCCCF)[C@@H]2CCCC[C@H]21 ZINC000560162648 383944005 /nfs/dbraw/zinc/94/40/05/383944005.db2.gz VGTSVILWFOFMPH-HZSPNIEDSA-N 1 1 227.367 3.637 20 0 BHADMO C[C@@H]1C[N@@H+](CCCCCF)[C@H]2CCCC[C@H]12 ZINC000560162649 383944436 /nfs/dbraw/zinc/94/44/36/383944436.db2.gz VGTSVILWFOFMPH-MCIONIFRSA-N 1 1 227.367 3.637 20 0 BHADMO C[C@@H]1C[N@@H+](CCCCCF)[C@@H]2CCCC[C@@H]21 ZINC000560162650 383945673 /nfs/dbraw/zinc/94/56/73/383945673.db2.gz VGTSVILWFOFMPH-MGPQQGTHSA-N 1 1 227.367 3.637 20 0 BHADMO C[C@@H]1C[N@@H+](CCCCCF)[C@H]2CCCC[C@@H]12 ZINC000560162651 383943866 /nfs/dbraw/zinc/94/38/66/383943866.db2.gz VGTSVILWFOFMPH-RDBSUJKOSA-N 1 1 227.367 3.637 20 0 BHADMO Cc1ccc([C@H]2CC[N@@H+](CCCCCF)C2)cc1 ZINC000560165607 383948193 /nfs/dbraw/zinc/94/81/93/383948193.db2.gz GAMGPVXWBVFRQC-INIZCTEOSA-N 1 1 249.373 3.924 20 0 BHADMO Cc1ccc([C@@H]2CC[N@@H+](CCCCCF)C2)cc1 ZINC000560165608 383948929 /nfs/dbraw/zinc/94/89/29/383948929.db2.gz GAMGPVXWBVFRQC-MRXNPFEDSA-N 1 1 249.373 3.924 20 0 BHADMO CC[N@@H+](CCCc1ccsc1)C1CCCC1 ZINC000560168700 383948667 /nfs/dbraw/zinc/94/86/67/383948667.db2.gz SYKJZTBNAXUUSK-UHFFFAOYSA-N 1 1 237.412 3.945 20 0 BHADMO c1ccc(C2=CCC[N@H+]([C@H]3C=CCCC3)C2)cc1 ZINC000560168829 383947886 /nfs/dbraw/zinc/94/78/86/383947886.db2.gz FWOYLQIKJQLIHE-KRWDZBQOSA-N 1 1 239.362 3.884 20 0 BHADMO c1ccc(C2=CCC[N@H+]([C@@H]3C=CCCC3)C2)cc1 ZINC000560168830 383948109 /nfs/dbraw/zinc/94/81/09/383948109.db2.gz FWOYLQIKJQLIHE-QGZVFWFLSA-N 1 1 239.362 3.884 20 0 BHADMO CC[N@@H+](Cc1cc(F)cc(F)c1)C1CCCC1 ZINC000560169305 383952049 /nfs/dbraw/zinc/95/20/49/383952049.db2.gz ROXPRVYXBMUUKO-UHFFFAOYSA-N 1 1 239.309 3.729 20 0 BHADMO COCC[N@@H+](CC(C)C)[C@@H](C)c1ccccc1C ZINC000560185144 383953989 /nfs/dbraw/zinc/95/39/89/383953989.db2.gz PYOKJDINGWXHNC-HNNXBMFYSA-N 1 1 249.398 3.660 20 0 BHADMO COCC[N@@H+](CC(C)C)[C@H](C)c1ccccc1C ZINC000560185145 383953697 /nfs/dbraw/zinc/95/36/97/383953697.db2.gz PYOKJDINGWXHNC-OAHLLOKOSA-N 1 1 249.398 3.660 20 0 BHADMO CCC(=O)CCC[N@H+](CC)Cc1ccc(C)cc1 ZINC000560186380 383958900 /nfs/dbraw/zinc/95/89/00/383958900.db2.gz CCNAEBZRLBNDNL-UHFFFAOYSA-N 1 1 247.382 3.576 20 0 BHADMO C[C@@H]1CCCC[C@H]1[N@@H+](C)CCCCCF ZINC000560196884 383967664 /nfs/dbraw/zinc/96/76/64/383967664.db2.gz ONLDYKUZZGBIHI-CHWSQXEVSA-N 1 1 215.356 3.637 20 0 BHADMO C[C@@H]1CCCC[C@@H]1[N@@H+](C)CCCCCF ZINC000560196885 383966490 /nfs/dbraw/zinc/96/64/90/383966490.db2.gz ONLDYKUZZGBIHI-OLZOCXBDSA-N 1 1 215.356 3.637 20 0 BHADMO C[C@H]1CCCC[C@H]1[N@@H+](C)CCCCCF ZINC000560196886 383966003 /nfs/dbraw/zinc/96/60/03/383966003.db2.gz ONLDYKUZZGBIHI-QWHCGFSZSA-N 1 1 215.356 3.637 20 0 BHADMO C[C@H]1CCCC[C@@H]1[N@@H+](C)CCCCCF ZINC000560196887 383966539 /nfs/dbraw/zinc/96/65/39/383966539.db2.gz ONLDYKUZZGBIHI-STQMWFEESA-N 1 1 215.356 3.637 20 0 BHADMO Cc1ccc2c(c1)C[N@H+](CCC(C)(C)C)C2 ZINC000560197562 383966582 /nfs/dbraw/zinc/96/65/82/383966582.db2.gz GWLBUJJYPYNFPU-UHFFFAOYSA-N 1 1 217.356 3.747 20 0 BHADMO Cc1cc(C[N@@H+](C)CCCCCF)ccc1F ZINC000560197569 383965770 /nfs/dbraw/zinc/96/57/70/383965770.db2.gz GXCXLNUIOGGSBS-UHFFFAOYSA-N 1 1 241.325 3.706 20 0 BHADMO Cc1ccc(F)c(C[N@@H+](C)CCCCCF)c1 ZINC000560198243 383967119 /nfs/dbraw/zinc/96/71/19/383967119.db2.gz KYBVCDALFASSAN-UHFFFAOYSA-N 1 1 241.325 3.706 20 0 BHADMO FCCCCC[N@H+]1CCCC2(CCCC2)C1 ZINC000560198524 383966765 /nfs/dbraw/zinc/96/67/65/383966765.db2.gz JLJLUFHHIOYUAI-UHFFFAOYSA-N 1 1 227.367 3.782 20 0 BHADMO C[C@@H](CCC(C)(C)C)[NH2+][C@H]1CCCc2c[nH]nc21 ZINC000560244880 384009213 /nfs/dbraw/zinc/00/92/13/384009213.db2.gz QDLFIUAGXFRLGV-AAEUAGOBSA-N 1 1 249.402 3.592 20 0 BHADMO C[C@H](CCC(C)(C)C)[NH2+][C@@H]1CCCc2c[nH]nc21 ZINC000560244881 384011054 /nfs/dbraw/zinc/01/10/54/384011054.db2.gz QDLFIUAGXFRLGV-DGCLKSJQSA-N 1 1 249.402 3.592 20 0 BHADMO C[C@@H](CCC(C)(C)C)[NH2+][C@@H]1CCCc2c[nH]nc21 ZINC000560244882 384009805 /nfs/dbraw/zinc/00/98/05/384009805.db2.gz QDLFIUAGXFRLGV-WCQYABFASA-N 1 1 249.402 3.592 20 0 BHADMO C[C@H](CCC(C)(C)C)[NH2+][C@H]1CCCc2c[nH]nc21 ZINC000560244883 384011542 /nfs/dbraw/zinc/01/15/42/384011542.db2.gz QDLFIUAGXFRLGV-YPMHNXCESA-N 1 1 249.402 3.592 20 0 BHADMO CC(C)C(C[N@@H+](C)Cc1nccs1)C(C)C ZINC000560258264 384026926 /nfs/dbraw/zinc/02/69/26/384026926.db2.gz VIMSKJYJFBEBBC-UHFFFAOYSA-N 1 1 240.416 3.503 20 0 BHADMO CC(C)C(C[N@@H+](CC(F)F)C1CC1)C(C)C ZINC000560259703 384025936 /nfs/dbraw/zinc/02/59/36/384025936.db2.gz CBLYFNZUDGWOHW-UHFFFAOYSA-N 1 1 233.346 3.644 20 0 BHADMO CC(C)C(C[N@H+](CC(F)F)C1CC1)C(C)C ZINC000560259703 384025930 /nfs/dbraw/zinc/02/59/30/384025930.db2.gz CBLYFNZUDGWOHW-UHFFFAOYSA-N 1 1 233.346 3.644 20 0 BHADMO CC1(C[N@H+]2CCC=C(c3ccccc3)C2)CC1 ZINC000560276176 384032027 /nfs/dbraw/zinc/03/20/27/384032027.db2.gz HFONQLBWBOYHEC-UHFFFAOYSA-N 1 1 227.351 3.576 20 0 BHADMO CC(C)(C)CC[N@H+]1CC2(CCC2)[C@H]1C1CC1 ZINC000560364694 384094413 /nfs/dbraw/zinc/09/44/13/384094413.db2.gz DJPIAGCYTPSSII-CYBMUJFWSA-N 1 1 221.388 3.687 20 0 BHADMO CC(C)(C)CC[N@H+]1CC2(CCC2)[C@@H]1C1CC1 ZINC000560364695 384096121 /nfs/dbraw/zinc/09/61/21/384096121.db2.gz DJPIAGCYTPSSII-ZDUSSCGKSA-N 1 1 221.388 3.687 20 0 BHADMO CCc1ccc(C[N@@H+](C)[C@@H](C)C2CC2)s1 ZINC000560448629 384142294 /nfs/dbraw/zinc/14/22/94/384142294.db2.gz ISRNCUBJOGOGBL-JTQLQIEISA-N 1 1 223.385 3.541 20 0 BHADMO CCc1ccc(C[N@@H+](C)[C@H](C)C2CC2)s1 ZINC000560448630 384142723 /nfs/dbraw/zinc/14/27/23/384142723.db2.gz ISRNCUBJOGOGBL-SNVBAGLBSA-N 1 1 223.385 3.541 20 0 BHADMO CCCOc1ccc(C[N@@H+](C)[C@H](C)C2CC2)cc1 ZINC000560448662 384142734 /nfs/dbraw/zinc/14/27/34/384142734.db2.gz YRMNUSOIRPORMI-CYBMUJFWSA-N 1 1 247.382 3.706 20 0 BHADMO CCCOc1ccc(C[N@@H+](C)[C@@H](C)C2CC2)cc1 ZINC000560448663 384142760 /nfs/dbraw/zinc/14/27/60/384142760.db2.gz YRMNUSOIRPORMI-ZDUSSCGKSA-N 1 1 247.382 3.706 20 0 BHADMO CC(C)[N@H+](Cc1ccc(F)cc1)C[C@H]1C[C@@H]1C ZINC000560544060 384213862 /nfs/dbraw/zinc/21/38/62/384213862.db2.gz NPVUVWUUSNDTHR-GXTWGEPZSA-N 1 1 235.346 3.692 20 0 BHADMO CC(C)[N@H+](Cc1ccc(F)cc1)C[C@@H]1C[C@@H]1C ZINC000560544062 384215127 /nfs/dbraw/zinc/21/51/27/384215127.db2.gz NPVUVWUUSNDTHR-JSGCOSHPSA-N 1 1 235.346 3.692 20 0 BHADMO CC(C)[N@H+](Cc1ccc(F)cc1)C[C@@H]1C[C@H]1C ZINC000560544063 384213785 /nfs/dbraw/zinc/21/37/85/384213785.db2.gz NPVUVWUUSNDTHR-OCCSQVGLSA-N 1 1 235.346 3.692 20 0 BHADMO CC(C)[N@H+](Cc1ccc(F)cc1)C[C@H]1C[C@H]1C ZINC000560544064 384214195 /nfs/dbraw/zinc/21/41/95/384214195.db2.gz NPVUVWUUSNDTHR-TZMCWYRMSA-N 1 1 235.346 3.692 20 0 BHADMO CCc1ccc(C[N@H+]2CCC3(CCC3)C2)s1 ZINC000560544541 384213850 /nfs/dbraw/zinc/21/38/50/384213850.db2.gz ADQRQQCHMWCAFF-UHFFFAOYSA-N 1 1 235.396 3.687 20 0 BHADMO C/C(=C\c1ccccc1)C[N@H+]1CCC2(CCC2)C1 ZINC000560547085 384218409 /nfs/dbraw/zinc/21/84/09/384218409.db2.gz ICRQQUOMZVJHOT-NTCAYCPXSA-N 1 1 241.378 3.966 20 0 BHADMO C/C(=C/c1ccccc1)C[N@H+]1CCC2(CCC2)C1 ZINC000560547090 384217102 /nfs/dbraw/zinc/21/71/02/384217102.db2.gz ICRQQUOMZVJHOT-QINSGFPZSA-N 1 1 241.378 3.966 20 0 BHADMO Cc1ccc(C)c(C[N@H+](C)CCCOC(C)C)c1 ZINC000560547202 384217539 /nfs/dbraw/zinc/21/75/39/384217539.db2.gz OCPLPZAICBLPNR-UHFFFAOYSA-N 1 1 249.398 3.550 20 0 BHADMO CCC[C@H](C)C[N@H+]1CC(C)(C)[C@H]1c1ccncc1 ZINC000560549411 384217020 /nfs/dbraw/zinc/21/70/20/384217020.db2.gz FOFQUYISVMDQKS-DZGCQCFKSA-N 1 1 246.398 3.901 20 0 BHADMO CCC[C@@H](C)C[N@H+]1CC(C)(C)[C@@H]1c1ccncc1 ZINC000560549416 384218241 /nfs/dbraw/zinc/21/82/41/384218241.db2.gz FOFQUYISVMDQKS-HIFRSBDPSA-N 1 1 246.398 3.901 20 0 BHADMO CCC[C@@H](C)C[N@H+]1CC(C)(C)[C@H]1c1ccncc1 ZINC000560549421 384216425 /nfs/dbraw/zinc/21/64/25/384216425.db2.gz FOFQUYISVMDQKS-UKRRQHHQSA-N 1 1 246.398 3.901 20 0 BHADMO CCC[C@H](C)C[N@H+]1CC(C)(C)[C@@H]1c1ccncc1 ZINC000560549425 384216969 /nfs/dbraw/zinc/21/69/69/384216969.db2.gz FOFQUYISVMDQKS-ZFWWWQNUSA-N 1 1 246.398 3.901 20 0 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C[C@H](c1ccc(F)c(Cl)c1)[N@@H+]1C[C@@H](C)[C@H]1C ZINC000561058269 384468528 /nfs/dbraw/zinc/46/85/28/384468528.db2.gz QMPFJWLQHBKWDR-OPRDCNLKSA-N 1 1 241.737 3.880 20 0 BHADMO C[C@@H](c1ccc(F)c(Cl)c1)[N@H+]1C[C@@H](C)[C@@H]1C ZINC000561058270 384469043 /nfs/dbraw/zinc/46/90/43/384469043.db2.gz QMPFJWLQHBKWDR-UTLUCORTSA-N 1 1 241.737 3.880 20 0 BHADMO C[C@@H](c1ccc(F)c(Cl)c1)[N@@H+]1C[C@@H](C)[C@@H]1C ZINC000561058270 384469040 /nfs/dbraw/zinc/46/90/40/384469040.db2.gz QMPFJWLQHBKWDR-UTLUCORTSA-N 1 1 241.737 3.880 20 0 BHADMO Cc1cccc(C[N@H+](C)[C@@H](C)CC(C)C)c1 ZINC000561059740 384469428 /nfs/dbraw/zinc/46/94/28/384469428.db2.gz AYYRNNDLJIRXSI-AWEZNQCLSA-N 1 1 219.372 3.861 20 0 BHADMO Cc1cccc(C[N@H+](C)[C@H](C)CC(C)C)c1 ZINC000561059757 384469727 /nfs/dbraw/zinc/46/97/27/384469727.db2.gz AYYRNNDLJIRXSI-CQSZACIVSA-N 1 1 219.372 3.861 20 0 BHADMO Cc1ccccc1C[N@H+](C)[C@@H](C)CC(C)C ZINC000561062113 384471832 /nfs/dbraw/zinc/47/18/32/384471832.db2.gz BLCFFZQCAUOAFJ-AWEZNQCLSA-N 1 1 219.372 3.861 20 0 BHADMO Cc1ccccc1C[N@H+](C)[C@H](C)CC(C)C ZINC000561062115 384471855 /nfs/dbraw/zinc/47/18/55/384471855.db2.gz BLCFFZQCAUOAFJ-CQSZACIVSA-N 1 1 219.372 3.861 20 0 BHADMO Cc1ccc(C[N@H+](CC(C)C)C(C)C)cc1 ZINC000561063865 344954025 /nfs/dbraw/zinc/95/40/25/344954025.db2.gz PMBSSTYQDFCIGT-UHFFFAOYSA-N 1 1 219.372 3.861 20 0 BHADMO Cc1ccccc1OCC[N@H+](C)[C@@H](C)CC(C)C ZINC000561075923 384478992 /nfs/dbraw/zinc/47/89/92/384478992.db2.gz LXFTWEAARGKZGS-HNNXBMFYSA-N 1 1 249.398 3.740 20 0 BHADMO Cc1ccccc1OCC[N@H+](C)[C@H](C)CC(C)C ZINC000561075927 384479041 /nfs/dbraw/zinc/47/90/41/384479041.db2.gz LXFTWEAARGKZGS-OAHLLOKOSA-N 1 1 249.398 3.740 20 0 BHADMO CCc1ccc(C[N@H+]2CC[C@@H]2C(C)C)s1 ZINC000561273192 384614568 /nfs/dbraw/zinc/61/45/68/384614568.db2.gz WAAOBMKTWJKOHK-CYBMUJFWSA-N 1 1 223.385 3.541 20 0 BHADMO CCc1ccc(C[N@H+]2CC[C@H]2C(C)C)s1 ZINC000561273195 384615932 /nfs/dbraw/zinc/61/59/32/384615932.db2.gz WAAOBMKTWJKOHK-ZDUSSCGKSA-N 1 1 223.385 3.541 20 0 BHADMO CC(C)=CC[N@H+]1CC[C@@](F)(c2ccccc2)C1 ZINC000561485921 323002578 /nfs/dbraw/zinc/00/25/78/323002578.db2.gz HQCVQTONQULXRM-HNNXBMFYSA-N 1 1 233.330 3.523 20 0 BHADMO CC(C)=CC[N@H+]1CC[C@](F)(c2ccccc2)C1 ZINC000561485923 323002565 /nfs/dbraw/zinc/00/25/65/323002565.db2.gz HQCVQTONQULXRM-OAHLLOKOSA-N 1 1 233.330 3.523 20 0 BHADMO Cc1cccc(N[C@H]2CCc3c2cccc3C)[nH+]1 ZINC000561764405 323006643 /nfs/dbraw/zinc/00/66/43/323006643.db2.gz JUQYYKOWFWZJSZ-HNNXBMFYSA-N 1 1 238.334 3.798 20 0 BHADMO Cc1cccc(N[C@@H]2CCc3c2cccc3C)[nH+]1 ZINC000561764409 323006574 /nfs/dbraw/zinc/00/65/74/323006574.db2.gz JUQYYKOWFWZJSZ-OAHLLOKOSA-N 1 1 238.334 3.798 20 0 BHADMO Cc1ccc(CCC[N@H+](C)[C@@H](C)C2CC2)cc1 ZINC000561768954 323006733 /nfs/dbraw/zinc/00/67/33/323006733.db2.gz ATRGKAHWCVOMLY-AWEZNQCLSA-N 1 1 231.383 3.658 20 0 BHADMO Cc1ccc(CCC[N@H+](C)[C@H](C)C2CC2)cc1 ZINC000561768955 323006795 /nfs/dbraw/zinc/00/67/95/323006795.db2.gz ATRGKAHWCVOMLY-CQSZACIVSA-N 1 1 231.383 3.658 20 0 BHADMO CCC(CC)[N@@H+](CC)CCCCCF ZINC000561787683 323007040 /nfs/dbraw/zinc/00/70/40/323007040.db2.gz OOCUENZONVMZTA-UHFFFAOYSA-N 1 1 203.345 3.637 20 0 BHADMO CCC(CC)[N@@H+](CC)CCC(=O)c1ccccc1 ZINC000561788005 323007088 /nfs/dbraw/zinc/00/70/88/323007088.db2.gz RLAIHORZLVASRV-UHFFFAOYSA-N 1 1 247.382 3.770 20 0 BHADMO CCC[N@@H+](Cc1cccc(C)c1)C(C)C ZINC000561809945 323007380 /nfs/dbraw/zinc/00/73/80/323007380.db2.gz FOVGRYPOBTYPLR-UHFFFAOYSA-N 1 1 205.345 3.615 20 0 BHADMO CCC[N@@H+](Cc1ccccc1Cl)C(C)C ZINC000561810350 323007340 /nfs/dbraw/zinc/00/73/40/323007340.db2.gz IDLVEVIPLHUARP-UHFFFAOYSA-N 1 1 225.763 3.960 20 0 BHADMO CCC[N@@H+](CCc1ccc(OC)cc1)CC(C)C ZINC000561810461 323007399 /nfs/dbraw/zinc/00/73/99/323007399.db2.gz JOLSMOQPMQXCLO-UHFFFAOYSA-N 1 1 249.398 3.606 20 0 BHADMO CCC[N@@H+](Cc1ccc(F)cc1F)C(C)C ZINC000561816636 323007556 /nfs/dbraw/zinc/00/75/56/323007556.db2.gz NECZNSDNNUBLBD-UHFFFAOYSA-N 1 1 227.298 3.585 20 0 BHADMO CCCC[N@@H+](C[C@@H]1Cc2ccccc21)C1CC1 ZINC000561841347 323007792 /nfs/dbraw/zinc/00/77/92/323007792.db2.gz DXMMHUPQSRHKPW-AWEZNQCLSA-N 1 1 229.367 3.591 20 0 BHADMO CCCC[N@@H+](C[C@H]1Cc2ccccc21)C1CC1 ZINC000561841348 323007767 /nfs/dbraw/zinc/00/77/67/323007767.db2.gz DXMMHUPQSRHKPW-CQSZACIVSA-N 1 1 229.367 3.591 20 0 BHADMO CCCCC[N@@H+](CC1(SC)CC1)C(C)C ZINC000561943265 323008865 /nfs/dbraw/zinc/00/88/65/323008865.db2.gz NKMLAOKYQHLGRZ-UHFFFAOYSA-N 1 1 229.433 3.783 20 0 BHADMO CC[C@@H](C)[N@H+]1CCCn2c(cc3ccccc32)C1 ZINC000561951892 323009305 /nfs/dbraw/zinc/00/93/05/323009305.db2.gz PIPPXLFZGVUOHB-CYBMUJFWSA-N 1 1 242.366 3.646 20 0 BHADMO CC[C@H](C)[N@H+]1CCCn2c(cc3ccccc32)C1 ZINC000561951893 323009280 /nfs/dbraw/zinc/00/92/80/323009280.db2.gz PIPPXLFZGVUOHB-ZDUSSCGKSA-N 1 1 242.366 3.646 20 0 BHADMO CCc1ccc(C[N@H+]2CCC[C@H](C(C)C)C2)cn1 ZINC000561955573 323009510 /nfs/dbraw/zinc/00/95/10/323009510.db2.gz ZPRUTFHXIKOOHT-HNNXBMFYSA-N 1 1 246.398 3.512 20 0 BHADMO CCc1ccc(C[N@H+]2CCC[C@@H](C(C)C)C2)cn1 ZINC000561955574 323009525 /nfs/dbraw/zinc/00/95/25/323009525.db2.gz ZPRUTFHXIKOOHT-OAHLLOKOSA-N 1 1 246.398 3.512 20 0 BHADMO CC(C)CCC[N@@H+](C)C1CCC(F)(F)CC1 ZINC000561957684 323009422 /nfs/dbraw/zinc/00/94/22/323009422.db2.gz INQFORPZBVPTOQ-UHFFFAOYSA-N 1 1 233.346 3.932 20 0 BHADMO C[C@H](F)CC[N@H+]1CC(C)(C)[C@H]1c1cccs1 ZINC000561958216 323009357 /nfs/dbraw/zinc/00/93/57/323009357.db2.gz UDMKOTQTVLNNOD-CMPLNLGQSA-N 1 1 241.375 3.879 20 0 BHADMO C[C@H](F)CC[N@H+]1CC(C)(C)[C@@H]1c1cccs1 ZINC000561958218 323009317 /nfs/dbraw/zinc/00/93/17/323009317.db2.gz UDMKOTQTVLNNOD-JQWIXIFHSA-N 1 1 241.375 3.879 20 0 BHADMO C[C@@H](F)CC[N@H+]1CC(C)(C)[C@@H]1c1cccs1 ZINC000561958219 323009247 /nfs/dbraw/zinc/00/92/47/323009247.db2.gz UDMKOTQTVLNNOD-PWSUYJOCSA-N 1 1 241.375 3.879 20 0 BHADMO C[C@@H](F)CC[N@H+]1CC(C)(C)[C@H]1c1cccs1 ZINC000561958222 323009266 /nfs/dbraw/zinc/00/92/66/323009266.db2.gz UDMKOTQTVLNNOD-ZYHUDNBSSA-N 1 1 241.375 3.879 20 0 BHADMO CC(C)CC[N@@H+](C)C1CCC(F)(F)CC1 ZINC000561958535 323009360 /nfs/dbraw/zinc/00/93/60/323009360.db2.gz XNRODWHQGWUAMA-UHFFFAOYSA-N 1 1 219.319 3.542 20 0 BHADMO CC1(C)C[N@@H+](CCCCF)[C@@H]1c1cccs1 ZINC000561960372 385183135 /nfs/dbraw/zinc/18/31/35/385183135.db2.gz RLXQDWCLADMKJC-GFCCVEGCSA-N 1 1 241.375 3.881 20 0 BHADMO CC1(C)C[N@@H+](CCCCF)[C@H]1c1cccs1 ZINC000561960373 385183622 /nfs/dbraw/zinc/18/36/22/385183622.db2.gz RLXQDWCLADMKJC-LBPRGKRZSA-N 1 1 241.375 3.881 20 0 BHADMO CC/C=C\CC[N@@H+](C)C1CCC(F)(F)CC1 ZINC000561961038 323009402 /nfs/dbraw/zinc/00/94/02/323009402.db2.gz HYRVAHAHOQTBDO-PLNGDYQASA-N 1 1 231.330 3.852 20 0 BHADMO CC/C=C/CC[N@@H+](C)C1CCC(F)(F)CC1 ZINC000561961039 323009432 /nfs/dbraw/zinc/00/94/32/323009432.db2.gz HYRVAHAHOQTBDO-SNAWJCMRSA-N 1 1 231.330 3.852 20 0 BHADMO C[N@@H+](C1CCC(F)(F)CC1)[C@@H]1C=CCCC1 ZINC000561961751 345263279 /nfs/dbraw/zinc/26/32/79/345263279.db2.gz NGDKJKRMXYZUAD-LLVKDONJSA-N 1 1 229.314 3.605 20 0 BHADMO C[N@@H+](C1CCC(F)(F)CC1)[C@H]1C=CCCC1 ZINC000561961756 345263248 /nfs/dbraw/zinc/26/32/48/345263248.db2.gz NGDKJKRMXYZUAD-NSHDSACASA-N 1 1 229.314 3.605 20 0 BHADMO CC1(C)C[N@@H+](CC2(F)CC2)[C@@H]1c1cccs1 ZINC000561985857 323009944 /nfs/dbraw/zinc/00/99/44/323009944.db2.gz LQTHXFZMPIFCEO-LLVKDONJSA-N 1 1 239.359 3.633 20 0 BHADMO CC1(C)C[N@H+](CC2(F)CC2)[C@@H]1c1cccs1 ZINC000561985857 323009943 /nfs/dbraw/zinc/00/99/43/323009943.db2.gz LQTHXFZMPIFCEO-LLVKDONJSA-N 1 1 239.359 3.633 20 0 BHADMO CC1(C)C[N@@H+](CC2(F)CC2)[C@H]1c1cccs1 ZINC000561985861 323009915 /nfs/dbraw/zinc/00/99/15/323009915.db2.gz LQTHXFZMPIFCEO-NSHDSACASA-N 1 1 239.359 3.633 20 0 BHADMO CC1(C)C[N@H+](CC2(F)CC2)[C@H]1c1cccs1 ZINC000561985861 323009914 /nfs/dbraw/zinc/00/99/14/323009914.db2.gz LQTHXFZMPIFCEO-NSHDSACASA-N 1 1 239.359 3.633 20 0 BHADMO CC[N@@H+](C[C@@H](C)c1cccc(Cl)c1)C1CC1 ZINC000562033747 323010997 /nfs/dbraw/zinc/01/09/97/323010997.db2.gz IRGTUTRRYJVKDQ-LLVKDONJSA-N 1 1 237.774 3.928 20 0 BHADMO CC[N@@H+](C[C@H](C)c1cccc(Cl)c1)C1CC1 ZINC000562033753 323010991 /nfs/dbraw/zinc/01/09/91/323010991.db2.gz IRGTUTRRYJVKDQ-NSHDSACASA-N 1 1 237.774 3.928 20 0 BHADMO C[C@@H](CCc1ccccc1)[N@@H+](C)CC1CCC1 ZINC000562043406 323011102 /nfs/dbraw/zinc/01/11/02/323011102.db2.gz WBENGWALNDAMTP-AWEZNQCLSA-N 1 1 231.383 3.740 20 0 BHADMO C[C@H](CCc1ccccc1)[N@@H+](C)CC1CCC1 ZINC000562043408 323011063 /nfs/dbraw/zinc/01/10/63/323011063.db2.gz WBENGWALNDAMTP-CQSZACIVSA-N 1 1 231.383 3.740 20 0 BHADMO CCCCOCC[N@@H+](CC(C)C)C1CCCC1 ZINC000562141342 323012585 /nfs/dbraw/zinc/01/25/85/323012585.db2.gz RYFZEHAYHCRLHU-UHFFFAOYSA-N 1 1 241.419 3.704 20 0 BHADMO C[C@H](Cc1ccsc1)[N@H+]1CC(C)(C)[C@H]1C1CC1 ZINC000562206351 323013461 /nfs/dbraw/zinc/01/34/61/323013461.db2.gz BDVUJBUAMLBLEH-BXUZGUMPSA-N 1 1 249.423 3.800 20 0 BHADMO C[C@@H](Cc1ccsc1)[N@H+]1CC(C)(C)[C@@H]1C1CC1 ZINC000562206353 323013414 /nfs/dbraw/zinc/01/34/14/323013414.db2.gz BDVUJBUAMLBLEH-FZMZJTMJSA-N 1 1 249.423 3.800 20 0 BHADMO C[C@H](Cc1ccsc1)[N@H+]1CC(C)(C)[C@@H]1C1CC1 ZINC000562206354 323013444 /nfs/dbraw/zinc/01/34/44/323013444.db2.gz BDVUJBUAMLBLEH-RISCZKNCSA-N 1 1 249.423 3.800 20 0 BHADMO C[C@@H](Cc1ccsc1)[N@H+]1CC(C)(C)[C@H]1C1CC1 ZINC000562206355 323013388 /nfs/dbraw/zinc/01/33/88/323013388.db2.gz BDVUJBUAMLBLEH-SMDDNHRTSA-N 1 1 249.423 3.800 20 0 BHADMO CC[N@H+](Cc1ccc(SC)s1)CC1CC1 ZINC000562207676 323013422 /nfs/dbraw/zinc/01/34/22/323013422.db2.gz YHOQKQJPPRKKPJ-UHFFFAOYSA-N 1 1 241.425 3.702 20 0 BHADMO CC[N@@H+](Cc1ccc(Cl)cn1)[C@H](C)C(C)C ZINC000562263272 323014293 /nfs/dbraw/zinc/01/42/93/323014293.db2.gz QJHZZLGMVRYEAY-LLVKDONJSA-N 1 1 240.778 3.601 20 0 BHADMO CC[N@@H+](Cc1ccc(Cl)cn1)[C@@H](C)C(C)C ZINC000562263273 323014271 /nfs/dbraw/zinc/01/42/71/323014271.db2.gz QJHZZLGMVRYEAY-NSHDSACASA-N 1 1 240.778 3.601 20 0 BHADMO C[C@@H]([N@@H+](C)CCCC1CCOCC1)C(C)(C)C ZINC000562301473 323015520 /nfs/dbraw/zinc/01/55/20/323015520.db2.gz YLXIVYMYSIEEBD-CYBMUJFWSA-N 1 1 241.419 3.560 20 0 BHADMO C[C@H]([N@@H+](C)CCCC1CCOCC1)C(C)(C)C ZINC000562301474 323015405 /nfs/dbraw/zinc/01/54/05/323015405.db2.gz YLXIVYMYSIEEBD-ZDUSSCGKSA-N 1 1 241.419 3.560 20 0 BHADMO CC1(C[N@@H+](CCc2cccc(F)c2)C2CC2)CC1 ZINC000562340264 323016968 /nfs/dbraw/zinc/01/69/68/323016968.db2.gz IWVNJKQUIRVMHY-UHFFFAOYSA-N 1 1 247.357 3.633 20 0 BHADMO CC[N@H+](Cc1ccc(C)cc1)C[C@@H]1CCSC1 ZINC000562340568 323017084 /nfs/dbraw/zinc/01/70/84/323017084.db2.gz JHWPUQLNSNOZFE-HNNXBMFYSA-N 1 1 249.423 3.570 20 0 BHADMO CC[N@H+](Cc1ccc(C)cc1)C[C@H]1CCSC1 ZINC000562340569 323017044 /nfs/dbraw/zinc/01/70/44/323017044.db2.gz JHWPUQLNSNOZFE-OAHLLOKOSA-N 1 1 249.423 3.570 20 0 BHADMO C[C@@H](c1cccs1)[N@@H+](C)CC1(C)CC1 ZINC000562340870 323017109 /nfs/dbraw/zinc/01/71/09/323017109.db2.gz YWOPBTZSGHBUCB-JTQLQIEISA-N 1 1 209.358 3.541 20 0 BHADMO C[C@H](c1cccs1)[N@@H+](C)CC1(C)CC1 ZINC000562340871 323017126 /nfs/dbraw/zinc/01/71/26/323017126.db2.gz YWOPBTZSGHBUCB-SNVBAGLBSA-N 1 1 209.358 3.541 20 0 BHADMO CCC[N@@H+](CCc1cccs1)CC1(C)CC1 ZINC000562341407 323017111 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323027014 /nfs/dbraw/zinc/02/70/14/323027014.db2.gz NQWMIQNCFDAQCQ-HNNXBMFYSA-N 1 1 246.398 3.648 20 0 BHADMO Cc1cnccc1C[N@H+]1CCC[C@@H](C(C)(C)C)C1 ZINC000562667147 323026928 /nfs/dbraw/zinc/02/69/28/323026928.db2.gz NQWMIQNCFDAQCQ-OAHLLOKOSA-N 1 1 246.398 3.648 20 0 BHADMO c1ccc([C@@H]2CCC[N@@H+]2CC2=CCCCC2)nc1 ZINC000562697538 323028123 /nfs/dbraw/zinc/02/81/23/323028123.db2.gz CXSLVDPLOZUDGM-INIZCTEOSA-N 1 1 242.366 3.719 20 0 BHADMO c1ccc([C@H]2CCC[N@@H+]2CC2=CCCCC2)nc1 ZINC000562697539 323028156 /nfs/dbraw/zinc/02/81/56/323028156.db2.gz CXSLVDPLOZUDGM-MRXNPFEDSA-N 1 1 242.366 3.719 20 0 BHADMO FC1(F)CC[C@@H](C[N@@H+](C2CC2)C2CCCC2)C1 ZINC000562697685 323028133 /nfs/dbraw/zinc/02/81/33/323028133.db2.gz RKNHMILRTIMCNP-LLVKDONJSA-N 1 1 243.341 3.829 20 0 BHADMO FC1(F)CC[C@H](C[N@@H+](C2CC2)C2CCCC2)C1 ZINC000562697686 323028318 /nfs/dbraw/zinc/02/83/18/323028318.db2.gz RKNHMILRTIMCNP-NSHDSACASA-N 1 1 243.341 3.829 20 0 BHADMO Cc1ccc2ncc(C[N@@H+]3[C@H](C)C[C@@H]3C)cc2c1 ZINC000562702656 323028736 /nfs/dbraw/zinc/02/87/36/323028736.db2.gz MNTNXDRMKRQLLD-BETUJISGSA-N 1 1 240.350 3.526 20 0 BHADMO C[C@@H]1C[N@@H+](Cc2cccc3ccccc32)[C@@H]1C ZINC000562771525 323030175 /nfs/dbraw/zinc/03/01/75/323030175.db2.gz PEJYJYPMSDXBHM-CHWSQXEVSA-N 1 1 225.335 3.680 20 0 BHADMO C[C@@H]1C[N@@H+](Cc2cccc3ccccc32)[C@H]1C ZINC000562771530 323030239 /nfs/dbraw/zinc/03/02/39/323030239.db2.gz PEJYJYPMSDXBHM-OLZOCXBDSA-N 1 1 225.335 3.680 20 0 BHADMO C[C@@H]1[C@@H](C)C[N@H+]1Cc1cccc2ccccc21 ZINC000562771531 323030225 /nfs/dbraw/zinc/03/02/25/323030225.db2.gz PEJYJYPMSDXBHM-QWHCGFSZSA-N 1 1 225.335 3.680 20 0 BHADMO C[C@H]1C[N@@H+](Cc2cccc3ccccc32)[C@H]1C ZINC000562771532 323030192 /nfs/dbraw/zinc/03/01/92/323030192.db2.gz PEJYJYPMSDXBHM-STQMWFEESA-N 1 1 225.335 3.680 20 0 BHADMO CC[N@@H+](C[C@@H]1CC=CCC1)C1CCCC1 ZINC000562849294 323032067 /nfs/dbraw/zinc/03/20/67/323032067.db2.gz PBYAGDPLVPCDRW-CYBMUJFWSA-N 1 1 207.361 3.607 20 0 BHADMO CC[N@@H+](C[C@H]1CC=CCC1)C1CCCC1 ZINC000562849295 323032102 /nfs/dbraw/zinc/03/21/02/323032102.db2.gz PBYAGDPLVPCDRW-ZDUSSCGKSA-N 1 1 207.361 3.607 20 0 BHADMO CC(C)(C)C[N@H+]1CC[C@@H](c2ccccc2F)C1 ZINC000562854881 323032207 /nfs/dbraw/zinc/03/22/07/323032207.db2.gz PSPVDXJUOXEODN-GFCCVEGCSA-N 1 1 235.346 3.661 20 0 BHADMO CC(C)(C)C[N@H+]1CC[C@H](c2ccccc2F)C1 ZINC000562854882 323032303 /nfs/dbraw/zinc/03/23/03/323032303.db2.gz PSPVDXJUOXEODN-LBPRGKRZSA-N 1 1 235.346 3.661 20 0 BHADMO Cc1ccc2cc[nH+]c(N3CCC[C@H]3C)c2c1 ZINC000563038573 323081160 /nfs/dbraw/zinc/08/11/60/323081160.db2.gz MOQFVOWALRYOAK-GFCCVEGCSA-N 1 1 226.323 3.532 20 0 BHADMO Cc1ccc2cc[nH+]c(N3CCC[C@@H]3C)c2c1 ZINC000563038585 323081167 /nfs/dbraw/zinc/08/11/67/323081167.db2.gz MOQFVOWALRYOAK-LBPRGKRZSA-N 1 1 226.323 3.532 20 0 BHADMO C[N@@H+](Cc1cc2ccccc2o1)C(C)(C)C ZINC000563081098 323088273 /nfs/dbraw/zinc/08/82/73/323088273.db2.gz LEOCIOKMZVSAQN-UHFFFAOYSA-N 1 1 217.312 3.663 20 0 BHADMO C[N@@H+](Cc1ccc(OC(F)F)cc1)C(C)(C)C ZINC000563081118 323088337 /nfs/dbraw/zinc/08/83/37/323088337.db2.gz LQLOURAMBSBRNX-UHFFFAOYSA-N 1 1 243.297 3.518 20 0 BHADMO Cc1ccc2ncc(C[N@H+](C)C(C)(C)C)cc2c1 ZINC000563082312 323089201 /nfs/dbraw/zinc/08/92/01/323089201.db2.gz ZLGJIGJMUQWPCA-UHFFFAOYSA-N 1 1 242.366 3.774 20 0 BHADMO C[N@@H+](Cc1cc2cc(F)ccc2o1)C(C)(C)C ZINC000563157596 323096506 /nfs/dbraw/zinc/09/65/06/323096506.db2.gz IBXIUGXVMSARPG-UHFFFAOYSA-N 1 1 235.302 3.802 20 0 BHADMO C[N@@H+](C[C@@H]1C[C@H]1c1ccccc1)C(C)(C)C ZINC000563158812 323096920 /nfs/dbraw/zinc/09/69/20/323096920.db2.gz VSPHNWQKZYVUMQ-KBPBESRZSA-N 1 1 217.356 3.520 20 0 BHADMO C[N@@H+](C[C@H]1C[C@H]1c1ccccc1)C(C)(C)C ZINC000563158814 323096922 /nfs/dbraw/zinc/09/69/22/323096922.db2.gz VSPHNWQKZYVUMQ-KGLIPLIRSA-N 1 1 217.356 3.520 20 0 BHADMO C[N@@H+](C[C@@H]1C[C@@H]1c1ccccc1)C(C)(C)C ZINC000563158816 323096902 /nfs/dbraw/zinc/09/69/02/323096902.db2.gz VSPHNWQKZYVUMQ-UONOGXRCSA-N 1 1 217.356 3.520 20 0 BHADMO C[N@@H+](C[C@H]1C[C@@H]1c1ccccc1)C(C)(C)C 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323120310 /nfs/dbraw/zinc/12/03/10/323120310.db2.gz QMJLIEHQWFIRDU-BXKDBHETSA-N 1 1 238.400 3.523 20 0 BHADMO CC[C@H]1CC[C@H](C)[N@H+]1Cc1c(C)nsc1C ZINC000563354285 323120274 /nfs/dbraw/zinc/12/02/74/323120274.db2.gz QMJLIEHQWFIRDU-CABZTGNLSA-N 1 1 238.400 3.523 20 0 BHADMO CC[C@@H]1CC[C@H](C)[N@H+]1Cc1c(C)nsc1C ZINC000563354287 323120319 /nfs/dbraw/zinc/12/03/19/323120319.db2.gz QMJLIEHQWFIRDU-JOYOIKCWSA-N 1 1 238.400 3.523 20 0 BHADMO CC[C@H]1CC[C@@H](C)[N@H+]1Cc1c(C)nsc1C ZINC000563354289 323120342 /nfs/dbraw/zinc/12/03/42/323120342.db2.gz QMJLIEHQWFIRDU-SKDRFNHKSA-N 1 1 238.400 3.523 20 0 BHADMO CCC[N@@H+](Cc1ncc(C(C)(C)C)o1)C(C)C ZINC000563365361 323121281 /nfs/dbraw/zinc/12/12/81/323121281.db2.gz CQOGFRHVXWOYCY-UHFFFAOYSA-N 1 1 238.375 3.593 20 0 BHADMO CC[N@@H+](Cc1c(C)nsc1C)CC(C)(C)C ZINC000563365576 323121349 /nfs/dbraw/zinc/12/13/49/323121349.db2.gz UWVYCJMGTGSPLX-UHFFFAOYSA-N 1 1 240.416 3.628 20 0 BHADMO Cc1ccnc([C@H]2CC[N@H+]([C@H](C)CC(C)C)C2)c1 ZINC000563366186 323121182 /nfs/dbraw/zinc/12/11/82/323121182.db2.gz PHNHBYIJJYSWSI-CABCVRRESA-N 1 1 246.398 3.614 20 0 BHADMO Cc1ccnc([C@H]2CC[N@H+]([C@@H](C)CC(C)C)C2)c1 ZINC000563366199 323121194 /nfs/dbraw/zinc/12/11/94/323121194.db2.gz PHNHBYIJJYSWSI-GJZGRUSLSA-N 1 1 246.398 3.614 20 0 BHADMO Cc1ccnc([C@@H]2CC[N@H+]([C@H](C)CC(C)C)C2)c1 ZINC000563366201 323121159 /nfs/dbraw/zinc/12/11/59/323121159.db2.gz PHNHBYIJJYSWSI-HUUCEWRRSA-N 1 1 246.398 3.614 20 0 BHADMO Cc1ccnc([C@@H]2CC[N@H+]([C@@H](C)CC(C)C)C2)c1 ZINC000563366204 323121335 /nfs/dbraw/zinc/12/13/35/323121335.db2.gz PHNHBYIJJYSWSI-LSDHHAIUSA-N 1 1 246.398 3.614 20 0 BHADMO CCC[N@@H+](Cc1ccsc1C)C(C)C ZINC000563429358 323125030 /nfs/dbraw/zinc/12/50/30/323125030.db2.gz WWJFBVWHYFQANS-UHFFFAOYSA-N 1 1 211.374 3.677 20 0 BHADMO CCC[N@@H+](Cc1cnc(C(C)C)s1)C(C)C ZINC000563429502 323125039 /nfs/dbraw/zinc/12/50/39/323125039.db2.gz ZXVDAVYQBIYTPY-UHFFFAOYSA-N 1 1 240.416 3.887 20 0 BHADMO C[C@H](C1CCCCC1)[N@@H+](C)Cc1cccc(O)c1 ZINC000563487241 323127802 /nfs/dbraw/zinc/12/78/02/323127802.db2.gz DGINGTGNBRPCGF-CYBMUJFWSA-N 1 1 247.382 3.793 20 0 BHADMO C[C@@H]1C[N@@H+](Cc2cccc(Cl)c2Cl)[C@H]1C ZINC000563504519 323128120 /nfs/dbraw/zinc/12/81/20/323128120.db2.gz AKHOCKJAYROUFB-BDAKNGLRSA-N 1 1 244.165 3.834 20 0 BHADMO C[C@@H]1C[N@H+](Cc2cccc(Cl)c2Cl)[C@H]1C ZINC000563504519 323128119 /nfs/dbraw/zinc/12/81/19/323128119.db2.gz AKHOCKJAYROUFB-BDAKNGLRSA-N 1 1 244.165 3.834 20 0 BHADMO C[C@@H]1[C@@H](C)C[N@H+]1Cc1cccc(Cl)c1Cl ZINC000563504523 323128135 /nfs/dbraw/zinc/12/81/35/323128135.db2.gz AKHOCKJAYROUFB-DTWKUNHWSA-N 1 1 244.165 3.834 20 0 BHADMO C[C@@H]1[C@@H](C)C[N@@H+]1Cc1cccc(Cl)c1Cl ZINC000563504523 323128134 /nfs/dbraw/zinc/12/81/34/323128134.db2.gz AKHOCKJAYROUFB-DTWKUNHWSA-N 1 1 244.165 3.834 20 0 BHADMO C[C@H]1C[N@@H+](Cc2cccc(Cl)c2Cl)[C@H]1C ZINC000563504524 323128200 /nfs/dbraw/zinc/12/82/00/323128200.db2.gz AKHOCKJAYROUFB-IUCAKERBSA-N 1 1 244.165 3.834 20 0 BHADMO C[C@H]1C[N@H+](Cc2cccc(Cl)c2Cl)[C@H]1C ZINC000563504524 323128199 /nfs/dbraw/zinc/12/81/99/323128199.db2.gz AKHOCKJAYROUFB-IUCAKERBSA-N 1 1 244.165 3.834 20 0 BHADMO C[C@@H]1C[N@@H+](Cc2cccc(Cl)c2Cl)[C@@H]1C ZINC000563504526 323128125 /nfs/dbraw/zinc/12/81/25/323128125.db2.gz AKHOCKJAYROUFB-RKDXNWHRSA-N 1 1 244.165 3.834 20 0 BHADMO C[C@@H]1C[N@H+](Cc2cccc(Cl)c2Cl)[C@@H]1C ZINC000563504526 323128124 /nfs/dbraw/zinc/12/81/24/323128124.db2.gz AKHOCKJAYROUFB-RKDXNWHRSA-N 1 1 244.165 3.834 20 0 BHADMO Cc1nc(C(C)C)ccc1C[N@@H+](C)CC(C)(C)C ZINC000563542544 323129544 /nfs/dbraw/zinc/12/95/44/323129544.db2.gz XPVUVMZSPWVGEA-UHFFFAOYSA-N 1 1 248.414 3.991 20 0 BHADMO Cc1cccc(C[N@H+]2CC3(CCC3)[C@@H]2C2CC2)c1 ZINC000563575822 323130547 /nfs/dbraw/zinc/13/05/47/323130547.db2.gz PYLZOFXBZAHSDJ-INIZCTEOSA-N 1 1 241.378 3.760 20 0 BHADMO Cc1cccc(C[N@H+]2CC3(CCC3)[C@H]2C2CC2)c1 ZINC000563575823 323130492 /nfs/dbraw/zinc/13/04/92/323130492.db2.gz PYLZOFXBZAHSDJ-MRXNPFEDSA-N 1 1 241.378 3.760 20 0 BHADMO CC[C@@H](C)CSCC[C@H]1CCCC[N@H+]1C ZINC000563672955 323134425 /nfs/dbraw/zinc/13/44/25/323134425.db2.gz FNYFYFUABQHASQ-CHWSQXEVSA-N 1 1 229.433 3.640 20 0 BHADMO CC[C@@H](C)CSCC[C@@H]1CCCC[N@H+]1C ZINC000563672966 323134404 /nfs/dbraw/zinc/13/44/04/323134404.db2.gz FNYFYFUABQHASQ-OLZOCXBDSA-N 1 1 229.433 3.640 20 0 BHADMO CC[C@H](C)CSCC[C@H]1CCCC[N@H+]1C ZINC000563672967 323134496 /nfs/dbraw/zinc/13/44/96/323134496.db2.gz FNYFYFUABQHASQ-QWHCGFSZSA-N 1 1 229.433 3.640 20 0 BHADMO CC[C@H](C)CSCC[C@@H]1CCCC[N@H+]1C ZINC000563672968 323134489 /nfs/dbraw/zinc/13/44/89/323134489.db2.gz FNYFYFUABQHASQ-STQMWFEESA-N 1 1 229.433 3.640 20 0 BHADMO CC(C)C[C@H](C)[N@@H+](C)CCCOc1ccccc1 ZINC000563709627 323174828 /nfs/dbraw/zinc/17/48/28/323174828.db2.gz OJCHOXWLTRKUCF-HNNXBMFYSA-N 1 1 249.398 3.822 20 0 BHADMO CC(C)C[C@@H](C)[N@@H+](C)CCCOc1ccccc1 ZINC000563709633 323174830 /nfs/dbraw/zinc/17/48/30/323174830.db2.gz OJCHOXWLTRKUCF-OAHLLOKOSA-N 1 1 249.398 3.822 20 0 BHADMO C[C@@H]1CC[C@@H]([N@@H+](C)CC2Cc3ccccc3C2)C1 ZINC000563754731 323176979 /nfs/dbraw/zinc/17/69/79/323176979.db2.gz JQLILANASHFZGG-CXAGYDPISA-N 1 1 243.394 3.522 20 0 BHADMO C[C@@H]1CC[C@H]([N@@H+](C)CC2Cc3ccccc3C2)C1 ZINC000563754750 323176964 /nfs/dbraw/zinc/17/69/64/323176964.db2.gz JQLILANASHFZGG-DYVFJYSZSA-N 1 1 243.394 3.522 20 0 BHADMO C[C@H]1CC[C@H]([N@@H+](C)CC2Cc3ccccc3C2)C1 ZINC000563754751 323176881 /nfs/dbraw/zinc/17/68/81/323176881.db2.gz JQLILANASHFZGG-GUYCJALGSA-N 1 1 243.394 3.522 20 0 BHADMO C[C@H]1CC[C@@H]([N@@H+](C)CC2Cc3ccccc3C2)C1 ZINC000563754752 323176860 /nfs/dbraw/zinc/17/68/60/323176860.db2.gz JQLILANASHFZGG-SUMWQHHRSA-N 1 1 243.394 3.522 20 0 BHADMO CC[N@@H+](CCCc1cnccc1C)[C@@H](C)C(C)C ZINC000563779106 323177495 /nfs/dbraw/zinc/17/74/95/323177495.db2.gz GOJKNDSHOSTAEC-HNNXBMFYSA-N 1 1 248.414 3.689 20 0 BHADMO CC[N@@H+](CCCc1cnccc1C)[C@H](C)C(C)C ZINC000563779107 323177476 /nfs/dbraw/zinc/17/74/76/323177476.db2.gz GOJKNDSHOSTAEC-OAHLLOKOSA-N 1 1 248.414 3.689 20 0 BHADMO C[N@@H+](Cc1sccc1Cl)C(C)(C)C ZINC000563808056 323178529 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ZINC000563814587 323178951 /nfs/dbraw/zinc/17/89/51/323178951.db2.gz KMMBBJBFRORTPJ-IUCAKERBSA-N 1 1 244.165 3.834 20 0 BHADMO C[C@@H]1C[N@@H+](Cc2ccc(Cl)c(Cl)c2)[C@@H]1C ZINC000563814588 323178964 /nfs/dbraw/zinc/17/89/64/323178964.db2.gz KMMBBJBFRORTPJ-RKDXNWHRSA-N 1 1 244.165 3.834 20 0 BHADMO C[C@@H]1C[N@H+](Cc2ccc(Cl)c(Cl)c2)[C@@H]1C ZINC000563814588 323178963 /nfs/dbraw/zinc/17/89/63/323178963.db2.gz KMMBBJBFRORTPJ-RKDXNWHRSA-N 1 1 244.165 3.834 20 0 BHADMO COc1ccccc1[C@@H]1CCC[N@H+]1CC1(C)CC1 ZINC000563819808 323179214 /nfs/dbraw/zinc/17/92/14/323179214.db2.gz XHPSOPYGYIDYQV-AWEZNQCLSA-N 1 1 245.366 3.632 20 0 BHADMO COc1ccccc1[C@H]1CCC[N@H+]1CC1(C)CC1 ZINC000563819809 323179143 /nfs/dbraw/zinc/17/91/43/323179143.db2.gz XHPSOPYGYIDYQV-CQSZACIVSA-N 1 1 245.366 3.632 20 0 BHADMO CCCc1cccc(C[N@H+]2CCC[C@H]2CF)c1 ZINC000563828489 323179883 /nfs/dbraw/zinc/17/98/83/323179883.db2.gz WQVJOOVHBRUKDN-HNNXBMFYSA-N 1 1 235.346 3.573 20 0 BHADMO CCCc1cccc(C[N@H+]2CCC[C@@H]2CF)c1 ZINC000563828490 323179870 /nfs/dbraw/zinc/17/98/70/323179870.db2.gz WQVJOOVHBRUKDN-OAHLLOKOSA-N 1 1 235.346 3.573 20 0 BHADMO CCC(CC)[N@@H+](CC)C[C@H](OC)c1ccccc1 ZINC000563835765 323180181 /nfs/dbraw/zinc/18/01/81/323180181.db2.gz OJPDHHINWZSAPD-INIZCTEOSA-N 1 1 249.398 3.885 20 0 BHADMO CCC(CC)[N@@H+](CC)C[C@@H](OC)c1ccccc1 ZINC000563835774 323180194 /nfs/dbraw/zinc/18/01/94/323180194.db2.gz OJPDHHINWZSAPD-MRXNPFEDSA-N 1 1 249.398 3.885 20 0 BHADMO COC1(CC[N@@H+](C)C2CCCCCC2)CCC1 ZINC000563900944 323222116 /nfs/dbraw/zinc/22/21/16/323222116.db2.gz NALOYMJIIMQEMK-UHFFFAOYSA-N 1 1 239.403 3.600 20 0 BHADMO CSC1(C[N@H+]2CC[C@@H](C(C)(C)C)C2)CCC1 ZINC000563922904 323321839 /nfs/dbraw/zinc/32/18/39/323321839.db2.gz SHNYFKOXKDZEJQ-GFCCVEGCSA-N 1 1 241.444 3.640 20 0 BHADMO CSC1(C[N@H+]2CC[C@H](C(C)(C)C)C2)CCC1 ZINC000563922906 323321823 /nfs/dbraw/zinc/32/18/23/323321823.db2.gz SHNYFKOXKDZEJQ-LBPRGKRZSA-N 1 1 241.444 3.640 20 0 BHADMO CC[N@@H+](Cc1ccccc1OCC(C)C)C1CC1 ZINC000564106440 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C[C@H]1CCCC[C@H]1C[N@@H+](C)Cc1ccc(O)cc1 ZINC000569916506 323044394 /nfs/dbraw/zinc/04/43/94/323044394.db2.gz MBZKZRWYJQNFNB-ZFWWWQNUSA-N 1 1 247.382 3.650 20 0 BHADMO C[N@@H+](Cc1cnc(C(C)(C)C)s1)C(C)(C)C ZINC000569972844 323046147 /nfs/dbraw/zinc/04/61/47/323046147.db2.gz YOMGOCUXINIRBP-UHFFFAOYSA-N 1 1 240.416 3.671 20 0 BHADMO C[N@@H+](Cc1ccccc1Cl)CC1(C)CC1 ZINC000569994434 323046902 /nfs/dbraw/zinc/04/69/02/323046902.db2.gz NZMZDUUVLPYRJJ-UHFFFAOYSA-N 1 1 223.747 3.572 20 0 BHADMO C[C@@H]1C[N@@H+](CCC2CCCC2)CCC1(F)F ZINC000570010704 323047209 /nfs/dbraw/zinc/04/72/09/323047209.db2.gz DJBPKKDPCZQRKB-LLVKDONJSA-N 1 1 231.330 3.544 20 0 BHADMO C[C@H]1C[N@@H+](CCC2CCCC2)CCC1(F)F ZINC000570010705 323047275 /nfs/dbraw/zinc/04/72/75/323047275.db2.gz DJBPKKDPCZQRKB-NSHDSACASA-N 1 1 231.330 3.544 20 0 BHADMO c1cc(C2CC2)cc(NC(C2CC2)C2CC2)[nH+]1 ZINC000570012487 323047380 /nfs/dbraw/zinc/04/73/80/323047380.db2.gz NZHZAVFJXSWPBA-UHFFFAOYSA-N 1 1 228.339 3.560 20 0 BHADMO 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CC[C@@H]1CC[C@@H](C)[N@H+]1Cc1ccc(C)s1 ZINC000571448818 323145218 /nfs/dbraw/zinc/14/52/18/323145218.db2.gz XRQHHNULYFIPMU-ZYHUDNBSSA-N 1 1 223.385 3.819 20 0 BHADMO CC1(C[N@H+]2CC[C@H](C(F)(F)F)C(C)(C)C2)CC1 ZINC000571473142 323145554 /nfs/dbraw/zinc/14/55/54/323145554.db2.gz UAZJYOGLDRGBNC-JTQLQIEISA-N 1 1 249.320 3.697 20 0 BHADMO CC1(C[N@H+]2CC[C@@H](C(F)(F)F)C(C)(C)C2)CC1 ZINC000571473143 323145577 /nfs/dbraw/zinc/14/55/77/323145577.db2.gz UAZJYOGLDRGBNC-SNVBAGLBSA-N 1 1 249.320 3.697 20 0 BHADMO Cc1nsc(C)c1C[N@H+](C)C1CCCCC1 ZINC000571484155 323145857 /nfs/dbraw/zinc/14/58/57/323145857.db2.gz QOKHFXGYTPCCKX-UHFFFAOYSA-N 1 1 238.400 3.524 20 0 BHADMO Cc1cccc2c1cc[nH+]c2NCC(C)(F)F ZINC000571518665 323146749 /nfs/dbraw/zinc/14/67/49/323146749.db2.gz HXXGCOALLGUBBU-UHFFFAOYSA-N 1 1 236.265 3.610 20 0 BHADMO CCSCC[N@H+]1CCCC[C@H]1c1ccccc1 ZINC000571577664 323148475 /nfs/dbraw/zinc/14/84/75/323148475.db2.gz GXDWORDQZZEVNF-HNNXBMFYSA-N 1 1 249.423 3.967 20 0 BHADMO CCSCC[N@H+]1CCCC[C@@H]1c1ccccc1 ZINC000571577665 323148433 /nfs/dbraw/zinc/14/84/33/323148433.db2.gz GXDWORDQZZEVNF-OAHLLOKOSA-N 1 1 249.423 3.967 20 0 BHADMO CCC[N@@H+](C[C@@H]1CCC2(CCCC2)O1)C(C)C ZINC000571578947 323148413 /nfs/dbraw/zinc/14/84/13/323148413.db2.gz DFYHBNFFUJLFOI-AWEZNQCLSA-N 1 1 239.403 3.599 20 0 BHADMO CCC[N@@H+](C[C@H]1CCC2(CCCC2)O1)C(C)C ZINC000571578948 323148451 /nfs/dbraw/zinc/14/84/51/323148451.db2.gz DFYHBNFFUJLFOI-CQSZACIVSA-N 1 1 239.403 3.599 20 0 BHADMO CCc1ccc(C[N@H+]2CC[C@@H](CC(C)C)C2)nc1 ZINC000571585074 323148913 /nfs/dbraw/zinc/14/89/13/323148913.db2.gz YTGLVPKBEFOVBX-HNNXBMFYSA-N 1 1 246.398 3.512 20 0 BHADMO CCc1ccc(C[N@H+]2CC[C@H](CC(C)C)C2)nc1 ZINC000571585075 323148846 /nfs/dbraw/zinc/14/88/46/323148846.db2.gz YTGLVPKBEFOVBX-OAHLLOKOSA-N 1 1 246.398 3.512 20 0 BHADMO C1=C[C@H]([N@@H+]2CCOC3(CCCC3)C2)CCCCC1 ZINC000571623571 323149649 /nfs/dbraw/zinc/14/96/49/323149649.db2.gz HKJYDSZHSUOETG-HNNXBMFYSA-N 1 1 249.398 3.520 20 0 BHADMO C1=C[C@@H]([N@@H+]2CCOC3(CCCC3)C2)CCCCC1 ZINC000571623572 323149654 /nfs/dbraw/zinc/14/96/54/323149654.db2.gz HKJYDSZHSUOETG-OAHLLOKOSA-N 1 1 249.398 3.520 20 0 BHADMO CCOc1ccc(C[N@@H+](CC)[C@@H](C)C(C)C)cc1 ZINC000571667758 323175634 /nfs/dbraw/zinc/17/56/34/323175634.db2.gz LQILSXLYFXUIBG-AWEZNQCLSA-N 1 1 249.398 3.952 20 0 BHADMO CCOc1ccc(C[N@@H+](CC)[C@H](C)C(C)C)cc1 ZINC000571667762 323175670 /nfs/dbraw/zinc/17/56/70/323175670.db2.gz LQILSXLYFXUIBG-CQSZACIVSA-N 1 1 249.398 3.952 20 0 BHADMO CCC[N@@H+](CCc1ccccn1)CCC(C)(C)C ZINC000571721024 387151259 /nfs/dbraw/zinc/15/12/59/387151259.db2.gz BVXGDOGHOQYGCH-UHFFFAOYSA-N 1 1 248.414 3.772 20 0 BHADMO Cc1cnccc1C[N@H+](C)[C@@H](C)C1CCCCC1 ZINC000571731691 387157703 /nfs/dbraw/zinc/15/77/03/387157703.db2.gz GFDRMSYBYFDFJO-AWEZNQCLSA-N 1 1 246.398 3.791 20 0 BHADMO CCC(CC)[N@@H+](CC)Cc1ccc(Cl)cn1 ZINC000571798434 387173341 /nfs/dbraw/zinc/17/33/41/387173341.db2.gz XPSUYAOARVSPJI-UHFFFAOYSA-N 1 1 240.778 3.746 20 0 BHADMO CC1(C[N@@H+]2CC=C(c3ccc(F)cc3)CC2)CC1 ZINC000571856271 387185908 /nfs/dbraw/zinc/18/59/08/387185908.db2.gz WAFZATOEMSSXJV-UHFFFAOYSA-N 1 1 245.341 3.715 20 0 BHADMO CSc1ccc(C[N@@H+]2CC=C(C)CC2)s1 ZINC000571872125 387182442 /nfs/dbraw/zinc/18/24/42/387182442.db2.gz UUZSFPFWSKCXKD-UHFFFAOYSA-N 1 1 239.409 3.622 20 0 BHADMO Cc1ccncc1CCC[N@H+](CC(C)C)C(C)C ZINC000571922916 387199841 /nfs/dbraw/zinc/19/98/41/387199841.db2.gz FHLZWSBAWUPQAI-UHFFFAOYSA-N 1 1 248.414 3.689 20 0 BHADMO CCCC[C@@H](C)[N@@H+](C)Cc1cccc2c[nH]nc21 ZINC000571934712 387201761 /nfs/dbraw/zinc/20/17/61/387201761.db2.gz STEHXZSZGLMIGR-GFCCVEGCSA-N 1 1 245.370 3.573 20 0 BHADMO CCCC[C@H](C)[N@@H+](C)Cc1cccc2c[nH]nc21 ZINC000571934715 387200596 /nfs/dbraw/zinc/20/05/96/387200596.db2.gz STEHXZSZGLMIGR-LBPRGKRZSA-N 1 1 245.370 3.573 20 0 BHADMO Cc1cnccc1C[N@H+](C)C1CCCCCC1 ZINC000571970191 387211497 /nfs/dbraw/zinc/21/14/97/387211497.db2.gz IIAPBIKNQJLNFP-UHFFFAOYSA-N 1 1 232.371 3.545 20 0 BHADMO CC[C@@H]1CC[C@@H](C)[N@H+]1C[C@H](OC)c1ccccc1 ZINC000572018455 387221267 /nfs/dbraw/zinc/22/12/67/387221267.db2.gz KDGTZKWNGKTSAZ-BMFZPTHFSA-N 1 1 247.382 3.637 20 0 BHADMO CC[C@@H]1CC[C@@H](C)[N@H+]1C[C@@H](OC)c1ccccc1 ZINC000572018456 387220625 /nfs/dbraw/zinc/22/06/25/387220625.db2.gz KDGTZKWNGKTSAZ-FVQBIDKESA-N 1 1 247.382 3.637 20 0 BHADMO CC[C@@H]1CC[C@H](C)[N@H+]1C[C@H](OC)c1ccccc1 ZINC000572018457 387220683 /nfs/dbraw/zinc/22/06/83/387220683.db2.gz KDGTZKWNGKTSAZ-IMJJTQAJSA-N 1 1 247.382 3.637 20 0 BHADMO CC[C@@H]1CC[C@H](C)[N@H+]1C[C@@H](OC)c1ccccc1 ZINC000572018458 387220088 /nfs/dbraw/zinc/22/00/88/387220088.db2.gz KDGTZKWNGKTSAZ-NUEKZKHPSA-N 1 1 247.382 3.637 20 0 BHADMO CCSCC[N@@H+](C)[C@H](C)C1CCCCC1 ZINC000572018671 387220703 /nfs/dbraw/zinc/22/07/03/387220703.db2.gz LNTWBCHEYPVKEW-GFCCVEGCSA-N 1 1 229.433 3.640 20 0 BHADMO CC1=C[C@H](C)C[N@H+]([C@@H](C)Cc2ccsc2)C1 ZINC000572075736 387230036 /nfs/dbraw/zinc/23/00/36/387230036.db2.gz UUFJJDDITZKLMH-AAEUAGOBSA-N 1 1 235.396 3.577 20 0 BHADMO CC1=C[C@@H](C)C[N@H+]([C@H](C)Cc2ccsc2)C1 ZINC000572075737 387229752 /nfs/dbraw/zinc/22/97/52/387229752.db2.gz UUFJJDDITZKLMH-DGCLKSJQSA-N 1 1 235.396 3.577 20 0 BHADMO CC1=C[C@H](C)C[N@H+]([C@H](C)Cc2ccsc2)C1 ZINC000572075738 387229618 /nfs/dbraw/zinc/22/96/18/387229618.db2.gz UUFJJDDITZKLMH-WCQYABFASA-N 1 1 235.396 3.577 20 0 BHADMO CC1=C[C@@H](C)C[N@H+]([C@@H](C)Cc2ccsc2)C1 ZINC000572075739 387230053 /nfs/dbraw/zinc/23/00/53/387230053.db2.gz UUFJJDDITZKLMH-YPMHNXCESA-N 1 1 235.396 3.577 20 0 BHADMO C[C@@H](Cc1ccccc1)C[N@@H+](C)[C@@H](C)C1CC1 ZINC000572078726 387229890 /nfs/dbraw/zinc/22/98/90/387229890.db2.gz RFGJDBXFRCPQPO-KBPBESRZSA-N 1 1 231.383 3.596 20 0 BHADMO C[C@H](Cc1ccccc1)C[N@@H+](C)[C@@H](C)C1CC1 ZINC000572078729 387230077 /nfs/dbraw/zinc/23/00/77/387230077.db2.gz RFGJDBXFRCPQPO-KGLIPLIRSA-N 1 1 231.383 3.596 20 0 BHADMO C[C@H](C1CC1)[N@H+](C)C[C@@H](C)Cc1ccccc1 ZINC000572078730 387230438 /nfs/dbraw/zinc/23/04/38/387230438.db2.gz 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JKLRFOBWHCFXMT-ZDUSSCGKSA-N 1 1 243.350 3.824 20 0 BHADMO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2ccon2)c(C)c1 ZINC000572168083 387255961 /nfs/dbraw/zinc/25/59/61/387255961.db2.gz HDXRTNNEVIFXDJ-CHWSQXEVSA-N 1 1 244.338 3.703 20 0 BHADMO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccon2)c(C)c1 ZINC000572168084 387255615 /nfs/dbraw/zinc/25/56/15/387255615.db2.gz HDXRTNNEVIFXDJ-OLZOCXBDSA-N 1 1 244.338 3.703 20 0 BHADMO Cc1ccc([C@H](C)[NH2+][C@H](C)c2ccon2)c(C)c1 ZINC000572168085 387255748 /nfs/dbraw/zinc/25/57/48/387255748.db2.gz HDXRTNNEVIFXDJ-QWHCGFSZSA-N 1 1 244.338 3.703 20 0 BHADMO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2ccon2)c(C)c1 ZINC000572168086 323557592 /nfs/dbraw/zinc/55/75/92/323557592.db2.gz HDXRTNNEVIFXDJ-STQMWFEESA-N 1 1 244.338 3.703 20 0 BHADMO CSc1ccc(C[N@H+]2CC[C@@H](C)[C@H]2C)s1 ZINC000572174272 387258478 /nfs/dbraw/zinc/25/84/78/387258478.db2.gz IFKROYAWRIJNFV-NXEZZACHSA-N 1 1 241.425 3.700 20 0 BHADMO CSc1ccc(C[N@H+]2CC[C@H](C)[C@@H]2C)s1 ZINC000572174273 387257550 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/nfs/dbraw/zinc/32/65/18/387326518.db2.gz FODIUZFIJJDMQM-KBPBESRZSA-N 1 1 217.356 3.697 20 0 BHADMO C[C@@H]1CCC[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000572335959 387327025 /nfs/dbraw/zinc/32/70/25/387327025.db2.gz FODIUZFIJJDMQM-KGLIPLIRSA-N 1 1 217.356 3.697 20 0 BHADMO C[C@@H]1CCC[C@H](C)C[N@@H+]1Cc1ccccc1 ZINC000572335960 387327393 /nfs/dbraw/zinc/32/73/93/387327393.db2.gz FODIUZFIJJDMQM-UONOGXRCSA-N 1 1 217.356 3.697 20 0 BHADMO C[C@@H]1CCC[C@@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000572335961 387327413 /nfs/dbraw/zinc/32/74/13/387327413.db2.gz FODIUZFIJJDMQM-ZIAGYGMSSA-N 1 1 217.356 3.697 20 0 BHADMO CC1(C[N@H+]2CCCCC[C@H]2c2ccncc2)CC1 ZINC000572339224 387332187 /nfs/dbraw/zinc/33/21/87/387332187.db2.gz CYXMDKHONDTBQR-HNNXBMFYSA-N 1 1 244.382 3.799 20 0 BHADMO CC1(C[N@H+]2CCCCC[C@@H]2c2ccncc2)CC1 ZINC000572339225 387332884 /nfs/dbraw/zinc/33/28/84/387332884.db2.gz CYXMDKHONDTBQR-OAHLLOKOSA-N 1 1 244.382 3.799 20 0 BHADMO C[C@H](C[N@@H+](C)C(C)(C)C)c1ccc(F)cc1 ZINC000572365281 387347701 /nfs/dbraw/zinc/34/77/01/387347701.db2.gz KIIOPBNBWTXKBB-LLVKDONJSA-N 1 1 223.335 3.660 20 0 BHADMO C[C@@H](C[N@@H+](C)C(C)(C)C)c1ccc(F)cc1 ZINC000572365282 387346700 /nfs/dbraw/zinc/34/67/00/387346700.db2.gz KIIOPBNBWTXKBB-NSHDSACASA-N 1 1 223.335 3.660 20 0 BHADMO CCCC[N@@H+](Cc1cc(C)c(O)c(C)c1)C1CC1 ZINC000572388811 387377805 /nfs/dbraw/zinc/37/78/05/387377805.db2.gz TUCRMRNQKHYVJN-UHFFFAOYSA-N 1 1 247.382 3.774 20 0 BHADMO CCC(CC)[N@@H+](CC)Cc1ccc(OC)cc1 ZINC000572440248 398145317 /nfs/dbraw/zinc/14/53/17/398145317.db2.gz XBQIHVXBMYNATP-UHFFFAOYSA-N 1 1 235.371 3.706 20 0 BHADMO CC[N@@H+](C/C=C/c1ccc(F)c(F)c1)C(C)C ZINC000572444474 387451935 /nfs/dbraw/zinc/45/19/35/387451935.db2.gz XBGMRELPNLTCNQ-AATRIKPKSA-N 1 1 239.309 3.708 20 0 BHADMO CC[N@@H+](C/C=C\c1ccc(F)c(F)c1)C(C)C ZINC000572444480 398146932 /nfs/dbraw/zinc/14/69/32/398146932.db2.gz XBGMRELPNLTCNQ-WAYWQWQTSA-N 1 1 239.309 3.708 20 0 BHADMO CC(C)OCC[N@H+]1CCC[C@H](C(C)(C)C)CC1 ZINC000572470383 411231386 /nfs/dbraw/zinc/23/13/86/411231386.db2.gz FYEMVQTYYNHSRO-AWEZNQCLSA-N 1 1 241.419 3.560 20 0 BHADMO CC(C)OCC[N@H+]1CCC[C@@H](C(C)(C)C)CC1 ZINC000572470384 411231341 /nfs/dbraw/zinc/23/13/41/411231341.db2.gz FYEMVQTYYNHSRO-CQSZACIVSA-N 1 1 241.419 3.560 20 0 BHADMO CCCC[C@H](C)[N@@H+](C)C[C@H]1CCO[C@@H](CC)C1 ZINC000572536593 388768265 /nfs/dbraw/zinc/76/82/65/388768265.db2.gz QZGMVJRPTCGUQC-KKUMJFAQSA-N 1 1 241.419 3.702 20 0 BHADMO CCCC[C@H](C)[N@@H+](C)C[C@@H]1CCO[C@H](CC)C1 ZINC000572536594 388767888 /nfs/dbraw/zinc/76/78/88/388767888.db2.gz QZGMVJRPTCGUQC-RRFJBIMHSA-N 1 1 241.419 3.702 20 0 BHADMO CCCC[C@H](C)[N@@H+](C)C[C@H]1CCO[C@H](CC)C1 ZINC000572536595 388768141 /nfs/dbraw/zinc/76/81/41/388768141.db2.gz QZGMVJRPTCGUQC-SOUVJXGZSA-N 1 1 241.419 3.702 20 0 BHADMO CCCC[C@H](C)[N@@H+](C)C[C@@H]1CCO[C@@H](CC)C1 ZINC000572536596 388769000 /nfs/dbraw/zinc/76/90/00/388769000.db2.gz QZGMVJRPTCGUQC-ZNMIVQPWSA-N 1 1 241.419 3.702 20 0 BHADMO CC(C)Oc1cccc(C[N@@H+](C)CC2(C)CC2)c1 ZINC000572578306 326086407 /nfs/dbraw/zinc/08/64/07/326086407.db2.gz GDGZCNVHTBIRQM-UHFFFAOYSA-N 1 1 247.382 3.706 20 0 BHADMO Cc1cc(F)ccc1C[N@H+]1CCCC12CCC2 ZINC000572585882 326236056 /nfs/dbraw/zinc/23/60/56/326236056.db2.gz IZZMHNYTYLXGKV-UHFFFAOYSA-N 1 1 233.330 3.653 20 0 BHADMO CCCC[N@@H+](CC)CCO[C@H]1CCCC[C@H]1C ZINC000572609346 323064186 /nfs/dbraw/zinc/06/41/86/323064186.db2.gz MTDSYQHNKGCMIO-CABCVRRESA-N 1 1 241.419 3.704 20 0 BHADMO CCCC[N@@H+](CC)CCO[C@H]1CCCC[C@@H]1C ZINC000572609347 323064174 /nfs/dbraw/zinc/06/41/74/323064174.db2.gz MTDSYQHNKGCMIO-GJZGRUSLSA-N 1 1 241.419 3.704 20 0 BHADMO CCCC[N@@H+](CC)CCO[C@@H]1CCCC[C@H]1C ZINC000572609348 323064181 /nfs/dbraw/zinc/06/41/81/323064181.db2.gz MTDSYQHNKGCMIO-HUUCEWRRSA-N 1 1 241.419 3.704 20 0 BHADMO CC[C@@H](C)[N@H+]1CCSC2(CCCCC2)C1 ZINC000572639070 388363073 /nfs/dbraw/zinc/36/30/73/388363073.db2.gz YWFHPXVEODSLSD-GFCCVEGCSA-N 1 1 227.417 3.537 20 0 BHADMO CC[C@H](C)[N@H+]1CCSC2(CCCCC2)C1 ZINC000572639074 388362754 /nfs/dbraw/zinc/36/27/54/388362754.db2.gz YWFHPXVEODSLSD-LBPRGKRZSA-N 1 1 227.417 3.537 20 0 BHADMO CCC(C)(C)[N@@H+](C)Cc1cc(C(C)(C)C)on1 ZINC000572650787 388363066 /nfs/dbraw/zinc/36/30/66/388363066.db2.gz XCZZKMWDRVXJQN-UHFFFAOYSA-N 1 1 238.375 3.593 20 0 BHADMO Cc1cc(C[N@H+](C)[C@H]2CC[C@@H](C)C2)cc(C)c1O ZINC000572709853 388368981 /nfs/dbraw/zinc/36/89/81/388368981.db2.gz VKLJMDMOTRUJME-ABAIWWIYSA-N 1 1 247.382 3.629 20 0 BHADMO Cc1cc(C[N@H+](C)[C@@H]2CC[C@@H](C)C2)cc(C)c1O ZINC000572709854 388369149 /nfs/dbraw/zinc/36/91/49/388369149.db2.gz VKLJMDMOTRUJME-IAQYHMDHSA-N 1 1 247.382 3.629 20 0 BHADMO Cc1cc(C[N@H+](C)[C@H]2CC[C@H](C)C2)cc(C)c1O ZINC000572709855 388368561 /nfs/dbraw/zinc/36/85/61/388368561.db2.gz VKLJMDMOTRUJME-NHYWBVRUSA-N 1 1 247.382 3.629 20 0 BHADMO Cc1cc(C[N@H+](C)[C@@H]2CC[C@H](C)C2)cc(C)c1O ZINC000572709856 323005834 /nfs/dbraw/zinc/00/58/34/323005834.db2.gz VKLJMDMOTRUJME-XHDPSFHLSA-N 1 1 247.382 3.629 20 0 BHADMO C[N@@H+](Cc1sccc1Cl)CC(C)(C)C ZINC000572733206 388372433 /nfs/dbraw/zinc/37/24/33/388372433.db2.gz HMAVDNINRNNGPA-UHFFFAOYSA-N 1 1 231.792 3.879 20 0 BHADMO C1=C[C@@H]([N@H+]2C[C@@H]3CCC[C@@H]3C2)CCCCC1 ZINC000572741148 388371536 /nfs/dbraw/zinc/37/15/36/388371536.db2.gz NKGNETXMZWHJFZ-QLFBSQMISA-N 1 1 219.372 3.607 20 0 BHADMO C1=C[C@H]([N@H+]2C[C@@H]3CCC[C@@H]3C2)CCCCC1 ZINC000572741149 388372040 /nfs/dbraw/zinc/37/20/40/388372040.db2.gz NKGNETXMZWHJFZ-ZNMIVQPWSA-N 1 1 219.372 3.607 20 0 BHADMO C[C@H]1CCC[C@@H](C[N@@H+](C)Cc2ccc(O)cc2)C1 ZINC000572745440 388372517 /nfs/dbraw/zinc/37/25/17/388372517.db2.gz SOZOJRIOEAXUHA-DZGCQCFKSA-N 1 1 247.382 3.650 20 0 BHADMO C[C@@H]1CCC[C@H](C[N@@H+](C)Cc2ccc(O)cc2)C1 ZINC000572745441 388372015 /nfs/dbraw/zinc/37/20/15/388372015.db2.gz SOZOJRIOEAXUHA-HIFRSBDPSA-N 1 1 247.382 3.650 20 0 BHADMO C[C@@H]1CCC[C@@H](C[N@@H+](C)Cc2ccc(O)cc2)C1 ZINC000572745442 388372543 /nfs/dbraw/zinc/37/25/43/388372543.db2.gz SOZOJRIOEAXUHA-UKRRQHHQSA-N 1 1 247.382 3.650 20 0 BHADMO C[C@H]1CCC[C@H](C[N@@H+](C)Cc2ccc(O)cc2)C1 ZINC000572745443 388372156 /nfs/dbraw/zinc/37/21/56/388372156.db2.gz SOZOJRIOEAXUHA-ZFWWWQNUSA-N 1 1 247.382 3.650 20 0 BHADMO CCCC[C@@H](C)[N@@H+](C)Cc1nc2ccccc2o1 ZINC000572804180 323102402 /nfs/dbraw/zinc/10/24/02/323102402.db2.gz ULEBZJSSGVHVOM-GFCCVEGCSA-N 1 1 246.354 3.838 20 0 BHADMO CCCC[C@H](C)[N@@H+](C)Cc1nc2ccccc2o1 ZINC000572804181 323102321 /nfs/dbraw/zinc/10/23/21/323102321.db2.gz ULEBZJSSGVHVOM-LBPRGKRZSA-N 1 1 246.354 3.838 20 0 BHADMO CC(C)C[N@@H+](C)C/C=C\c1ccc(F)c(F)c1 ZINC000572886605 388384414 /nfs/dbraw/zinc/38/44/14/388384414.db2.gz WGTKJRXBOVCCGH-PLNGDYQASA-N 1 1 239.309 3.566 20 0 BHADMO CC(C)C[N@@H+](C)C/C=C/c1ccc(F)c(F)c1 ZINC000572886606 388384569 /nfs/dbraw/zinc/38/45/69/388384569.db2.gz WGTKJRXBOVCCGH-SNAWJCMRSA-N 1 1 239.309 3.566 20 0 BHADMO CSC1(C[N@@H+](C)Cc2cc(C)cc(C)c2)CC1 ZINC000572886719 388384864 /nfs/dbraw/zinc/38/48/64/388384864.db2.gz BADKGBZDZDHOGF-UHFFFAOYSA-N 1 1 249.423 3.631 20 0 BHADMO CCC[N@@H+](Cc1ccc2ccccc2n1)C(C)C ZINC000572897785 388385925 /nfs/dbraw/zinc/38/59/25/388385925.db2.gz WWZKVTHHHHGCDI-UHFFFAOYSA-N 1 1 242.366 3.855 20 0 BHADMO CCC[N@@H+](CC1=Cc2ccccc2OC1)C(C)C ZINC000572899611 388385956 /nfs/dbraw/zinc/38/59/56/388385956.db2.gz FNKMNGNQZLPHCC-UHFFFAOYSA-N 1 1 245.366 3.583 20 0 BHADMO C[C@@H](c1ccc(Cl)cc1)[N@H+]1CCC[C@H]1CF ZINC000572989187 388403931 /nfs/dbraw/zinc/40/39/31/388403931.db2.gz CUWFFPQQROCDQW-GWCFXTLKSA-N 1 1 241.737 3.835 20 0 BHADMO C[C@@H](c1ccc(Cl)cc1)[N@@H+]1CCC[C@H]1CF ZINC000572989187 388403929 /nfs/dbraw/zinc/40/39/29/388403929.db2.gz CUWFFPQQROCDQW-GWCFXTLKSA-N 1 1 241.737 3.835 20 0 BHADMO C[C@@H](c1ccc(Cl)cc1)[N@H+]1CCC[C@@H]1CF ZINC000572989188 388403906 /nfs/dbraw/zinc/40/39/06/388403906.db2.gz CUWFFPQQROCDQW-GXFFZTMASA-N 1 1 241.737 3.835 20 0 BHADMO C[C@@H](c1ccc(Cl)cc1)[N@@H+]1CCC[C@@H]1CF ZINC000572989188 388403904 /nfs/dbraw/zinc/40/39/04/388403904.db2.gz CUWFFPQQROCDQW-GXFFZTMASA-N 1 1 241.737 3.835 20 0 BHADMO C[C@H](c1ccc(Cl)cc1)[N@H+]1CCC[C@H]1CF ZINC000572989189 388403689 /nfs/dbraw/zinc/40/36/89/388403689.db2.gz CUWFFPQQROCDQW-MFKMUULPSA-N 1 1 241.737 3.835 20 0 BHADMO C[C@H](c1ccc(Cl)cc1)[N@@H+]1CCC[C@H]1CF ZINC000572989189 388403686 /nfs/dbraw/zinc/40/36/86/388403686.db2.gz CUWFFPQQROCDQW-MFKMUULPSA-N 1 1 241.737 3.835 20 0 BHADMO C[C@H](c1ccc(Cl)cc1)[N@H+]1CCC[C@@H]1CF ZINC000572989190 388403516 /nfs/dbraw/zinc/40/35/16/388403516.db2.gz CUWFFPQQROCDQW-ZWNOBZJWSA-N 1 1 241.737 3.835 20 0 BHADMO C[C@H](c1ccc(Cl)cc1)[N@@H+]1CCC[C@@H]1CF ZINC000572989190 388403514 /nfs/dbraw/zinc/40/35/14/388403514.db2.gz CUWFFPQQROCDQW-ZWNOBZJWSA-N 1 1 241.737 3.835 20 0 BHADMO C[N@@H+](Cc1c(F)cccc1Cl)CC1(C)CC1 ZINC000573044439 388410984 /nfs/dbraw/zinc/41/09/84/388410984.db2.gz NLICQXOPKCKGHU-UHFFFAOYSA-N 1 1 241.737 3.711 20 0 BHADMO C[N@H+](Cc1c(F)cccc1Cl)CC1(C)CC1 ZINC000573044439 388410980 /nfs/dbraw/zinc/41/09/80/388410980.db2.gz NLICQXOPKCKGHU-UHFFFAOYSA-N 1 1 241.737 3.711 20 0 BHADMO CCC(C)(C)[C@@H]1CCC[N@H+]1Cc1ccncc1C ZINC000573058722 388414983 /nfs/dbraw/zinc/41/49/83/388414983.db2.gz YUJVGZKRVORPIL-HNNXBMFYSA-N 1 1 246.398 3.791 20 0 BHADMO CCC(C)(C)[C@H]1CCC[N@H+]1Cc1ccncc1C ZINC000573058723 388414138 /nfs/dbraw/zinc/41/41/38/388414138.db2.gz YUJVGZKRVORPIL-OAHLLOKOSA-N 1 1 246.398 3.791 20 0 BHADMO F[C@@]1(c2ccccc2)CC[N@H+]([C@@H]2C=CCCC2)C1 ZINC000573109722 388421125 /nfs/dbraw/zinc/42/11/25/388421125.db2.gz ZXBDIPQYWUFQCM-CVEARBPZSA-N 1 1 245.341 3.666 20 0 BHADMO F[C@@]1(c2ccccc2)CC[N@H+]([C@H]2C=CCCC2)C1 ZINC000573109724 388420803 /nfs/dbraw/zinc/42/08/03/388420803.db2.gz ZXBDIPQYWUFQCM-HOTGVXAUSA-N 1 1 245.341 3.666 20 0 BHADMO F[C@]1(c2ccccc2)CC[N@H+]([C@@H]2C=CCCC2)C1 ZINC000573109726 388420876 /nfs/dbraw/zinc/42/08/76/388420876.db2.gz ZXBDIPQYWUFQCM-HZPDHXFCSA-N 1 1 245.341 3.666 20 0 BHADMO F[C@]1(c2ccccc2)CC[N@H+]([C@H]2C=CCCC2)C1 ZINC000573109728 388420656 /nfs/dbraw/zinc/42/06/56/388420656.db2.gz ZXBDIPQYWUFQCM-JKSUJKDBSA-N 1 1 245.341 3.666 20 0 BHADMO CC[N@@H+](Cc1cccc(F)c1Cl)C1CCC1 ZINC000573109758 388420933 /nfs/dbraw/zinc/42/09/33/388420933.db2.gz LLLDTAYTCXSSCU-UHFFFAOYSA-N 1 1 241.737 3.854 20 0 BHADMO C[C@H](c1ccccc1Cl)[N@@H+]1C[C@@H]2[C@H](C1)C2(C)C ZINC000573174812 388427154 /nfs/dbraw/zinc/42/71/54/388427154.db2.gz KSFPTZLBGSHBPC-RTXFEEFZSA-N 1 1 249.785 3.989 20 0 BHADMO C[C@@H](c1ccccc1Cl)[N@@H+]1C[C@@H]2[C@H](C1)C2(C)C ZINC000573174813 388428060 /nfs/dbraw/zinc/42/80/60/388428060.db2.gz KSFPTZLBGSHBPC-WCFLWFBJSA-N 1 1 249.785 3.989 20 0 BHADMO C[N@@H+](Cc1ccc2ccccc2c1)CC1(F)CC1 ZINC000573177937 388428371 /nfs/dbraw/zinc/42/83/71/388428371.db2.gz BCGQHPHLMXIPOJ-UHFFFAOYSA-N 1 1 243.325 3.774 20 0 BHADMO CC[C@@H](c1ccccc1)[N@H+]1CC[C@@H](OC(C)C)C1 ZINC000573203081 388431582 /nfs/dbraw/zinc/43/15/82/388431582.db2.gz WHMZGXZFYSWZMZ-CVEARBPZSA-N 1 1 247.382 3.637 20 0 BHADMO CC[C@H](c1ccccc1)[N@H+]1CC[C@@H](OC(C)C)C1 ZINC000573203082 344012179 /nfs/dbraw/zinc/01/21/79/344012179.db2.gz WHMZGXZFYSWZMZ-HZPDHXFCSA-N 1 1 247.382 3.637 20 0 BHADMO CC[C@H](C)[N@H+]1CC[C@H](CSc2ccccc2)C1 ZINC000573240158 388434893 /nfs/dbraw/zinc/43/48/93/388434893.db2.gz KMTKTIAZQBWJJI-KBPBESRZSA-N 1 1 249.423 3.899 20 0 BHADMO CC[C@@H](C)[N@H+]1CC[C@H](CSc2ccccc2)C1 ZINC000573240159 388435002 /nfs/dbraw/zinc/43/50/02/388435002.db2.gz KMTKTIAZQBWJJI-KGLIPLIRSA-N 1 1 249.423 3.899 20 0 BHADMO CC[C@H](C)[N@H+]1CC[C@@H](CSc2ccccc2)C1 ZINC000573240160 388435054 /nfs/dbraw/zinc/43/50/54/388435054.db2.gz KMTKTIAZQBWJJI-UONOGXRCSA-N 1 1 249.423 3.899 20 0 BHADMO CC[C@@H](C)[N@H+]1CC[C@@H](CSc2ccccc2)C1 ZINC000573240161 388434410 /nfs/dbraw/zinc/43/44/10/388434410.db2.gz KMTKTIAZQBWJJI-ZIAGYGMSSA-N 1 1 249.423 3.899 20 0 BHADMO CCC(CC)[N@@H+](CC)CCc1ncc(C)cc1C ZINC000573241953 388434981 /nfs/dbraw/zinc/43/49/81/388434981.db2.gz VQDRODGQHLZDGU-UHFFFAOYSA-N 1 1 248.414 3.751 20 0 BHADMO CSC1(C[N@@H+](C)C2CCCCCC2)CC1 ZINC000573287453 388439625 /nfs/dbraw/zinc/43/96/25/388439625.db2.gz MUEBPWFFJYUWLL-UHFFFAOYSA-N 1 1 227.417 3.537 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COXOQNMAZPQEJR-YCPHGPKFSA-N 1 1 244.382 3.543 20 0 BHADMO Cc1cccc(C)c1C[NH2+][C@H](C)c1cscn1 ZINC000580789903 367168184 /nfs/dbraw/zinc/16/81/84/367168184.db2.gz KQUOKQVSCFGQBV-GFCCVEGCSA-N 1 1 246.379 3.611 20 0 BHADMO Cc1cccc(C)c1C[NH2+][C@@H](C)c1cscn1 ZINC000580789904 367167574 /nfs/dbraw/zinc/16/75/74/367167574.db2.gz KQUOKQVSCFGQBV-LBPRGKRZSA-N 1 1 246.379 3.611 20 0 BHADMO CCC(CC)[N@@H+](CCOC1CCC1)CC(C)C ZINC000580792065 367167838 /nfs/dbraw/zinc/16/78/38/367167838.db2.gz RVLCVNFMLAANAQ-UHFFFAOYSA-N 1 1 241.419 3.702 20 0 BHADMO C[C@H](Nc1cc(C2CC2)cc[nH+]1)c1ccoc1 ZINC000580803201 367168981 /nfs/dbraw/zinc/16/89/81/367168981.db2.gz CNKDXWNMYGQNLX-JTQLQIEISA-N 1 1 228.295 3.725 20 0 BHADMO C[C@@H](Nc1cc(C2CC2)cc[nH+]1)c1ccoc1 ZINC000580803202 367168881 /nfs/dbraw/zinc/16/88/81/367168881.db2.gz CNKDXWNMYGQNLX-SNVBAGLBSA-N 1 1 228.295 3.725 20 0 BHADMO Cc1cnccc1C[N@H+]1CCC[C@H]1CC(C)(C)C ZINC000580814211 367174173 /nfs/dbraw/zinc/17/41/73/367174173.db2.gz 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236.265 3.610 20 0 BHADMO CC[C@H]1CC[C@@H](C)[N@H+]1CCc1ncc(C)cc1C ZINC000581307768 367336196 /nfs/dbraw/zinc/33/61/96/367336196.db2.gz DMRXZEMEQIWUGA-CABCVRRESA-N 1 1 246.398 3.504 20 0 BHADMO CC[C@H]1CC[C@H](C)[N@H+]1CCc1ncc(C)cc1C ZINC000581307769 367337001 /nfs/dbraw/zinc/33/70/01/367337001.db2.gz DMRXZEMEQIWUGA-GJZGRUSLSA-N 1 1 246.398 3.504 20 0 BHADMO CC[C@@H]1CC[C@@H](C)[N@H+]1CCc1ncc(C)cc1C ZINC000581307770 367336429 /nfs/dbraw/zinc/33/64/29/367336429.db2.gz DMRXZEMEQIWUGA-HUUCEWRRSA-N 1 1 246.398 3.504 20 0 BHADMO CC[C@@H]1CC[C@H](C)[N@H+]1CCc1ncc(C)cc1C ZINC000581307771 367336549 /nfs/dbraw/zinc/33/65/49/367336549.db2.gz DMRXZEMEQIWUGA-LSDHHAIUSA-N 1 1 246.398 3.504 20 0 BHADMO CC(C)=CC[N@H+]1CC[C@H](c2ccc(F)cc2)C1 ZINC000581333470 367354792 /nfs/dbraw/zinc/35/47/92/367354792.db2.gz HSRYHNDIMQJBLJ-AWEZNQCLSA-N 1 1 233.330 3.581 20 0 BHADMO CC(C)=CC[N@H+]1CC[C@@H](c2ccc(F)cc2)C1 ZINC000581333471 367354717 /nfs/dbraw/zinc/35/47/17/367354717.db2.gz HSRYHNDIMQJBLJ-CQSZACIVSA-N 1 1 233.330 3.581 20 0 BHADMO Cc1ccccc1C[N@H+]1CC2(CCC2)[C@@H]1C1CC1 ZINC000581341984 344096229 /nfs/dbraw/zinc/09/62/29/344096229.db2.gz SAZKHZFSNZZJST-INIZCTEOSA-N 1 1 241.378 3.760 20 0 BHADMO Cc1ccccc1C[N@H+]1CC2(CCC2)[C@H]1C1CC1 ZINC000581341985 344096222 /nfs/dbraw/zinc/09/62/22/344096222.db2.gz SAZKHZFSNZZJST-MRXNPFEDSA-N 1 1 241.378 3.760 20 0 BHADMO CCC(CC)[N@@H+](CC)Cc1ccsc1 ZINC000581397024 367428646 /nfs/dbraw/zinc/42/86/46/367428646.db2.gz DKPBIXZYJWICMR-UHFFFAOYSA-N 1 1 211.374 3.759 20 0 BHADMO CCCC[C@H](C)[N@@H+](C)Cc1ccc(Cl)o1 ZINC000581411877 367451699 /nfs/dbraw/zinc/45/16/99/367451699.db2.gz XSQJIGHSACUCJJ-JTQLQIEISA-N 1 1 229.751 3.944 20 0 BHADMO CCCC[C@@H](C)[N@@H+](C)Cc1ccc(Cl)o1 ZINC000581411878 367451728 /nfs/dbraw/zinc/45/17/28/367451728.db2.gz XSQJIGHSACUCJJ-SNVBAGLBSA-N 1 1 229.751 3.944 20 0 BHADMO Cc1[nH+]ccn1C[C@@H]1CC[C@@H](c2ccccc2)C1 ZINC000581440915 367474271 /nfs/dbraw/zinc/47/42/71/367474271.db2.gz VYGZRUBFNGDFJA-GDBMZVCRSA-N 1 1 240.350 3.775 20 0 BHADMO CCC[N@@H+](CC)C[C@@H](C)c1ccccc1 ZINC000581451766 367477275 /nfs/dbraw/zinc/47/72/75/367477275.db2.gz RMMQXPRAUCIGNT-CYBMUJFWSA-N 1 1 205.345 3.522 20 0 BHADMO CCC[N@@H+](CC)C[C@H](C)c1ccccc1 ZINC000581451767 367477176 /nfs/dbraw/zinc/47/71/76/367477176.db2.gz RMMQXPRAUCIGNT-ZDUSSCGKSA-N 1 1 205.345 3.522 20 0 BHADMO Cc1ccccc1C[N@H+]1CC(C)(C)[C@@H]1C1CC1 ZINC000581460334 367481552 /nfs/dbraw/zinc/48/15/52/367481552.db2.gz KWBPISJVUURDFE-HNNXBMFYSA-N 1 1 229.367 3.615 20 0 BHADMO Cc1ccccc1C[N@H+]1CC(C)(C)[C@H]1C1CC1 ZINC000581460335 367481348 /nfs/dbraw/zinc/48/13/48/367481348.db2.gz KWBPISJVUURDFE-OAHLLOKOSA-N 1 1 229.367 3.615 20 0 BHADMO C[C@@H]1C[N@@H+](CCCc2ccccc2Cl)[C@H]1C ZINC000581477148 367511158 /nfs/dbraw/zinc/51/11/58/367511158.db2.gz XEYLUHKPLXRXSJ-NEPJUHHUSA-N 1 1 237.774 3.613 20 0 BHADMO C[C@@H]1[C@@H](C)C[N@H+]1CCCc1ccccc1Cl ZINC000581477149 367510967 /nfs/dbraw/zinc/51/09/67/367510967.db2.gz XEYLUHKPLXRXSJ-NWDGAFQWSA-N 1 1 237.774 3.613 20 0 BHADMO C[C@H]1C[N@@H+](CCCc2ccccc2Cl)[C@H]1C ZINC000581477150 367511033 /nfs/dbraw/zinc/51/10/33/367511033.db2.gz XEYLUHKPLXRXSJ-RYUDHWBXSA-N 1 1 237.774 3.613 20 0 BHADMO C[C@@H]1C[N@@H+](CCCc2ccccc2Cl)[C@@H]1C ZINC000581477151 367510662 /nfs/dbraw/zinc/51/06/62/367510662.db2.gz XEYLUHKPLXRXSJ-VXGBXAGGSA-N 1 1 237.774 3.613 20 0 BHADMO Cc1ccc2cc[nH+]c(N3CC=C(C)CC3)c2c1 ZINC000581545056 367571359 /nfs/dbraw/zinc/57/13/59/367571359.db2.gz YONUJVNINWNEGA-UHFFFAOYSA-N 1 1 238.334 3.700 20 0 BHADMO CC[C@@H]1CC[C@@H](C)[N@H+]1CCCc1ccc(C)nc1 ZINC000581575611 367600671 /nfs/dbraw/zinc/60/06/71/367600671.db2.gz YAKPNWGYESOFFP-GDBMZVCRSA-N 1 1 246.398 3.586 20 0 BHADMO CC[C@@H]1CC[C@H](C)[N@H+]1CCCc1ccc(C)nc1 ZINC000581575612 367601004 /nfs/dbraw/zinc/60/10/04/367601004.db2.gz YAKPNWGYESOFFP-GOEBONIOSA-N 1 1 246.398 3.586 20 0 BHADMO CC[C@H]1CC[C@H](C)[N@H+]1CCCc1ccc(C)nc1 ZINC000581575613 367600499 /nfs/dbraw/zinc/60/04/99/367600499.db2.gz YAKPNWGYESOFFP-HOCLYGCPSA-N 1 1 246.398 3.586 20 0 BHADMO CC[C@H]1CC[C@@H](C)[N@H+]1CCCc1ccc(C)nc1 ZINC000581575614 367601161 /nfs/dbraw/zinc/60/11/61/367601161.db2.gz YAKPNWGYESOFFP-ZBFHGGJFSA-N 1 1 246.398 3.586 20 0 BHADMO CC[C@H](c1ccc(F)cc1F)[N@H+]1C[C@@H](C)[C@H]1C ZINC000581596413 348653639 /nfs/dbraw/zinc/65/36/39/348653639.db2.gz YGYOHMMRABVBGE-GPCCPHFNSA-N 1 1 239.309 3.756 20 0 BHADMO CC[C@H](c1ccc(F)cc1F)[N@H+]1C[C@H](C)[C@H]1C ZINC000581596414 348653280 /nfs/dbraw/zinc/65/32/80/348653280.db2.gz YGYOHMMRABVBGE-IMSIIYSGSA-N 1 1 239.309 3.756 20 0 BHADMO CC[C@H](c1ccc(F)cc1F)[N@H+]1C[C@@H](C)[C@@H]1C ZINC000581596415 348653982 /nfs/dbraw/zinc/65/39/82/348653982.db2.gz YGYOHMMRABVBGE-ISTVAULSSA-N 1 1 239.309 3.756 20 0 BHADMO CC[C@H](c1ccc(F)cc1F)[N@H+]1C[C@H](C)[C@@H]1C ZINC000581596416 348653976 /nfs/dbraw/zinc/65/39/76/348653976.db2.gz YGYOHMMRABVBGE-PKFCDNJMSA-N 1 1 239.309 3.756 20 0 BHADMO CCc1ccc(C[N@H+]2CCCCC(C)(C)C2)nc1 ZINC000581620865 367639224 /nfs/dbraw/zinc/63/92/24/367639224.db2.gz QMDGSEMIFZQEMO-UHFFFAOYSA-N 1 1 246.398 3.656 20 0 BHADMO c1cc(CCC[N@H+]2CCC[C@H]3CCC[C@@H]32)cs1 ZINC000581628611 367643608 /nfs/dbraw/zinc/64/36/08/367643608.db2.gz HZPYBPMTRVUAIB-CABCVRRESA-N 1 1 249.423 3.945 20 0 BHADMO c1cc(CCC[N@H+]2CCC[C@@H]3CCC[C@@H]32)cs1 ZINC000581628612 367642888 /nfs/dbraw/zinc/64/28/88/367642888.db2.gz HZPYBPMTRVUAIB-GJZGRUSLSA-N 1 1 249.423 3.945 20 0 BHADMO c1cc(CCC[N@H+]2CCC[C@H]3CCC[C@H]32)cs1 ZINC000581628613 367642647 /nfs/dbraw/zinc/64/26/47/367642647.db2.gz HZPYBPMTRVUAIB-HUUCEWRRSA-N 1 1 249.423 3.945 20 0 BHADMO c1cc(CCC[N@H+]2CCC[C@@H]3CCC[C@H]32)cs1 ZINC000581628614 367643113 /nfs/dbraw/zinc/64/31/13/367643113.db2.gz HZPYBPMTRVUAIB-LSDHHAIUSA-N 1 1 249.423 3.945 20 0 BHADMO CCC[N@@H+](Cc1ccc(SC)s1)C1CC1 ZINC000581639559 367644899 /nfs/dbraw/zinc/64/48/99/367644899.db2.gz VEAPTUDKANQCDR-UHFFFAOYSA-N 1 1 241.425 3.844 20 0 BHADMO CC1(C)CC[N@H+]1Cc1ccc(C(F)(F)F)s1 ZINC000581644793 367649317 /nfs/dbraw/zinc/64/93/17/367649317.db2.gz TXZDVZAQTUTOBP-UHFFFAOYSA-N 1 1 249.301 3.751 20 0 BHADMO CC1(C)CC[N@@H+]1Cc1ccc(C(F)(F)F)s1 ZINC000581644793 367649309 /nfs/dbraw/zinc/64/93/09/367649309.db2.gz TXZDVZAQTUTOBP-UHFFFAOYSA-N 1 1 249.301 3.751 20 0 BHADMO CC/C=C\CC[N@H+]1CC[C@@H](c2cc(C)ccn2)C1 ZINC000581675434 367704846 /nfs/dbraw/zinc/70/48/46/367704846.db2.gz SLIHUAWRJXYQEE-FOSCPCJNSA-N 1 1 244.382 3.536 20 0 BHADMO CC/C=C/CC[N@H+]1CC[C@@H](c2cc(C)ccn2)C1 ZINC000581675435 367705074 /nfs/dbraw/zinc/70/50/74/367705074.db2.gz SLIHUAWRJXYQEE-MBVDDHJVSA-N 1 1 244.382 3.536 20 0 BHADMO CC/C=C/CC[N@H+]1CC[C@H](c2cc(C)ccn2)C1 ZINC000581675436 367704727 /nfs/dbraw/zinc/70/47/27/367704727.db2.gz SLIHUAWRJXYQEE-RGDDUWESSA-N 1 1 244.382 3.536 20 0 BHADMO CC/C=C\CC[N@H+]1CC[C@H](c2cc(C)ccn2)C1 ZINC000581675437 367703959 /nfs/dbraw/zinc/70/39/59/367703959.db2.gz SLIHUAWRJXYQEE-XVWMLYKFSA-N 1 1 244.382 3.536 20 0 BHADMO CC[C@@H]1CCC[N@@H+](CCCCCF)CC1 ZINC000581681885 367708566 /nfs/dbraw/zinc/70/85/66/367708566.db2.gz MCFVMWILYVGBGV-CYBMUJFWSA-N 1 1 215.356 3.638 20 0 BHADMO CC[C@H]1CCC[N@@H+](CCCCCF)CC1 ZINC000581681886 367708581 /nfs/dbraw/zinc/70/85/81/367708581.db2.gz MCFVMWILYVGBGV-ZDUSSCGKSA-N 1 1 215.356 3.638 20 0 BHADMO CC1(C[N@H+]2CC(C)(C)[C@H]2c2cccs2)CC1 ZINC000581694174 367715609 /nfs/dbraw/zinc/71/56/09/367715609.db2.gz GQDSSPJJPPRLMX-GFCCVEGCSA-N 1 1 235.396 3.931 20 0 BHADMO CC1(C[N@H+]2CC(C)(C)[C@@H]2c2cccs2)CC1 ZINC000581694175 367715578 /nfs/dbraw/zinc/71/55/78/367715578.db2.gz GQDSSPJJPPRLMX-LBPRGKRZSA-N 1 1 235.396 3.931 20 0 BHADMO CC[C@H](C)[N@@H+](C)C/C=C\c1ccc(F)cc1F ZINC000581694882 367715179 /nfs/dbraw/zinc/71/51/79/367715179.db2.gz LEKUPDMNSGXRKA-GZTOBOFZSA-N 1 1 239.309 3.708 20 0 BHADMO CC[C@@H](C)[N@@H+](C)C/C=C\c1ccc(F)cc1F ZINC000581694883 367715370 /nfs/dbraw/zinc/71/53/70/367715370.db2.gz LEKUPDMNSGXRKA-ISALQUGTSA-N 1 1 239.309 3.708 20 0 BHADMO CC[C@@H](C)[N@@H+](C)C/C=C/c1ccc(F)cc1F ZINC000581694884 367715127 /nfs/dbraw/zinc/71/51/27/367715127.db2.gz LEKUPDMNSGXRKA-MVIFTORASA-N 1 1 239.309 3.708 20 0 BHADMO 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C[C@@H]1CCC[C@@H](C[N@H+]2CCC(F)(F)[C@H](C)C2)C1 ZINC000582515175 357324641 /nfs/dbraw/zinc/32/46/41/357324641.db2.gz CSLPKHCJZISOLE-JHJVBQTASA-N 1 1 245.357 3.790 20 0 BHADMO C[C@@H]1CCC[C@H](C[N@H+]2CCC(F)(F)[C@H](C)C2)C1 ZINC000582515176 357324767 /nfs/dbraw/zinc/32/47/67/357324767.db2.gz CSLPKHCJZISOLE-UPJWGTAASA-N 1 1 245.357 3.790 20 0 BHADMO CC(C)COc1ccccc1C[N@@H+](C)CC(C)C ZINC000582534352 357336621 /nfs/dbraw/zinc/33/66/21/357336621.db2.gz OSUWKGKLLNVYOJ-UHFFFAOYSA-N 1 1 249.398 3.809 20 0 BHADMO C[C@H](c1ccccc1)[N@@H+](C)CC1(C)CCC1 ZINC000582597082 357346687 /nfs/dbraw/zinc/34/66/87/357346687.db2.gz WXKPRVYTRSXEQL-CYBMUJFWSA-N 1 1 217.356 3.870 20 0 BHADMO C[C@@H](c1ccccc1)[N@@H+](C)CC1(C)CCC1 ZINC000582597085 357346387 /nfs/dbraw/zinc/34/63/87/357346387.db2.gz WXKPRVYTRSXEQL-ZDUSSCGKSA-N 1 1 217.356 3.870 20 0 BHADMO CC1(C)CC[N@H+]([C@@H]2C=CCCCCC2)C1 ZINC000582620005 357355131 /nfs/dbraw/zinc/35/51/31/357355131.db2.gz XKSGJSYQUYLNND-CYBMUJFWSA-N 1 1 207.361 3.607 20 0 BHADMO CC1(C)CC[N@H+]([C@H]2C=CCCCCC2)C1 ZINC000582620006 357354921 /nfs/dbraw/zinc/35/49/21/357354921.db2.gz XKSGJSYQUYLNND-ZDUSSCGKSA-N 1 1 207.361 3.607 20 0 BHADMO COc1cc(Cl)ccc1C[N@@H+](C)C(C)(C)C ZINC000582664103 357357248 /nfs/dbraw/zinc/35/72/48/357357248.db2.gz ZHRFPGRFAAUKHG-UHFFFAOYSA-N 1 1 241.762 3.579 20 0 BHADMO C[C@@H]1C[C@H](C)[N@@H+]1CCc1ccc(F)cc1Cl ZINC000582757590 357381516 /nfs/dbraw/zinc/38/15/16/357381516.db2.gz PODFVZWRPNQTHA-AOOOYVTPSA-N 1 1 241.737 3.504 20 0 BHADMO CC[N@@H+](Cc1ccc(Cl)cn1)CC(C)(C)C ZINC000582777230 398045391 /nfs/dbraw/zinc/04/53/91/398045391.db2.gz CGRQBRQCPRESIM-UHFFFAOYSA-N 1 1 240.778 3.603 20 0 BHADMO C[C@H](C1CCCCC1)[N@@H+](C)CCC1CC1 ZINC000582848139 357417948 /nfs/dbraw/zinc/41/79/48/357417948.db2.gz HNAOMPZJBAHXIR-GFCCVEGCSA-N 1 1 209.377 3.687 20 0 BHADMO CSCCC[N@@H+](C)[C@H](C)C1CCCCC1 ZINC000582857876 357415933 /nfs/dbraw/zinc/41/59/33/357415933.db2.gz JUMVBPABZSKBGK-GFCCVEGCSA-N 1 1 229.433 3.640 20 0 BHADMO C[C@H](CCc1cccc(F)c1)[N@@H+](C)[C@H](C)C1CC1 ZINC000582866263 357417178 /nfs/dbraw/zinc/41/71/78/357417178.db2.gz GCNUCELGYGAPBP-CHWSQXEVSA-N 1 1 249.373 3.877 20 0 BHADMO C[C@H](CCc1cccc(F)c1)[N@@H+](C)[C@@H](C)C1CC1 ZINC000582866264 357417088 /nfs/dbraw/zinc/41/70/88/357417088.db2.gz GCNUCELGYGAPBP-OLZOCXBDSA-N 1 1 249.373 3.877 20 0 BHADMO C[C@H](C1CC1)[N@H+](C)[C@@H](C)CCc1cccc(F)c1 ZINC000582866266 357416794 /nfs/dbraw/zinc/41/67/94/357416794.db2.gz GCNUCELGYGAPBP-QWHCGFSZSA-N 1 1 249.373 3.877 20 0 BHADMO C[C@@H](CCc1cccc(F)c1)[N@@H+](C)[C@@H](C)C1CC1 ZINC000582866267 357417042 /nfs/dbraw/zinc/41/70/42/357417042.db2.gz GCNUCELGYGAPBP-STQMWFEESA-N 1 1 249.373 3.877 20 0 BHADMO CCC[C@@H]1CCCC[N@H+]1C[C@@H](C)C(F)(F)F ZINC000582897654 357425092 /nfs/dbraw/zinc/42/50/92/357425092.db2.gz KJDZYHKXIHHXFL-GHMZBOCLSA-N 1 1 237.309 3.839 20 0 BHADMO CCC[C@H]1CCCC[N@H+]1C[C@@H](C)C(F)(F)F ZINC000582897655 357424840 /nfs/dbraw/zinc/42/48/40/357424840.db2.gz KJDZYHKXIHHXFL-MNOVXSKESA-N 1 1 237.309 3.839 20 0 BHADMO CCC[C@H]1CCCC[N@H+]1C[C@H](C)C(F)(F)F ZINC000582897656 357425362 /nfs/dbraw/zinc/42/53/62/357425362.db2.gz KJDZYHKXIHHXFL-QWRGUYRKSA-N 1 1 237.309 3.839 20 0 BHADMO CCC[C@@H]1CCCC[N@H+]1C[C@H](C)C(F)(F)F ZINC000582897657 357424775 /nfs/dbraw/zinc/42/47/75/357424775.db2.gz KJDZYHKXIHHXFL-WDEREUQCSA-N 1 1 237.309 3.839 20 0 BHADMO CS[C@H]1CC[C@@H]1Nc1cccc2cc[nH+]cc21 ZINC000582900623 357425850 /nfs/dbraw/zinc/42/58/50/357425850.db2.gz RBNIHASZCVWPID-KBPBESRZSA-N 1 1 244.363 3.541 20 0 BHADMO CS[C@H]1CC[C@H]1Nc1cccc2cc[nH+]cc21 ZINC000582900630 357426379 /nfs/dbraw/zinc/42/63/79/357426379.db2.gz RBNIHASZCVWPID-KGLIPLIRSA-N 1 1 244.363 3.541 20 0 BHADMO CS[C@@H]1CC[C@@H]1Nc1cccc2cc[nH+]cc21 ZINC000582900632 357426212 /nfs/dbraw/zinc/42/62/12/357426212.db2.gz RBNIHASZCVWPID-UONOGXRCSA-N 1 1 244.363 3.541 20 0 BHADMO CS[C@@H]1CC[C@H]1Nc1cccc2cc[nH+]cc21 ZINC000582900635 357426387 /nfs/dbraw/zinc/42/63/87/357426387.db2.gz RBNIHASZCVWPID-ZIAGYGMSSA-N 1 1 244.363 3.541 20 0 BHADMO CCC(C)(C)[C@H]1CCC[N@H+]1CC1(SC)CC1 ZINC000582912113 357434674 /nfs/dbraw/zinc/43/46/74/357434674.db2.gz RAKNDSROHJECFD-GFCCVEGCSA-N 1 1 241.444 3.783 20 0 BHADMO CCC(C)(C)[C@@H]1CCC[N@H+]1CC1(SC)CC1 ZINC000582912114 357434029 /nfs/dbraw/zinc/43/40/29/357434029.db2.gz RAKNDSROHJECFD-LBPRGKRZSA-N 1 1 241.444 3.783 20 0 BHADMO CCC(CC)[N@@H+](CC)Cc1ccc(C)o1 ZINC000582932839 357432825 /nfs/dbraw/zinc/43/28/25/357432825.db2.gz VGPIMNQJSAGDQS-UHFFFAOYSA-N 1 1 209.333 3.599 20 0 BHADMO CCCn1ccc(C[N@@H+](C)[C@H](C)C(C)(C)C)c1 ZINC000582939926 357441454 /nfs/dbraw/zinc/44/14/54/357441454.db2.gz MVNLSGJVIUWBBY-CYBMUJFWSA-N 1 1 236.403 3.765 20 0 BHADMO CCCn1ccc(C[N@@H+](C)[C@@H](C)C(C)(C)C)c1 ZINC000582939927 357441588 /nfs/dbraw/zinc/44/15/88/357441588.db2.gz MVNLSGJVIUWBBY-ZDUSSCGKSA-N 1 1 236.403 3.765 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@H](C)C2CC2)c(Cl)c1 ZINC000582944148 357442597 /nfs/dbraw/zinc/44/25/97/357442597.db2.gz OCXJRMJZKJJNOL-LLVKDONJSA-N 1 1 237.774 3.879 20 0 BHADMO 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HFQPDCATEBDQFZ-UHFFFAOYSA-N 1 1 246.741 3.964 20 0 BHADMO Cc1ccc(C[N@H+](CC(C)C)C2CC2)c(C)c1 ZINC000583161149 357498411 /nfs/dbraw/zinc/49/84/11/357498411.db2.gz KEXNCFJOHJZQCM-UHFFFAOYSA-N 1 1 231.383 3.924 20 0 BHADMO CC(C)[C@H]1CC[N@H+]1C[C@H](C)c1ccccc1 ZINC000583184006 357511120 /nfs/dbraw/zinc/51/11/20/357511120.db2.gz VWNSAKYAGQRJQK-DZGCQCFKSA-N 1 1 217.356 3.520 20 0 BHADMO CC(C)[C@@H]1CC[N@H+]1C[C@@H](C)c1ccccc1 ZINC000583184007 357510622 /nfs/dbraw/zinc/51/06/22/357510622.db2.gz VWNSAKYAGQRJQK-HIFRSBDPSA-N 1 1 217.356 3.520 20 0 BHADMO CC(C)[C@H]1CC[N@H+]1C[C@@H](C)c1ccccc1 ZINC000583184008 357511137 /nfs/dbraw/zinc/51/11/37/357511137.db2.gz VWNSAKYAGQRJQK-UKRRQHHQSA-N 1 1 217.356 3.520 20 0 BHADMO CC(C)[C@@H]1CC[N@H+]1C[C@H](C)c1ccccc1 ZINC000583184009 357511071 /nfs/dbraw/zinc/51/10/71/357511071.db2.gz VWNSAKYAGQRJQK-ZFWWWQNUSA-N 1 1 217.356 3.520 20 0 BHADMO C[N@@H+](Cc1ccco1)[C@@H]1C=CCCCCC1 ZINC000583217141 357587243 /nfs/dbraw/zinc/58/72/43/357587243.db2.gz NQNNXGWWYIDTBS-CYBMUJFWSA-N 1 1 219.328 3.600 20 0 BHADMO C[N@@H+](Cc1ccco1)[C@H]1C=CCCCCC1 ZINC000583217142 357587260 /nfs/dbraw/zinc/58/72/60/357587260.db2.gz NQNNXGWWYIDTBS-ZDUSSCGKSA-N 1 1 219.328 3.600 20 0 BHADMO Cc1cnccc1C[N@H+]1CCC[C@H]1C1CCCC1 ZINC000583303022 357888765 /nfs/dbraw/zinc/88/87/65/357888765.db2.gz OUJQONRLNQVJQJ-INIZCTEOSA-N 1 1 244.382 3.545 20 0 BHADMO Cc1cnccc1C[N@H+]1CCC[C@@H]1C1CCCC1 ZINC000583303023 357889087 /nfs/dbraw/zinc/88/90/87/357889087.db2.gz OUJQONRLNQVJQJ-MRXNPFEDSA-N 1 1 244.382 3.545 20 0 BHADMO CC[C@@H](C)[N@H+]1CCc2sc(Cl)cc2C1 ZINC000583319949 357902398 /nfs/dbraw/zinc/90/23/98/357902398.db2.gz RGKQDRGSHJLJAI-MRVPVSSYSA-N 1 1 229.776 3.558 20 0 BHADMO CC[C@H](C)[N@H+]1CCc2sc(Cl)cc2C1 ZINC000583319950 357902148 /nfs/dbraw/zinc/90/21/48/357902148.db2.gz RGKQDRGSHJLJAI-QMMMGPOBSA-N 1 1 229.776 3.558 20 0 BHADMO CCC(CC)[N@@H+](CC)CCCC1CCOCC1 ZINC000583345935 344716234 /nfs/dbraw/zinc/71/62/34/344716234.db2.gz XXILFVNQWQTGPF-UHFFFAOYSA-N 1 1 241.419 3.704 20 0 BHADMO CSC1(C[N@@H+](C)C[C@@H](C)c2ccccc2)CC1 ZINC000583348325 344739171 /nfs/dbraw/zinc/73/91/71/344739171.db2.gz JGJLFOUUOXJXAQ-CYBMUJFWSA-N 1 1 249.423 3.618 20 0 BHADMO CSC1(C[N@@H+](C)C[C@H](C)c2ccccc2)CC1 ZINC000583348326 344739156 /nfs/dbraw/zinc/73/91/56/344739156.db2.gz JGJLFOUUOXJXAQ-ZDUSSCGKSA-N 1 1 249.423 3.618 20 0 BHADMO C[C@@H](c1ccccc1)[N@@H+](C[C@@H]1C[C@H]1C)C1CC1 ZINC000583348984 344741102 /nfs/dbraw/zinc/74/11/02/344741102.db2.gz PCZSMKVRQNJWBV-IPYPFGDCSA-N 1 1 229.367 3.868 20 0 BHADMO C[C@H](c1ccccc1)[N@@H+](C[C@@H]1C[C@H]1C)C1CC1 ZINC000583348985 344741055 /nfs/dbraw/zinc/74/10/55/344741055.db2.gz PCZSMKVRQNJWBV-NFAWXSAZSA-N 1 1 229.367 3.868 20 0 BHADMO C[C@H](c1ccccc1)[N@@H+](C[C@H]1C[C@H]1C)C1CC1 ZINC000583348986 344740844 /nfs/dbraw/zinc/74/08/44/344740844.db2.gz PCZSMKVRQNJWBV-UMVBOHGHSA-N 1 1 229.367 3.868 20 0 BHADMO C[C@@H](c1ccccc1)[N@@H+](C[C@H]1C[C@H]1C)C1CC1 ZINC000583348987 344740999 /nfs/dbraw/zinc/74/09/99/344740999.db2.gz PCZSMKVRQNJWBV-VNHYZAJKSA-N 1 1 229.367 3.868 20 0 BHADMO CSC1(C[N@H+]2CCC[C@@H]2C(C)(C)C)CCC1 ZINC000583353237 344749311 /nfs/dbraw/zinc/74/93/11/344749311.db2.gz IHILAUMHQQHIAW-GFCCVEGCSA-N 1 1 241.444 3.783 20 0 BHADMO CSC1(C[N@H+]2CCC[C@H]2C(C)(C)C)CCC1 ZINC000583353238 344749503 /nfs/dbraw/zinc/74/95/03/344749503.db2.gz IHILAUMHQQHIAW-LBPRGKRZSA-N 1 1 241.444 3.783 20 0 BHADMO C[C@@H](C1CC1)[N@@H+](C)CCCCOc1ccccc1 ZINC000583354560 344749690 /nfs/dbraw/zinc/74/96/90/344749690.db2.gz XVKQFIBILGRIHB-AWEZNQCLSA-N 1 1 247.382 3.576 20 0 BHADMO C[C@H](C1CC1)[N@@H+](C)CCCCOc1ccccc1 ZINC000583354561 344749216 /nfs/dbraw/zinc/74/92/16/344749216.db2.gz XVKQFIBILGRIHB-CQSZACIVSA-N 1 1 247.382 3.576 20 0 BHADMO CCc1nc(C(C)C)ccc1C[N@H+](CC)C(C)C ZINC000583394091 344882077 /nfs/dbraw/zinc/88/20/77/344882077.db2.gz KRLGZCWOWMVLPB-UHFFFAOYSA-N 1 1 248.414 3.998 20 0 BHADMO CC[C@@H]1CC[C@@H](C)[N@H+]1Cc1ccc(Cl)o1 ZINC000583468405 349230033 /nfs/dbraw/zinc/23/00/33/349230033.db2.gz UBYVVZFQRBEEBB-NXEZZACHSA-N 1 1 227.735 3.696 20 0 BHADMO CC[C@H]1CC[C@H](C)[N@H+]1Cc1ccc(Cl)o1 ZINC000583468406 349229684 /nfs/dbraw/zinc/22/96/84/349229684.db2.gz UBYVVZFQRBEEBB-UWVGGRQHSA-N 1 1 227.735 3.696 20 0 BHADMO CC[C@@H]1CC[C@H](C)[N@H+]1Cc1ccc(Cl)o1 ZINC000583468407 349229583 /nfs/dbraw/zinc/22/95/83/349229583.db2.gz UBYVVZFQRBEEBB-VHSXEESVSA-N 1 1 227.735 3.696 20 0 BHADMO CC[C@H]1CC[C@@H](C)[N@H+]1Cc1ccc(Cl)o1 ZINC000583468408 349229820 /nfs/dbraw/zinc/22/98/20/349229820.db2.gz UBYVVZFQRBEEBB-ZJUUUORDSA-N 1 1 227.735 3.696 20 0 BHADMO Cc1ccccc1[C@H]1CC[N@@H+](CC2(C)CC2)C1 ZINC000583476396 349284515 /nfs/dbraw/zinc/28/45/15/349284515.db2.gz QTWTWVWDCLBJRY-AWEZNQCLSA-N 1 1 229.367 3.584 20 0 BHADMO Cc1ccccc1[C@@H]1CC[N@@H+](CC2(C)CC2)C1 ZINC000583476397 349284365 /nfs/dbraw/zinc/28/43/65/349284365.db2.gz QTWTWVWDCLBJRY-CQSZACIVSA-N 1 1 229.367 3.584 20 0 BHADMO CCC[C@H]1CCCC[N@H+]1Cc1ccncc1C ZINC000583480647 351143813 /nfs/dbraw/zinc/14/38/13/351143813.db2.gz BRHPWRHOVBMCII-HNNXBMFYSA-N 1 1 232.371 3.545 20 0 BHADMO CCC[C@@H]1CCCC[N@H+]1Cc1ccncc1C ZINC000583480648 351143888 /nfs/dbraw/zinc/14/38/88/351143888.db2.gz BRHPWRHOVBMCII-OAHLLOKOSA-N 1 1 232.371 3.545 20 0 BHADMO CCC[N@@H+](Cc1ccc(F)cc1)[C@H](C)CC ZINC000583517791 355383942 /nfs/dbraw/zinc/38/39/42/355383942.db2.gz OJHCULWFCKXSPH-GFCCVEGCSA-N 1 1 223.335 3.836 20 0 BHADMO CCC[N@@H+](Cc1ccc(F)cc1)[C@@H](C)CC ZINC000583517792 355383934 /nfs/dbraw/zinc/38/39/34/355383934.db2.gz OJHCULWFCKXSPH-LBPRGKRZSA-N 1 1 223.335 3.836 20 0 BHADMO CSC1(C[N@@H+]2CC=C(C(C)(C)C)CC2)CC1 ZINC000583526339 355388802 /nfs/dbraw/zinc/38/88/02/355388802.db2.gz HSUDHGOQCZQRGP-UHFFFAOYSA-N 1 1 239.428 3.560 20 0 BHADMO CCCC[C@@H](C)[N@@H+](C)C[C@@H](C)C(F)(F)F ZINC000583534210 355396541 /nfs/dbraw/zinc/39/65/41/355396541.db2.gz CXOJBCQAIKTXHT-NXEZZACHSA-N 1 1 225.298 3.695 20 0 BHADMO CCCC[C@H](C)[N@@H+](C)C[C@H](C)C(F)(F)F ZINC000583534211 355396067 /nfs/dbraw/zinc/39/60/67/355396067.db2.gz 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346645023 /nfs/dbraw/zinc/64/50/23/346645023.db2.gz XQPOQJYSPIEOFN-UHFFFAOYSA-N 1 1 249.741 3.955 20 0 BHADMO CC[N@@H+](Cc1ccoc1)Cc1cc(C)cc(C)c1 ZINC000588236570 346648507 /nfs/dbraw/zinc/64/85/07/346648507.db2.gz IQGKXBMEKAJWIW-UHFFFAOYSA-N 1 1 243.350 3.919 20 0 BHADMO CC[N@@H+](C/C=C/c1ccccc1)Cc1ccoc1 ZINC000588236685 346648982 /nfs/dbraw/zinc/64/89/82/346648982.db2.gz XWUKTSKNFPCUMS-RMKNXTFCSA-N 1 1 241.334 3.815 20 0 BHADMO CC[N@@H+](C/C=C\c1ccccc1)Cc1ccoc1 ZINC000588236686 346648736 /nfs/dbraw/zinc/64/87/36/346648736.db2.gz XWUKTSKNFPCUMS-TWGQIWQCSA-N 1 1 241.334 3.815 20 0 BHADMO CC/C=C\CC[N@@H+]1CCC[C@@H](OCCC)CC1 ZINC000588475976 538852571 /nfs/dbraw/zinc/85/25/71/538852571.db2.gz RZPGGFMUODBVSZ-IYKSTZQJSA-N 1 1 239.403 3.624 20 0 BHADMO CC/C=C\CC[N@@H+]1CCC[C@H](OCCC)CC1 ZINC000588475977 538853022 /nfs/dbraw/zinc/85/30/22/538853022.db2.gz RZPGGFMUODBVSZ-YVACAVLKSA-N 1 1 239.403 3.624 20 0 BHADMO CC[C@H]1CCCC[N@H+]1Cc1cc(C)ccc1OC ZINC000588770284 344187049 /nfs/dbraw/zinc/18/70/49/344187049.db2.gz SMKRBSKKCVWIJQ-HNNXBMFYSA-N 1 1 247.382 3.768 20 0 BHADMO Cc1cc(C)cc(OCC[N@@H+]2CCCC[C@@H]2C)c1 ZINC000588779018 344188028 /nfs/dbraw/zinc/18/80/28/344188028.db2.gz TUERUUUSWIHOSD-HNNXBMFYSA-N 1 1 247.382 3.557 20 0 BHADMO Cc1ccccc1OCCC[N@H+](C)CC(C)(C)C ZINC000588900969 344197839 /nfs/dbraw/zinc/19/78/39/344197839.db2.gz BJOPGPWVEBQPRV-UHFFFAOYSA-N 1 1 249.398 3.742 20 0 BHADMO CC(C)Oc1ccccc1C[N@@H+](C)CC(C)(C)C ZINC000588901055 344197974 /nfs/dbraw/zinc/19/79/74/344197974.db2.gz NDEIJVVWUMAABB-UHFFFAOYSA-N 1 1 249.398 3.952 20 0 BHADMO C[N@@H+](CCCc1ccccc1)CC(C)(C)C ZINC000588901787 344198406 /nfs/dbraw/zinc/19/84/06/344198406.db2.gz JKQMDJZJLVPJKY-UHFFFAOYSA-N 1 1 219.372 3.597 20 0 BHADMO C[N@@H+](Cc1ccc(F)cc1Cl)CC(C)(C)C ZINC000588902031 344198624 /nfs/dbraw/zinc/19/86/24/344198624.db2.gz CCCRTHYEZYWDPN-UHFFFAOYSA-N 1 1 243.753 3.957 20 0 BHADMO Cc1ccc(C)c(C[N@H+](C)CC(C)(C)C)c1 ZINC000588902267 344198668 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KLUYPOAOXCBLLW-INIZCTEOSA-N 1 1 231.383 3.740 20 0 BHADMO CC(C)C[N@H+]1CCCC[C@@H]1Cc1ccccc1 ZINC000589151198 346668725 /nfs/dbraw/zinc/66/87/25/346668725.db2.gz KLUYPOAOXCBLLW-MRXNPFEDSA-N 1 1 231.383 3.740 20 0 BHADMO CCc1ccc(C[N@@H+](C)CC2(SC)CC2)cc1 ZINC000589157855 346669954 /nfs/dbraw/zinc/66/99/54/346669954.db2.gz YWSLUAWNWVCJDS-UHFFFAOYSA-N 1 1 249.423 3.576 20 0 BHADMO CC[C@H](CSC)[N@@H+](C)Cc1ccc(C)s1 ZINC000589206261 346675902 /nfs/dbraw/zinc/67/59/02/346675902.db2.gz CRZRNWNBAUBGLD-LLVKDONJSA-N 1 1 243.441 3.630 20 0 BHADMO CC[C@@H](CSC)[N@@H+](C)Cc1ccc(C)s1 ZINC000589206266 346676074 /nfs/dbraw/zinc/67/60/74/346676074.db2.gz CRZRNWNBAUBGLD-NSHDSACASA-N 1 1 243.441 3.630 20 0 BHADMO CC[N@@H+](CC=C(C)C)Cc1cccc(F)c1 ZINC000589260213 346681185 /nfs/dbraw/zinc/68/11/85/346681185.db2.gz CIQZZMHHFNGHGQ-UHFFFAOYSA-N 1 1 221.319 3.614 20 0 BHADMO CSC1(C[N@@H+](C)C2CCCCC2)CCC1 ZINC000589494631 346709381 /nfs/dbraw/zinc/70/93/81/346709381.db2.gz UOEUMSGHMXLEIF-UHFFFAOYSA-N 1 1 227.417 3.537 20 0 BHADMO CC(C)C[N@H+]1CCC[C@H](c2ccccc2)CC1 ZINC000589609211 346717399 /nfs/dbraw/zinc/71/73/99/346717399.db2.gz DBVLFPGKIMTFMM-INIZCTEOSA-N 1 1 231.383 3.912 20 0 BHADMO CC(C)C[N@H+]1CCC[C@@H](c2ccccc2)CC1 ZINC000589609214 346717719 /nfs/dbraw/zinc/71/77/19/346717719.db2.gz DBVLFPGKIMTFMM-MRXNPFEDSA-N 1 1 231.383 3.912 20 0 BHADMO CCC[N@H+]1CCC[C@H](c2ccccc2)CC1 ZINC000589609581 346717823 /nfs/dbraw/zinc/71/78/23/346717823.db2.gz LZWYLLFMRKCOKH-HNNXBMFYSA-N 1 1 217.356 3.666 20 0 BHADMO CCC[N@H+]1CCC[C@@H](c2ccccc2)CC1 ZINC000589609584 346717727 /nfs/dbraw/zinc/71/77/27/346717727.db2.gz LZWYLLFMRKCOKH-OAHLLOKOSA-N 1 1 217.356 3.666 20 0 BHADMO CSC[C@@H]1CCC[N@@H+](C[C@@H](C)C(C)(C)C)C1 ZINC000590053584 346768966 /nfs/dbraw/zinc/76/89/66/346768966.db2.gz FSKLXJNNXMJOLV-CHWSQXEVSA-N 1 1 243.460 3.744 20 0 BHADMO CSC[C@H]1CCC[N@@H+](C[C@@H](C)C(C)(C)C)C1 ZINC000590053585 346769174 /nfs/dbraw/zinc/76/91/74/346769174.db2.gz FSKLXJNNXMJOLV-OLZOCXBDSA-N 1 1 243.460 3.744 20 0 BHADMO CSC[C@@H]1CCC[N@@H+](C[C@H](C)C(C)(C)C)C1 ZINC000590053586 346769066 /nfs/dbraw/zinc/76/90/66/346769066.db2.gz FSKLXJNNXMJOLV-QWHCGFSZSA-N 1 1 243.460 3.744 20 0 BHADMO CSC[C@H]1CCC[N@@H+](C[C@H](C)C(C)(C)C)C1 ZINC000590053587 346769093 /nfs/dbraw/zinc/76/90/93/346769093.db2.gz FSKLXJNNXMJOLV-STQMWFEESA-N 1 1 243.460 3.744 20 0 BHADMO CCC(CC)[N@@H+](CC1CCCC1)C1CC1 ZINC000590058604 346769027 /nfs/dbraw/zinc/76/90/27/346769027.db2.gz YRQLLGMRSLQXNI-UHFFFAOYSA-N 1 1 209.377 3.830 20 0 BHADMO CC[C@H]1CCC[N@H+]1Cc1cc(C)ccc1C ZINC000590061803 346769925 /nfs/dbraw/zinc/76/99/25/346769925.db2.gz CBIYTWYDGQKPLV-HNNXBMFYSA-N 1 1 217.356 3.678 20 0 BHADMO CC[C@@H]1CCC[N@H+]1Cc1cc(C)ccc1C ZINC000590061805 346769877 /nfs/dbraw/zinc/76/98/77/346769877.db2.gz CBIYTWYDGQKPLV-OAHLLOKOSA-N 1 1 217.356 3.678 20 0 BHADMO CC[C@H]1CCC[N@H+]1CCOc1cc(C)ccc1C ZINC000590061834 346769941 /nfs/dbraw/zinc/76/99/41/346769941.db2.gz FHJFFLZSEYAELO-HNNXBMFYSA-N 1 1 247.382 3.557 20 0 BHADMO CC[C@@H]1CCC[N@H+]1CCOc1cc(C)ccc1C ZINC000590061836 346769855 /nfs/dbraw/zinc/76/98/55/346769855.db2.gz FHJFFLZSEYAELO-OAHLLOKOSA-N 1 1 247.382 3.557 20 0 BHADMO CC[C@@H]1CCC[N@H+]1Cc1ccccc1Cl ZINC000590062088 346769983 /nfs/dbraw/zinc/76/99/83/346769983.db2.gz RILOKKSKASKETM-GFCCVEGCSA-N 1 1 223.747 3.714 20 0 BHADMO CC[C@H]1CCC[N@H+]1Cc1ccccc1Cl ZINC000590062092 346769846 /nfs/dbraw/zinc/76/98/46/346769846.db2.gz RILOKKSKASKETM-LBPRGKRZSA-N 1 1 223.747 3.714 20 0 BHADMO CC[C@@H]1CCC[N@H+]1Cc1cccc(Cl)c1 ZINC000590062094 346769819 /nfs/dbraw/zinc/76/98/19/346769819.db2.gz RZXDYPFTOALNLM-CYBMUJFWSA-N 1 1 223.747 3.714 20 0 BHADMO CC[C@H]1CCC[N@H+]1Cc1cccc(Cl)c1 ZINC000590062096 346769965 /nfs/dbraw/zinc/76/99/65/346769965.db2.gz RZXDYPFTOALNLM-ZDUSSCGKSA-N 1 1 223.747 3.714 20 0 BHADMO CC[C@H]1CCC[N@H+]1Cc1c(F)cccc1Cl ZINC000590062188 346770063 /nfs/dbraw/zinc/77/00/63/346770063.db2.gz WJYUPSPDRDZZOC-JTQLQIEISA-N 1 1 241.737 3.854 20 0 BHADMO CC[C@@H]1CCC[N@H+]1Cc1c(F)cccc1Cl ZINC000590062196 346769869 /nfs/dbraw/zinc/76/98/69/346769869.db2.gz WJYUPSPDRDZZOC-SNVBAGLBSA-N 1 1 241.737 3.854 20 0 BHADMO CC[C@H]1CCC[N@H+]1CCOc1cc(C)cc(C)c1 ZINC000590062508 346769929 /nfs/dbraw/zinc/76/99/29/346769929.db2.gz IFFCSGVEXDRAKT-HNNXBMFYSA-N 1 1 247.382 3.557 20 0 BHADMO CC[C@@H]1CCC[N@H+]1CCOc1cc(C)cc(C)c1 ZINC000590062509 346770022 /nfs/dbraw/zinc/77/00/22/346770022.db2.gz IFFCSGVEXDRAKT-OAHLLOKOSA-N 1 1 247.382 3.557 20 0 BHADMO COc1ccccc1[C@@H]1CCC[N@H+]1CC=C(C)C ZINC000590064063 346769058 /nfs/dbraw/zinc/76/90/58/346769058.db2.gz JKDXLEVUEBLBRW-HNNXBMFYSA-N 1 1 245.366 3.798 20 0 BHADMO COc1ccccc1[C@H]1CCC[N@H+]1CC=C(C)C ZINC000590064066 346769013 /nfs/dbraw/zinc/76/90/13/346769013.db2.gz JKDXLEVUEBLBRW-OAHLLOKOSA-N 1 1 245.366 3.798 20 0 BHADMO CC[C@@H]1CCC[N@H+]1C/C=C\c1ccccc1 ZINC000590125482 346777538 /nfs/dbraw/zinc/77/75/38/346777538.db2.gz IUQMRYUNNDAFQO-IZIDJEDMSA-N 1 1 215.340 3.574 20 0 BHADMO CC[C@H]1CCC[N@H+]1C/C=C\c1ccccc1 ZINC000590125484 346777377 /nfs/dbraw/zinc/77/73/77/346777377.db2.gz IUQMRYUNNDAFQO-MLBQELRYSA-N 1 1 215.340 3.574 20 0 BHADMO CC[C@@H]1CCC[N@H+]1C/C=C/c1ccccc1 ZINC000590125485 346777344 /nfs/dbraw/zinc/77/73/44/346777344.db2.gz IUQMRYUNNDAFQO-WCLQSUPFSA-N 1 1 215.340 3.574 20 0 BHADMO CC[C@H]1CCC[N@H+]1C/C=C/c1ccccc1 ZINC000590125486 346777157 /nfs/dbraw/zinc/77/71/57/346777157.db2.gz IUQMRYUNNDAFQO-WGPYJDKQSA-N 1 1 215.340 3.574 20 0 BHADMO CCCC[N@@H+](CC1CC1)C1CCCCC1 ZINC000590127065 346778765 /nfs/dbraw/zinc/77/87/65/346778765.db2.gz NFZIJOUOCHCWRI-UHFFFAOYSA-N 1 1 209.377 3.831 20 0 BHADMO CC(C)[C@@H](C)[N@@H+](C)CCc1ccccc1Cl ZINC000590293407 346938910 /nfs/dbraw/zinc/93/89/10/346938910.db2.gz XEORSHHJTNYLMJ-GFCCVEGCSA-N 1 1 239.790 3.859 20 0 BHADMO CC(C)[C@H](C)[N@@H+](C)CCc1ccccc1Cl ZINC000590293415 346939358 /nfs/dbraw/zinc/93/93/58/346939358.db2.gz XEORSHHJTNYLMJ-LBPRGKRZSA-N 1 1 239.790 3.859 20 0 BHADMO Cc1ccc(C[N@H+](C)Cc2ccc(C)cc2)s1 ZINC000590295384 346939816 /nfs/dbraw/zinc/93/98/16/346939816.db2.gz OPNMMJSSGGZDJZ-UHFFFAOYSA-N 1 1 245.391 3.997 20 0 BHADMO Cc1ccc(C[N@@H+](C)CC2CCCC2)s1 ZINC000590295998 346940231 /nfs/dbraw/zinc/94/02/31/346940231.db2.gz MNJUNDXVHPDBHH-UHFFFAOYSA-N 1 1 223.385 3.679 20 0 BHADMO Cc1ccc(C[N@H+](C)CCC(C)C)s1 ZINC000590296130 346939781 /nfs/dbraw/zinc/93/97/81/346939781.db2.gz ZURHJDXDBOTRML-UHFFFAOYSA-N 1 1 211.374 3.534 20 0 BHADMO CC[N@@H+](Cc1cccc(F)c1)[C@H]1C=CCCC1 ZINC000590400484 347088078 /nfs/dbraw/zinc/08/80/78/347088078.db2.gz GUJOSULHUHNXCG-HNNXBMFYSA-N 1 1 233.330 3.756 20 0 BHADMO CC[N@@H+](Cc1ccccc1C)[C@H]1C=CCCC1 ZINC000590400500 347084611 /nfs/dbraw/zinc/08/46/11/347084611.db2.gz IOSYLNXIEZRJBL-INIZCTEOSA-N 1 1 229.367 3.926 20 0 BHADMO CC[N@@H+](Cc1ccccc1C)[C@@H]1C=CCCC1 ZINC000590400514 347084764 /nfs/dbraw/zinc/08/47/64/347084764.db2.gz IOSYLNXIEZRJBL-MRXNPFEDSA-N 1 1 229.367 3.926 20 0 BHADMO C[N@@H+](Cc1cccc(Cl)c1)[C@H]1C=CCCC1 ZINC000590400727 347085597 /nfs/dbraw/zinc/08/55/97/347085597.db2.gz OJBUFBVCLXXGTR-AWEZNQCLSA-N 1 1 235.758 3.881 20 0 BHADMO C[N@@H+](Cc1cccc(Cl)c1)[C@@H]1C=CCCC1 ZINC000590400728 347085541 /nfs/dbraw/zinc/08/55/41/347085541.db2.gz OJBUFBVCLXXGTR-CQSZACIVSA-N 1 1 235.758 3.881 20 0 BHADMO c1ccc(C[N@@H+](C2CC2)[C@H]2C=CCCC2)cc1 ZINC000590400781 347085699 /nfs/dbraw/zinc/08/56/99/347085699.db2.gz QWYMRXCWDBZVPW-HNNXBMFYSA-N 1 1 227.351 3.760 20 0 BHADMO c1ccc(C[N@@H+](C2CC2)[C@@H]2C=CCCC2)cc1 ZINC000590400793 347085220 /nfs/dbraw/zinc/08/52/20/347085220.db2.gz QWYMRXCWDBZVPW-OAHLLOKOSA-N 1 1 227.351 3.760 20 0 BHADMO CC1CCC([N@@H+](C)[C@H]2C=CCCC2)CC1 ZINC000590400855 347085694 /nfs/dbraw/zinc/08/56/94/347085694.db2.gz UUHKDSZZLXTMGS-MOKVOYLWSA-N 1 1 207.361 3.606 20 0 BHADMO CC1CCC([N@@H+](C)[C@@H]2C=CCCC2)CC1 ZINC000590400860 347085744 /nfs/dbraw/zinc/08/57/44/347085744.db2.gz UUHKDSZZLXTMGS-ROKHWSDSSA-N 1 1 207.361 3.606 20 0 BHADMO Cc1cc(C)cc(OCC[N@H+]2CCCC2(C)C)c1 ZINC000590605840 347477347 /nfs/dbraw/zinc/47/73/47/347477347.db2.gz LOHCHLUVOXGSMK-UHFFFAOYSA-N 1 1 247.382 3.557 20 0 BHADMO CS[C@H]1CC[N@@H+](Cc2ccccc2C2CC2)C1 ZINC000590656511 347486368 /nfs/dbraw/zinc/48/63/68/347486368.db2.gz AGJDUIRTFMFKLA-AWEZNQCLSA-N 1 1 247.407 3.501 20 0 BHADMO CS[C@@H]1CC[N@@H+](Cc2ccccc2C2CC2)C1 ZINC000590656512 347486249 /nfs/dbraw/zinc/48/62/49/347486249.db2.gz AGJDUIRTFMFKLA-CQSZACIVSA-N 1 1 247.407 3.501 20 0 BHADMO Cc1cc(C)c(C[N@H+]2CCC[C@H]2C2CC2)c(C)c1 ZINC000590787574 347557334 /nfs/dbraw/zinc/55/73/34/347557334.db2.gz BDOXQYRTBCSRCQ-KRWDZBQOSA-N 1 1 243.394 3.986 20 0 BHADMO Cc1cc(C)c(C[N@H+]2CCC[C@@H]2C2CC2)c(C)c1 ZINC000590787575 347557127 /nfs/dbraw/zinc/55/71/27/347557127.db2.gz BDOXQYRTBCSRCQ-QGZVFWFLSA-N 1 1 243.394 3.986 20 0 BHADMO Clc1cccc(C[N@H+]2CCC[C@H]2C2CC2)c1 ZINC000590788014 347557898 /nfs/dbraw/zinc/55/78/98/347557898.db2.gz QSUUNOBEQRWWDW-AWEZNQCLSA-N 1 1 235.758 3.714 20 0 BHADMO Clc1cccc(C[N@H+]2CCC[C@@H]2C2CC2)c1 ZINC000590788015 347557705 /nfs/dbraw/zinc/55/77/05/347557705.db2.gz QSUUNOBEQRWWDW-CQSZACIVSA-N 1 1 235.758 3.714 20 0 BHADMO Cc1cc(C[N@H+]2CCC[C@H]2C2CC2)c(C)s1 ZINC000590788227 347557941 /nfs/dbraw/zinc/55/79/41/347557941.db2.gz WUWNRCIDRYQYCF-AWEZNQCLSA-N 1 1 235.396 3.739 20 0 BHADMO Cc1cc(C[N@H+]2CCC[C@@H]2C2CC2)c(C)s1 ZINC000590788228 347557847 /nfs/dbraw/zinc/55/78/47/347557847.db2.gz WUWNRCIDRYQYCF-CQSZACIVSA-N 1 1 235.396 3.739 20 0 BHADMO Clc1ccccc1CC[N@H+]1CCC[C@H]1C1CC1 ZINC000590788298 347558086 /nfs/dbraw/zinc/55/80/86/347558086.db2.gz YQWFUEJXMJWVCH-HNNXBMFYSA-N 1 1 249.785 3.757 20 0 BHADMO Clc1ccccc1CC[N@H+]1CCC[C@@H]1C1CC1 ZINC000590788299 347557696 /nfs/dbraw/zinc/55/76/96/347557696.db2.gz YQWFUEJXMJWVCH-OAHLLOKOSA-N 1 1 249.785 3.757 20 0 BHADMO Clc1ccc(C[N@H+]2CCC[C@@H]2C2CC2)s1 ZINC000590789090 347558845 /nfs/dbraw/zinc/55/88/45/347558845.db2.gz PLTKOIDNZHYXTM-LLVKDONJSA-N 1 1 241.787 3.776 20 0 BHADMO Clc1ccc(C[N@H+]2CCC[C@H]2C2CC2)s1 ZINC000590789093 347559014 /nfs/dbraw/zinc/55/90/14/347559014.db2.gz PLTKOIDNZHYXTM-NSHDSACASA-N 1 1 241.787 3.776 20 0 BHADMO CSc1ccc(C[N@H+]2CCC[C@H]2C2CC2)cc1 ZINC000590789441 347559155 /nfs/dbraw/zinc/55/91/55/347559155.db2.gz UUBJWXMOEKZGQQ-HNNXBMFYSA-N 1 1 247.407 3.783 20 0 BHADMO CSc1ccc(C[N@H+]2CCC[C@@H]2C2CC2)cc1 ZINC000590789443 347559055 /nfs/dbraw/zinc/55/90/55/347559055.db2.gz UUBJWXMOEKZGQQ-OAHLLOKOSA-N 1 1 247.407 3.783 20 0 BHADMO Cc1ccc(C)c(C[N@H+]2CCC[C@H]2C2CC2)c1 ZINC000590789488 347558888 /nfs/dbraw/zinc/55/88/88/347558888.db2.gz VSCRRUBPEXXFSC-INIZCTEOSA-N 1 1 229.367 3.678 20 0 BHADMO Cc1ccc(C)c(C[N@H+]2CCC[C@@H]2C2CC2)c1 ZINC000590789489 347558785 /nfs/dbraw/zinc/55/87/85/347558785.db2.gz VSCRRUBPEXXFSC-MRXNPFEDSA-N 1 1 229.367 3.678 20 0 BHADMO Clc1ccc(C[N@H+]2CCC[C@H]2C2CC2)cc1 ZINC000590789588 347558634 /nfs/dbraw/zinc/55/86/34/347558634.db2.gz CLCUNMGPVIDZQV-AWEZNQCLSA-N 1 1 235.758 3.714 20 0 BHADMO Clc1ccc(C[N@H+]2CCC[C@@H]2C2CC2)cc1 ZINC000590789589 347558926 /nfs/dbraw/zinc/55/89/26/347558926.db2.gz CLCUNMGPVIDZQV-CQSZACIVSA-N 1 1 235.758 3.714 20 0 BHADMO Clc1ccccc1C[N@H+]1CCC[C@H]1C1CC1 ZINC000590789590 347558904 /nfs/dbraw/zinc/55/89/04/347558904.db2.gz FOLNWNJCZXTCDM-AWEZNQCLSA-N 1 1 235.758 3.714 20 0 BHADMO Clc1ccccc1C[N@H+]1CCC[C@@H]1C1CC1 ZINC000590789591 347559109 /nfs/dbraw/zinc/55/91/09/347559109.db2.gz FOLNWNJCZXTCDM-CQSZACIVSA-N 1 1 235.758 3.714 20 0 BHADMO CC(C)OCCC[N@@H+](C1CC1)C1CCCCC1 ZINC000590818393 385528125 /nfs/dbraw/zinc/52/81/25/385528125.db2.gz BQTJWROMOPBWJJ-UHFFFAOYSA-N 1 1 239.403 3.599 20 0 BHADMO COCCCCC[N@@H+](C1CC1)C1CCCCC1 ZINC000590818437 385528141 /nfs/dbraw/zinc/52/81/41/385528141.db2.gz MIVFCZVQGWEADF-UHFFFAOYSA-N 1 1 239.403 3.600 20 0 BHADMO CC[N@@H+](CCCCCOC)Cc1ccc(C)cc1 ZINC000590818613 347568707 /nfs/dbraw/zinc/56/87/07/347568707.db2.gz GYNDMOWEIZGVCS-UHFFFAOYSA-N 1 1 249.398 3.634 20 0 BHADMO Cc1cc(C)cc(C[N@H+]2CCC[C@H]2C2CC2)c1 ZINC000590820135 347568703 /nfs/dbraw/zinc/56/87/03/347568703.db2.gz HCRVFHJJDCHDMJ-INIZCTEOSA-N 1 1 229.367 3.678 20 0 BHADMO Cc1cc(C)cc(C[N@H+]2CCC[C@@H]2C2CC2)c1 ZINC000590820136 347568699 /nfs/dbraw/zinc/56/86/99/347568699.db2.gz HCRVFHJJDCHDMJ-MRXNPFEDSA-N 1 1 229.367 3.678 20 0 BHADMO C(=C\c1ccccc1)\C[N@H+]1CCC[C@H]1C1CC1 ZINC000590820368 347568845 /nfs/dbraw/zinc/56/88/45/347568845.db2.gz XDOXLHMUCXERDR-FAOGRTBUSA-N 1 1 227.351 3.574 20 0 BHADMO C(=C/c1ccccc1)\C[N@H+]1CCC[C@@H]1C1CC1 ZINC000590820369 347568875 /nfs/dbraw/zinc/56/88/75/347568875.db2.gz XDOXLHMUCXERDR-KZJSRBBCSA-N 1 1 227.351 3.574 20 0 BHADMO C(=C\c1ccccc1)\C[N@H+]1CCC[C@@H]1C1CC1 ZINC000590820370 347569137 /nfs/dbraw/zinc/56/91/37/347569137.db2.gz XDOXLHMUCXERDR-LWAXHKBTSA-N 1 1 227.351 3.574 20 0 BHADMO C(=C/c1ccccc1)\C[N@H+]1CCC[C@H]1C1CC1 ZINC000590820371 347569347 /nfs/dbraw/zinc/56/93/47/347569347.db2.gz XDOXLHMUCXERDR-YCOJEUHLSA-N 1 1 227.351 3.574 20 0 BHADMO c1ccc(C[N@@H+](C2CC2)C2CCCC2)cc1 ZINC000590925289 347589898 /nfs/dbraw/zinc/58/98/98/347589898.db2.gz ZHIWCEVTJWWKNW-UHFFFAOYSA-N 1 1 215.340 3.594 20 0 BHADMO Fc1ccc(C[N@@H+](C2CC2)C2CCCC2)cc1 ZINC000590926017 347590063 /nfs/dbraw/zinc/59/00/63/347590063.db2.gz SPOYYJFACNSUSN-UHFFFAOYSA-N 1 1 233.330 3.733 20 0 BHADMO CC(C)(C)[C@@H]1CCC[N@H+]1CCOc1ccccc1 ZINC000591378240 347651083 /nfs/dbraw/zinc/65/10/83/347651083.db2.gz CFCKRKUJLNCLKU-HNNXBMFYSA-N 1 1 247.382 3.576 20 0 BHADMO CC(C)(C)[C@H]1CCC[N@H+]1CCOc1ccccc1 ZINC000591378241 347651181 /nfs/dbraw/zinc/65/11/81/347651181.db2.gz CFCKRKUJLNCLKU-OAHLLOKOSA-N 1 1 247.382 3.576 20 0 BHADMO CC[N@@H+](CCc1ccccc1Cl)CC(C)C ZINC000591469549 397927760 /nfs/dbraw/zinc/92/77/60/397927760.db2.gz GBMJOZSDRTUMPI-UHFFFAOYSA-N 1 1 239.790 3.860 20 0 BHADMO CC(C)CCOCC[N@H+]1CCC[C@H]1C(C)(C)C ZINC000591472632 347667350 /nfs/dbraw/zinc/66/73/50/347667350.db2.gz RISIVSLRQBNTJD-AWEZNQCLSA-N 1 1 241.419 3.560 20 0 BHADMO CC(C)CCOCC[N@H+]1CCC[C@@H]1C(C)(C)C ZINC000591472633 347667398 /nfs/dbraw/zinc/66/73/98/347667398.db2.gz RISIVSLRQBNTJD-CQSZACIVSA-N 1 1 241.419 3.560 20 0 BHADMO CC[C@@H](C)[C@@H](C)[N@@H+](CCOC(C)(C)C)C1CC1 ZINC000591474890 347667388 /nfs/dbraw/zinc/66/73/88/347667388.db2.gz JPZWCOCSFVYRRX-CHWSQXEVSA-N 1 1 241.419 3.701 20 0 BHADMO CC[C@@H](C)[C@H](C)[N@@H+](CCOC(C)(C)C)C1CC1 ZINC000591474891 347667525 /nfs/dbraw/zinc/66/75/25/347667525.db2.gz JPZWCOCSFVYRRX-OLZOCXBDSA-N 1 1 241.419 3.701 20 0 BHADMO CC[C@H](C)[C@@H](C)[N@@H+](CCOC(C)(C)C)C1CC1 ZINC000591474892 347667590 /nfs/dbraw/zinc/66/75/90/347667590.db2.gz JPZWCOCSFVYRRX-QWHCGFSZSA-N 1 1 241.419 3.701 20 0 BHADMO CC[C@@H](C)[C@@H](C)[N@@H+](CC=C(C)C)C1CC1 ZINC000591476436 347667597 /nfs/dbraw/zinc/66/75/97/347667597.db2.gz QFUKFXKGNJOQRV-CHWSQXEVSA-N 1 1 209.377 3.852 20 0 BHADMO CC[C@@H](C)[C@H](C)[N@@H+](CC=C(C)C)C1CC1 ZINC000591476437 347667606 /nfs/dbraw/zinc/66/76/06/347667606.db2.gz QFUKFXKGNJOQRV-OLZOCXBDSA-N 1 1 209.377 3.852 20 0 BHADMO CC[C@H](C)[C@@H](C)[N@@H+](CC=C(C)C)C1CC1 ZINC000591476438 347667559 /nfs/dbraw/zinc/66/75/59/347667559.db2.gz QFUKFXKGNJOQRV-QWHCGFSZSA-N 1 1 209.377 3.852 20 0 BHADMO CC[C@H](C)[C@H](C)[N@@H+](CC=C(C)C)C1CC1 ZINC000591476439 347667328 /nfs/dbraw/zinc/66/73/28/347667328.db2.gz QFUKFXKGNJOQRV-STQMWFEESA-N 1 1 209.377 3.852 20 0 BHADMO CCC[C@H]([NH2+]Cc1ccc(C)o1)c1ccccn1 ZINC000591700182 347690083 /nfs/dbraw/zinc/69/00/83/347690083.db2.gz YKWGNPBYWWEPSL-AWEZNQCLSA-N 1 1 244.338 3.614 20 0 BHADMO CCC[C@@H]([NH2+]Cc1ccc(C)o1)c1ccccn1 ZINC000591700188 347690384 /nfs/dbraw/zinc/69/03/84/347690384.db2.gz YKWGNPBYWWEPSL-CQSZACIVSA-N 1 1 244.338 3.614 20 0 BHADMO CCS[C@H]1CC[C@H]([N@@H+](C)CC2=CCCC2)C1 ZINC000592070293 347727694 /nfs/dbraw/zinc/72/76/94/347727694.db2.gz MXLCNHQQTUPPFY-KBPBESRZSA-N 1 1 239.428 3.703 20 0 BHADMO CCS[C@H]1CC[C@@H]([N@@H+](C)CC2=CCCC2)C1 ZINC000592070312 347727130 /nfs/dbraw/zinc/72/71/30/347727130.db2.gz MXLCNHQQTUPPFY-KGLIPLIRSA-N 1 1 239.428 3.703 20 0 BHADMO CCS[C@@H]1CC[C@H]([N@@H+](C)CC2=CCCC2)C1 ZINC000592070313 347727189 /nfs/dbraw/zinc/72/71/89/347727189.db2.gz MXLCNHQQTUPPFY-UONOGXRCSA-N 1 1 239.428 3.703 20 0 BHADMO CCS[C@@H]1CC[C@@H]([N@@H+](C)CC2=CCCC2)C1 ZINC000592070315 347727240 /nfs/dbraw/zinc/72/72/40/347727240.db2.gz MXLCNHQQTUPPFY-ZIAGYGMSSA-N 1 1 239.428 3.703 20 0 BHADMO CCSCC[C@@H](C)[N@@H+](C)CC1=CCCC1 ZINC000592084752 487805390 /nfs/dbraw/zinc/80/53/90/487805390.db2.gz WZMVVLPBRXKPNF-GFCCVEGCSA-N 1 1 227.417 3.560 20 0 BHADMO CCSCC[C@H](C)[N@@H+](C)CC1=CCCC1 ZINC000592084785 487806064 /nfs/dbraw/zinc/80/60/64/487806064.db2.gz WZMVVLPBRXKPNF-LBPRGKRZSA-N 1 1 227.417 3.560 20 0 BHADMO CC[N@@H+](CCSC)Cc1sccc1Cl ZINC000592201985 347753639 /nfs/dbraw/zinc/75/36/39/347753639.db2.gz MWNPFURTEHMSNE-UHFFFAOYSA-N 1 1 249.832 3.586 20 0 BHADMO CC[N@@H+](CCSC)Cc1cc(C)sc1C ZINC000592205694 347756508 /nfs/dbraw/zinc/75/65/08/347756508.db2.gz ZELKPJUTFAYUFU-UHFFFAOYSA-N 1 1 243.441 3.550 20 0 BHADMO CC[N@@H+](CCSC)Cc1ccsc1Cl ZINC000592526688 347795496 /nfs/dbraw/zinc/79/54/96/347795496.db2.gz CHYBULCCOYUJQD-UHFFFAOYSA-N 1 1 249.832 3.586 20 0 BHADMO CC[N@H+](CCSC)Cc1ccsc1Cl ZINC000592526688 347795491 /nfs/dbraw/zinc/79/54/91/347795491.db2.gz CHYBULCCOYUJQD-UHFFFAOYSA-N 1 1 249.832 3.586 20 0 BHADMO CC[N@@H+](CCSC)Cc1coc2ccccc12 ZINC000592527659 347795699 /nfs/dbraw/zinc/79/56/99/347795699.db2.gz GGYHRZPJTAPYFL-UHFFFAOYSA-N 1 1 249.379 3.618 20 0 BHADMO CC[N@@H+](CCSC)Cc1cscc1Cl ZINC000592530280 347796091 /nfs/dbraw/zinc/79/60/91/347796091.db2.gz PIJSBJKMTUIFGI-UHFFFAOYSA-N 1 1 249.832 3.586 20 0 BHADMO CC[N@H+](CCSC)Cc1cscc1Cl ZINC000592530280 347796088 /nfs/dbraw/zinc/79/60/88/347796088.db2.gz PIJSBJKMTUIFGI-UHFFFAOYSA-N 1 1 249.832 3.586 20 0 BHADMO CC[N@@H+](CCSC)Cc1ccc2occc2c1 ZINC000592531947 347796744 /nfs/dbraw/zinc/79/67/44/347796744.db2.gz YIUFKPACYIGKBW-UHFFFAOYSA-N 1 1 249.379 3.618 20 0 BHADMO c1cc2c(s1)CCC[N@H+](CC1CCCC1)C2 ZINC000592982718 347841822 /nfs/dbraw/zinc/84/18/22/347841822.db2.gz JYGJUONFJOUEJH-UHFFFAOYSA-N 1 1 235.396 3.687 20 0 BHADMO CC(C)CC[N@H+]1CCCc2sccc2C1 ZINC000592983482 347842073 /nfs/dbraw/zinc/84/20/73/347842073.db2.gz POKSROXSNBJZKW-UHFFFAOYSA-N 1 1 223.385 3.542 20 0 BHADMO c1cc2c(s1)CCC[N@H+](Cc1ccccc1)C2 ZINC000592983888 347836376 /nfs/dbraw/zinc/83/63/76/347836376.db2.gz NJOXZNRUHPNFCY-UHFFFAOYSA-N 1 1 243.375 3.697 20 0 BHADMO CCS[C@H]1CC[C@H]([N@@H+](C)CC2CC=CC2)C1 ZINC000595330950 348228075 /nfs/dbraw/zinc/22/80/75/348228075.db2.gz RXSVIMXMONLDQB-KBPBESRZSA-N 1 1 239.428 3.559 20 0 BHADMO CCS[C@H]1CC[C@@H]([N@@H+](C)CC2CC=CC2)C1 ZINC000595330951 348227931 /nfs/dbraw/zinc/22/79/31/348227931.db2.gz RXSVIMXMONLDQB-KGLIPLIRSA-N 1 1 239.428 3.559 20 0 BHADMO CCS[C@@H]1CC[C@H]([N@@H+](C)CC2CC=CC2)C1 ZINC000595330952 348227940 /nfs/dbraw/zinc/22/79/40/348227940.db2.gz RXSVIMXMONLDQB-UONOGXRCSA-N 1 1 239.428 3.559 20 0 BHADMO CCS[C@@H]1CC[C@@H]([N@@H+](C)CC2CC=CC2)C1 ZINC000595330953 348228424 /nfs/dbraw/zinc/22/84/24/348228424.db2.gz RXSVIMXMONLDQB-ZIAGYGMSSA-N 1 1 239.428 3.559 20 0 BHADMO CSC[C@H]1CCC[N@@H+](CCCC2CCC2)C1 ZINC000595512417 348266638 /nfs/dbraw/zinc/26/66/38/348266638.db2.gz USLSVKPNHOSQED-AWEZNQCLSA-N 1 1 241.444 3.642 20 0 BHADMO CSC[C@@H]1CCC[N@@H+](CCCC2CCC2)C1 ZINC000595512419 348266401 /nfs/dbraw/zinc/26/64/01/348266401.db2.gz USLSVKPNHOSQED-CQSZACIVSA-N 1 1 241.444 3.642 20 0 BHADMO C[N@@H+](Cc1ccc(Cl)cc1)[C@H]1C=CCCC1 ZINC000595544492 348277768 /nfs/dbraw/zinc/27/77/68/348277768.db2.gz ODMVJXBKIHUVJU-AWEZNQCLSA-N 1 1 235.758 3.881 20 0 BHADMO C[N@@H+](Cc1ccc(Cl)cc1)[C@@H]1C=CCCC1 ZINC000595544493 348277807 /nfs/dbraw/zinc/27/78/07/348277807.db2.gz ODMVJXBKIHUVJU-CQSZACIVSA-N 1 1 235.758 3.881 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@H]2C=CCCC2)cc1 ZINC000595544515 348277803 /nfs/dbraw/zinc/27/78/03/348277803.db2.gz SBGCGNMBWOBUBM-HNNXBMFYSA-N 1 1 215.340 3.536 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@@H]2C=CCCC2)cc1 ZINC000595544527 348277605 /nfs/dbraw/zinc/27/76/05/348277605.db2.gz SBGCGNMBWOBUBM-OAHLLOKOSA-N 1 1 215.340 3.536 20 0 BHADMO C[N@@H+]([C@H]1C=CCCC1)C1CCCCCC1 ZINC000595550237 348268639 /nfs/dbraw/zinc/26/86/39/348268639.db2.gz SNIXFMFZLADNOD-AWEZNQCLSA-N 1 1 207.361 3.750 20 0 BHADMO C[N@@H+]([C@@H]1C=CCCC1)C1CCCCCC1 ZINC000595550238 348268307 /nfs/dbraw/zinc/26/83/07/348268307.db2.gz SNIXFMFZLADNOD-CQSZACIVSA-N 1 1 207.361 3.750 20 0 BHADMO Fc1ccccc1C[N@@H+](C1CC1)[C@H]1C=CCCC1 ZINC000595550271 348268613 /nfs/dbraw/zinc/26/86/13/348268613.db2.gz YTHKDCYUTYHBDX-AWEZNQCLSA-N 1 1 245.341 3.899 20 0 BHADMO Fc1ccccc1C[N@@H+](C1CC1)[C@@H]1C=CCCC1 ZINC000595550285 348268722 /nfs/dbraw/zinc/26/87/22/348268722.db2.gz YTHKDCYUTYHBDX-CQSZACIVSA-N 1 1 245.341 3.899 20 0 BHADMO CC[N@@H+](C1CCCCC1)[C@@H]1C=CCCC1 ZINC000595553375 348269283 /nfs/dbraw/zinc/26/92/83/348269283.db2.gz QDGXHSZFQCGXJL-CYBMUJFWSA-N 1 1 207.361 3.750 20 0 BHADMO CC[N@@H+](C1CCCCC1)[C@H]1C=CCCC1 ZINC000595553376 348269347 /nfs/dbraw/zinc/26/93/47/348269347.db2.gz QDGXHSZFQCGXJL-ZDUSSCGKSA-N 1 1 207.361 3.750 20 0 BHADMO c1ccc(C[C@H]2CCC[N@H+]2[C@H]2C=CCCC2)cc1 ZINC000595553409 348269321 /nfs/dbraw/zinc/26/93/21/348269321.db2.gz VWFTVWSIOKRCHX-DLBZAZTESA-N 1 1 241.378 3.802 20 0 BHADMO c1ccc(C[C@H]2CCC[N@H+]2[C@@H]2C=CCCC2)cc1 ZINC000595553410 348269441 /nfs/dbraw/zinc/26/94/41/348269441.db2.gz VWFTVWSIOKRCHX-IAGOWNOFSA-N 1 1 241.378 3.802 20 0 BHADMO c1ccc(C[C@@H]2CCC[N@H+]2[C@H]2C=CCCC2)cc1 ZINC000595553411 348269419 /nfs/dbraw/zinc/26/94/19/348269419.db2.gz VWFTVWSIOKRCHX-IRXDYDNUSA-N 1 1 241.378 3.802 20 0 BHADMO c1ccc(C[C@@H]2CCC[N@H+]2[C@@H]2C=CCCC2)cc1 ZINC000595553412 348269287 /nfs/dbraw/zinc/26/92/87/348269287.db2.gz VWFTVWSIOKRCHX-SJORKVTESA-N 1 1 241.378 3.802 20 0 BHADMO CCCCC[N@@H+](C(C)C)[C@H]1C=CCCC1 ZINC000595555276 348269558 /nfs/dbraw/zinc/26/95/58/348269558.db2.gz ANZJVMRMNGFUJX-AWEZNQCLSA-N 1 1 209.377 3.996 20 0 BHADMO CCCCC[N@@H+](C(C)C)[C@@H]1C=CCCC1 ZINC000595555281 348269509 /nfs/dbraw/zinc/26/95/09/348269509.db2.gz ANZJVMRMNGFUJX-CQSZACIVSA-N 1 1 209.377 3.996 20 0 BHADMO C[C@@H]1CCC[C@@H]([N@@H+](C)[C@H]2C=CCCC2)C1 ZINC000595555339 348269257 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ZINC000595556527 348269264 /nfs/dbraw/zinc/26/92/64/348269264.db2.gz FIPGRNZXPLKEMC-HNNXBMFYSA-N 1 1 215.340 3.536 20 0 BHADMO Cc1cccc(C[N@H+](C)[C@@H]2C=CCCC2)c1 ZINC000595556528 348269325 /nfs/dbraw/zinc/26/93/25/348269325.db2.gz FIPGRNZXPLKEMC-OAHLLOKOSA-N 1 1 215.340 3.536 20 0 BHADMO CCC(CC)[N@@H+](C1CC1)[C@@H]1C=CCCC1 ZINC000595556641 348279451 /nfs/dbraw/zinc/27/94/51/348279451.db2.gz NMAVCFZOCLPLBL-CYBMUJFWSA-N 1 1 207.361 3.748 20 0 BHADMO CCC(CC)[N@@H+](C1CC1)[C@H]1C=CCCC1 ZINC000595556642 348279528 /nfs/dbraw/zinc/27/95/28/348279528.db2.gz NMAVCFZOCLPLBL-ZDUSSCGKSA-N 1 1 207.361 3.748 20 0 BHADMO C1=C[C@@H]([N@@H+]2CCC[C@H]2C2CCCC2)CCC1 ZINC000595556969 348279740 /nfs/dbraw/zinc/27/97/40/348279740.db2.gz RCXJELORTUOOAH-CABCVRRESA-N 1 1 219.372 3.750 20 0 BHADMO C1=C[C@H]([N@@H+]2CCC[C@H]2C2CCCC2)CCC1 ZINC000595556970 348279564 /nfs/dbraw/zinc/27/95/64/348279564.db2.gz RCXJELORTUOOAH-GJZGRUSLSA-N 1 1 219.372 3.750 20 0 BHADMO C1=C[C@@H]([N@@H+]2CCC[C@@H]2C2CCCC2)CCC1 ZINC000595556971 348279238 /nfs/dbraw/zinc/27/92/38/348279238.db2.gz RCXJELORTUOOAH-HUUCEWRRSA-N 1 1 219.372 3.750 20 0 BHADMO C1=C[C@H]([N@@H+]2CCC[C@@H]2C2CCCC2)CCC1 ZINC000595556972 348279264 /nfs/dbraw/zinc/27/92/64/348279264.db2.gz RCXJELORTUOOAH-LSDHHAIUSA-N 1 1 219.372 3.750 20 0 BHADMO Oc1ccc([C@H]2CCC[N@H+]2[C@@H]2C=CCCC2)cc1 ZINC000595556990 348279480 /nfs/dbraw/zinc/27/94/80/348279480.db2.gz SWMSUFUSNCFFIB-GDBMZVCRSA-N 1 1 243.350 3.638 20 0 BHADMO Oc1ccc([C@H]2CCC[N@H+]2[C@H]2C=CCCC2)cc1 ZINC000595556991 348279181 /nfs/dbraw/zinc/27/91/81/348279181.db2.gz SWMSUFUSNCFFIB-GOEBONIOSA-N 1 1 243.350 3.638 20 0 BHADMO Oc1ccc([C@@H]2CCC[N@H+]2[C@H]2C=CCCC2)cc1 ZINC000595556992 348279423 /nfs/dbraw/zinc/27/94/23/348279423.db2.gz SWMSUFUSNCFFIB-HOCLYGCPSA-N 1 1 243.350 3.638 20 0 BHADMO Oc1ccc([C@@H]2CCC[N@H+]2[C@@H]2C=CCCC2)cc1 ZINC000595556993 348279583 /nfs/dbraw/zinc/27/95/83/348279583.db2.gz SWMSUFUSNCFFIB-ZBFHGGJFSA-N 1 1 243.350 3.638 20 0 BHADMO CC(C)C[C@@H]1CCC[N@H+]1[C@H]1C=CCCC1 ZINC000595558095 348280497 /nfs/dbraw/zinc/28/04/97/348280497.db2.gz WSGHARPCISKVPD-KBPBESRZSA-N 1 1 207.361 3.606 20 0 BHADMO CC(C)C[C@@H]1CCC[N@H+]1[C@@H]1C=CCCC1 ZINC000595558096 348280329 /nfs/dbraw/zinc/28/03/29/348280329.db2.gz WSGHARPCISKVPD-KGLIPLIRSA-N 1 1 207.361 3.606 20 0 BHADMO CC(C)C[C@H]1CCC[N@H+]1[C@H]1C=CCCC1 ZINC000595558097 348280392 /nfs/dbraw/zinc/28/03/92/348280392.db2.gz WSGHARPCISKVPD-UONOGXRCSA-N 1 1 207.361 3.606 20 0 BHADMO CC(C)C[C@H]1CCC[N@H+]1[C@@H]1C=CCCC1 ZINC000595558098 348280038 /nfs/dbraw/zinc/28/00/38/348280038.db2.gz WSGHARPCISKVPD-ZIAGYGMSSA-N 1 1 207.361 3.606 20 0 BHADMO C1=C[C@@H]([N@@H+](C2CC2)C2CCCCC2)CCC1 ZINC000595563704 348281757 /nfs/dbraw/zinc/28/17/57/348281757.db2.gz GGKFBFRJQSPCOK-CYBMUJFWSA-N 1 1 219.372 3.892 20 0 BHADMO C1=C[C@H]([N@@H+](C2CC2)C2CCCCC2)CCC1 ZINC000595563705 348281736 /nfs/dbraw/zinc/28/17/36/348281736.db2.gz GGKFBFRJQSPCOK-ZDUSSCGKSA-N 1 1 219.372 3.892 20 0 BHADMO CC[N@@H+](CCc1ccccc1)[C@H]1C=CCCC1 ZINC000595563762 348281714 /nfs/dbraw/zinc/28/17/14/348281714.db2.gz RVHLKWDUCXNQKB-INIZCTEOSA-N 1 1 229.367 3.660 20 0 BHADMO CC[N@@H+](CCc1ccccc1)[C@@H]1C=CCCC1 ZINC000595563763 348282434 /nfs/dbraw/zinc/28/24/34/348282434.db2.gz RVHLKWDUCXNQKB-MRXNPFEDSA-N 1 1 229.367 3.660 20 0 BHADMO CC[N@@H+](Cc1ccc(OC)cc1)[C@H]1C=CCCC1 ZINC000595563764 348281732 /nfs/dbraw/zinc/28/17/32/348281732.db2.gz RZFZPBDCGKYSRJ-HNNXBMFYSA-N 1 1 245.366 3.626 20 0 BHADMO CC[N@@H+](Cc1ccc(OC)cc1)[C@@H]1C=CCCC1 ZINC000595563765 348281954 /nfs/dbraw/zinc/28/19/54/348281954.db2.gz RZFZPBDCGKYSRJ-OAHLLOKOSA-N 1 1 245.366 3.626 20 0 BHADMO Cc1ccc(C[N@@H+](C2CC2)[C@@H]2C=CCCC2)o1 ZINC000595563778 348281962 /nfs/dbraw/zinc/28/19/62/348281962.db2.gz WBBKXBSGGLYSPZ-CYBMUJFWSA-N 1 1 231.339 3.661 20 0 BHADMO Cc1ccc(C[N@@H+](C2CC2)[C@H]2C=CCCC2)o1 ZINC000595563779 348282323 /nfs/dbraw/zinc/28/23/23/348282323.db2.gz WBBKXBSGGLYSPZ-ZDUSSCGKSA-N 1 1 231.339 3.661 20 0 BHADMO c1cc([C@@H]2CCC[N@H+]2[C@@H]2C=CCCC2)cs1 ZINC000595563796 348281920 /nfs/dbraw/zinc/28/19/20/348281920.db2.gz ZWNZTZLNUKVIKN-KGLIPLIRSA-N 1 1 233.380 3.994 20 0 BHADMO c1cc([C@H]2CCC[N@H+]2[C@@H]2C=CCCC2)cs1 ZINC000595563797 348282031 /nfs/dbraw/zinc/28/20/31/348282031.db2.gz ZWNZTZLNUKVIKN-ZIAGYGMSSA-N 1 1 233.380 3.994 20 0 BHADMO CC[N@@H+](Cc1ccc(C)cc1)[C@H]1C=CCCC1 ZINC000595564328 348282044 /nfs/dbraw/zinc/28/20/44/348282044.db2.gz RLFGUWRYPPBSBY-INIZCTEOSA-N 1 1 229.367 3.926 20 0 BHADMO CC[N@@H+](Cc1ccc(C)cc1)[C@@H]1C=CCCC1 ZINC000595564329 348282024 /nfs/dbraw/zinc/28/20/24/348282024.db2.gz RLFGUWRYPPBSBY-MRXNPFEDSA-N 1 1 229.367 3.926 20 0 BHADMO C[C@H](C[N@@H+](C)[C@@H]1C=CCCC1)c1ccccc1 ZINC000595564755 348283282 /nfs/dbraw/zinc/28/32/82/348283282.db2.gz DTVHPLALUMUDKN-GDBMZVCRSA-N 1 1 229.367 3.831 20 0 BHADMO C[C@@H](C[N@@H+](C)[C@@H]1C=CCCC1)c1ccccc1 ZINC000595564757 348282792 /nfs/dbraw/zinc/28/27/92/348282792.db2.gz DTVHPLALUMUDKN-GOEBONIOSA-N 1 1 229.367 3.831 20 0 BHADMO C[C@@H](C[N@@H+](C)[C@H]1C=CCCC1)c1ccccc1 ZINC000595564758 348282954 /nfs/dbraw/zinc/28/29/54/348282954.db2.gz DTVHPLALUMUDKN-HOCLYGCPSA-N 1 1 229.367 3.831 20 0 BHADMO C[C@H](C[N@@H+](C)[C@H]1C=CCCC1)c1ccccc1 ZINC000595564759 348283113 /nfs/dbraw/zinc/28/31/13/348283113.db2.gz DTVHPLALUMUDKN-ZBFHGGJFSA-N 1 1 229.367 3.831 20 0 BHADMO Cc1ccccc1[C@@H]1CC[N@H+]([C@H]2C=CCCC2)C1 ZINC000595564766 348283191 /nfs/dbraw/zinc/28/31/91/348283191.db2.gz GUTZONCUNFNPPS-CVEARBPZSA-N 1 1 241.378 3.893 20 0 BHADMO Cc1ccccc1[C@H]1CC[N@H+]([C@H]2C=CCCC2)C1 ZINC000595564768 348282625 /nfs/dbraw/zinc/28/26/25/348282625.db2.gz GUTZONCUNFNPPS-HOTGVXAUSA-N 1 1 241.378 3.893 20 0 BHADMO Cc1ccccc1[C@@H]1CC[N@H+]([C@@H]2C=CCCC2)C1 ZINC000595564770 348283311 /nfs/dbraw/zinc/28/33/11/348283311.db2.gz GUTZONCUNFNPPS-HZPDHXFCSA-N 1 1 241.378 3.893 20 0 BHADMO Cc1ccccc1[C@H]1CC[N@H+]([C@@H]2C=CCCC2)C1 ZINC000595564771 348282944 /nfs/dbraw/zinc/28/29/44/348282944.db2.gz GUTZONCUNFNPPS-JKSUJKDBSA-N 1 1 241.378 3.893 20 0 BHADMO COc1ccc(C[N@@H+](C)[C@H]2C=CCCC2)cc1C ZINC000595572166 490162249 /nfs/dbraw/zinc/16/22/49/490162249.db2.gz UZIXHNJTYHGNNY-HNNXBMFYSA-N 1 1 245.366 3.544 20 0 BHADMO COc1ccc(C[N@@H+](C)[C@@H]2C=CCCC2)cc1C ZINC000595572167 490162335 /nfs/dbraw/zinc/16/23/35/490162335.db2.gz UZIXHNJTYHGNNY-OAHLLOKOSA-N 1 1 245.366 3.544 20 0 BHADMO CSCC[N@@H+](Cc1ccsc1)C(C)(C)C ZINC000595600850 348295909 /nfs/dbraw/zinc/29/59/09/348295909.db2.gz KPXJQDIVONFPQS-UHFFFAOYSA-N 1 1 243.441 3.712 20 0 BHADMO CC12CC(C1)C[N@H+]2CCSC1CCCCC1 ZINC000595920801 348401663 /nfs/dbraw/zinc/40/16/63/348401663.db2.gz WSGJWGKGZKVDNC-UHFFFAOYSA-N 1 1 239.428 3.537 20 0 BHADMO CCCC[N@@H+](CC)[C@@H](C)Cc1ccc(OC)cc1 ZINC000596222406 348470149 /nfs/dbraw/zinc/47/01/49/348470149.db2.gz CZWCICRDCZUSBC-AWEZNQCLSA-N 1 1 249.398 3.748 20 0 BHADMO CCCC[N@@H+](CC)[C@H](C)Cc1ccc(OC)cc1 ZINC000596222407 348470226 /nfs/dbraw/zinc/47/02/26/348470226.db2.gz CZWCICRDCZUSBC-CQSZACIVSA-N 1 1 249.398 3.748 20 0 BHADMO 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C[C@@H](C[N@H+]1CCC[C@H]1C1CC1)c1ccccc1 ZINC000604884572 350196313 /nfs/dbraw/zinc/19/63/13/350196313.db2.gz RFHHJEAISQLTOL-BBRMVZONSA-N 1 1 229.367 3.665 20 0 BHADMO C[C@H](C[N@H+]1CCC[C@H]1C1CC1)c1ccccc1 ZINC000604884573 350196187 /nfs/dbraw/zinc/19/61/87/350196187.db2.gz RFHHJEAISQLTOL-CJNGLKHVSA-N 1 1 229.367 3.665 20 0 BHADMO C[C@H](C[N@H+]1CCC[C@@H]1C1CC1)c1ccccc1 ZINC000604884574 350196411 /nfs/dbraw/zinc/19/64/11/350196411.db2.gz RFHHJEAISQLTOL-CZUORRHYSA-N 1 1 229.367 3.665 20 0 BHADMO C[C@@H](C[N@H+]1CCC[C@@H]1C1CC1)c1ccccc1 ZINC000604884575 350196227 /nfs/dbraw/zinc/19/62/27/350196227.db2.gz RFHHJEAISQLTOL-XJKSGUPXSA-N 1 1 229.367 3.665 20 0 BHADMO CCCC[N@@H+](CC)C[C@H](C)c1ccccc1 ZINC000604884797 350196204 /nfs/dbraw/zinc/19/62/04/350196204.db2.gz HFTGTMXRSQCEKB-AWEZNQCLSA-N 1 1 219.372 3.912 20 0 BHADMO CCCC[N@@H+](CC)C[C@@H](C)c1ccccc1 ZINC000604884798 350196693 /nfs/dbraw/zinc/19/66/93/350196693.db2.gz HFTGTMXRSQCEKB-CQSZACIVSA-N 1 1 219.372 3.912 20 0 BHADMO CC[C@H]1CCC[N@@H+](C[C@@H](C)c2ccccc2)C1 ZINC000604884801 350196500 /nfs/dbraw/zinc/19/65/00/350196500.db2.gz HGSCKEZLBDQCHU-CABCVRRESA-N 1 1 231.383 3.912 20 0 BHADMO CC[C@H]1CCC[N@@H+](C[C@H](C)c2ccccc2)C1 ZINC000604884802 350196235 /nfs/dbraw/zinc/19/62/35/350196235.db2.gz HGSCKEZLBDQCHU-GJZGRUSLSA-N 1 1 231.383 3.912 20 0 BHADMO CC[C@@H]1CCC[N@@H+](C[C@@H](C)c2ccccc2)C1 ZINC000604884803 350196428 /nfs/dbraw/zinc/19/64/28/350196428.db2.gz HGSCKEZLBDQCHU-HUUCEWRRSA-N 1 1 231.383 3.912 20 0 BHADMO CC[C@@H]1CCC[N@@H+](C[C@H](C)c2ccccc2)C1 ZINC000604884804 350196520 /nfs/dbraw/zinc/19/65/20/350196520.db2.gz HGSCKEZLBDQCHU-LSDHHAIUSA-N 1 1 231.383 3.912 20 0 BHADMO CC(C)[C@H](C)[N@@H+](C)C[C@H](C)c1ccccc1 ZINC000604884851 350196442 /nfs/dbraw/zinc/19/64/42/350196442.db2.gz PARSMMBESNKVGY-KBPBESRZSA-N 1 1 219.372 3.766 20 0 BHADMO CC(C)[C@H](C)[N@@H+](C)C[C@@H](C)c1ccccc1 ZINC000604884852 350196631 /nfs/dbraw/zinc/19/66/31/350196631.db2.gz PARSMMBESNKVGY-KGLIPLIRSA-N 1 1 219.372 3.766 20 0 BHADMO CC(C)[C@@H](C)[N@@H+](C)C[C@H](C)c1ccccc1 ZINC000604884853 350196667 /nfs/dbraw/zinc/19/66/67/350196667.db2.gz PARSMMBESNKVGY-UONOGXRCSA-N 1 1 219.372 3.766 20 0 BHADMO CC(C)[C@@H](C)[N@@H+](C)C[C@@H](C)c1ccccc1 ZINC000604884854 350196570 /nfs/dbraw/zinc/19/65/70/350196570.db2.gz PARSMMBESNKVGY-ZIAGYGMSSA-N 1 1 219.372 3.766 20 0 BHADMO C[C@@H](C[N@H+]1CCC[C@@H](C)CC1)c1ccccc1 ZINC000604884928 350196554 /nfs/dbraw/zinc/19/65/54/350196554.db2.gz UNXWOXHAUGNSJP-CABCVRRESA-N 1 1 231.383 3.912 20 0 BHADMO C[C@@H](C[N@H+]1CCC[C@H](C)CC1)c1ccccc1 ZINC000604884929 350196698 /nfs/dbraw/zinc/19/66/98/350196698.db2.gz UNXWOXHAUGNSJP-GJZGRUSLSA-N 1 1 231.383 3.912 20 0 BHADMO C[C@H](C[N@H+]1CCC[C@@H](C)CC1)c1ccccc1 ZINC000604884930 350196493 /nfs/dbraw/zinc/19/64/93/350196493.db2.gz UNXWOXHAUGNSJP-HUUCEWRRSA-N 1 1 231.383 3.912 20 0 BHADMO C[C@H](C[N@H+]1CCC[C@H](C)CC1)c1ccccc1 ZINC000604884931 350196156 /nfs/dbraw/zinc/19/61/56/350196156.db2.gz UNXWOXHAUGNSJP-LSDHHAIUSA-N 1 1 231.383 3.912 20 0 BHADMO CCC[N@@H+](C[C@H](C)c1ccccc1)CC1CC1 ZINC000604885044 350196288 /nfs/dbraw/zinc/19/62/88/350196288.db2.gz BPFDLTLKWHRKLO-AWEZNQCLSA-N 1 1 231.383 3.912 20 0 BHADMO CCC[N@@H+](C[C@@H](C)c1ccccc1)CC1CC1 ZINC000604885045 350196454 /nfs/dbraw/zinc/19/64/54/350196454.db2.gz BPFDLTLKWHRKLO-CQSZACIVSA-N 1 1 231.383 3.912 20 0 BHADMO CC[N@@H+](C[C@@H](C)c1ccccc1)CC1CC1 ZINC000604885104 350196673 /nfs/dbraw/zinc/19/66/73/350196673.db2.gz MQCPJWDRXVVOBO-CYBMUJFWSA-N 1 1 217.356 3.522 20 0 BHADMO CC[N@@H+](C[C@H](C)c1ccccc1)CC1CC1 ZINC000604885105 350196547 /nfs/dbraw/zinc/19/65/47/350196547.db2.gz MQCPJWDRXVVOBO-ZDUSSCGKSA-N 1 1 217.356 3.522 20 0 BHADMO CC[N@@H+](CC(C)C)C[C@H](C)c1ccccc1 ZINC000604885252 350194528 /nfs/dbraw/zinc/19/45/28/350194528.db2.gz TXGUVHDEGALGDB-AWEZNQCLSA-N 1 1 219.372 3.768 20 0 BHADMO CC[N@@H+](CC(C)C)C[C@@H](C)c1ccccc1 ZINC000604885253 350194121 /nfs/dbraw/zinc/19/41/21/350194121.db2.gz TXGUVHDEGALGDB-CQSZACIVSA-N 1 1 219.372 3.768 20 0 BHADMO CC(C)=CC[N@@H+](CCc1ccc(F)cc1)C1CC1 ZINC000604903149 350197363 /nfs/dbraw/zinc/19/73/63/350197363.db2.gz QSIZKLCUBXECHK-UHFFFAOYSA-N 1 1 247.357 3.799 20 0 BHADMO CCc1ccc(C[N@@H+](C)C2CCCC2)cc1 ZINC000604997025 350233624 /nfs/dbraw/zinc/23/36/24/350233624.db2.gz FAQKTCWBAQNNAJ-UHFFFAOYSA-N 1 1 217.356 3.623 20 0 BHADMO CCc1ccc(C[N@@H+](CC2CC2)C(C)C)cc1 ZINC000604997462 350234029 /nfs/dbraw/zinc/23/40/29/350234029.db2.gz YYUUEDNFDZZWFL-UHFFFAOYSA-N 1 1 231.383 3.869 20 0 BHADMO CCc1ccc(C[N@H+]2CCC[C@H]2C2CC2)cc1 ZINC000604997739 537872472 /nfs/dbraw/zinc/87/24/72/537872472.db2.gz GCXSXQHWOWBCNH-INIZCTEOSA-N 1 1 229.367 3.623 20 0 BHADMO CCc1ccc(C[N@H+]2CCC[C@@H]2C2CC2)cc1 ZINC000604997740 537870717 /nfs/dbraw/zinc/87/07/17/537870717.db2.gz GCXSXQHWOWBCNH-MRXNPFEDSA-N 1 1 229.367 3.623 20 0 BHADMO CCc1ccc(C[N@@H+](CC)Cc2ccoc2)cc1 ZINC000604997813 537872593 /nfs/dbraw/zinc/87/25/93/537872593.db2.gz LOLPAURUMCTZGM-UHFFFAOYSA-N 1 1 243.350 3.864 20 0 BHADMO CCc1ccc(C[N@@H+]2CCC[C@@H]2CC)cc1 ZINC000604997814 398123040 /nfs/dbraw/zinc/12/30/40/398123040.db2.gz LQWXALURCKQOKJ-HNNXBMFYSA-N 1 1 217.356 3.623 20 0 BHADMO CCc1ccc(C[N@@H+]2CCC[C@H]2CC)cc1 ZINC000604997815 398123313 /nfs/dbraw/zinc/12/33/13/398123313.db2.gz LQWXALURCKQOKJ-OAHLLOKOSA-N 1 1 217.356 3.623 20 0 BHADMO CCc1ccc(C[N@@H+](C)C(C)(C)CC)cc1 ZINC000604998707 350234861 /nfs/dbraw/zinc/23/48/61/350234861.db2.gz UDLVUKLWWZLVTF-UHFFFAOYSA-N 1 1 219.372 3.869 20 0 BHADMO CC[C@@H]1CCC[N@@H+](Cc2cccc(F)c2)CC1 ZINC000604998788 350235321 /nfs/dbraw/zinc/23/53/21/350235321.db2.gz BJWHRTNDPMABDU-CYBMUJFWSA-N 1 1 235.346 3.838 20 0 BHADMO CC[C@H]1CCC[N@@H+](Cc2cccc(F)c2)CC1 ZINC000604998789 350235507 /nfs/dbraw/zinc/23/55/07/350235507.db2.gz BJWHRTNDPMABDU-ZDUSSCGKSA-N 1 1 235.346 3.838 20 0 BHADMO CC[C@@H]1CCC[N@@H+](Cc2ccccc2F)CC1 ZINC000604998820 350235551 /nfs/dbraw/zinc/23/55/51/350235551.db2.gz FCYPLGRHBKKJTL-CYBMUJFWSA-N 1 1 235.346 3.838 20 0 BHADMO CC[C@H]1CCC[N@@H+](Cc2ccccc2F)CC1 ZINC000604998821 350235325 /nfs/dbraw/zinc/23/53/25/350235325.db2.gz FCYPLGRHBKKJTL-ZDUSSCGKSA-N 1 1 235.346 3.838 20 0 BHADMO CC[C@H]1CCC[N@@H+](CCOc2ccccc2)CC1 ZINC000604998850 350235698 /nfs/dbraw/zinc/23/56/98/350235698.db2.gz HKNYGPKQXBAAMW-HNNXBMFYSA-N 1 1 247.382 3.578 20 0 BHADMO CC[C@@H]1CCC[N@@H+](CCOc2ccccc2)CC1 ZINC000604998851 350235563 /nfs/dbraw/zinc/23/55/63/350235563.db2.gz HKNYGPKQXBAAMW-OAHLLOKOSA-N 1 1 247.382 3.578 20 0 BHADMO CC[C@H]1CCC[N@H+]([C@@H](C)c2ccncc2)CC1 ZINC000604998854 350235354 /nfs/dbraw/zinc/23/53/54/350235354.db2.gz IAVYPNABSZGXRU-KBPBESRZSA-N 1 1 232.371 3.655 20 0 BHADMO CC[C@H]1CCC[N@H+]([C@H](C)c2ccncc2)CC1 ZINC000604998855 350235992 /nfs/dbraw/zinc/23/59/92/350235992.db2.gz IAVYPNABSZGXRU-KGLIPLIRSA-N 1 1 232.371 3.655 20 0 BHADMO CC[C@@H]1CCC[N@H+]([C@@H](C)c2ccncc2)CC1 ZINC000604998856 350235828 /nfs/dbraw/zinc/23/58/28/350235828.db2.gz IAVYPNABSZGXRU-UONOGXRCSA-N 1 1 232.371 3.655 20 0 BHADMO CC[C@@H]1CCC[N@H+]([C@H](C)c2ccncc2)CC1 ZINC000604998857 350235855 /nfs/dbraw/zinc/23/58/55/350235855.db2.gz IAVYPNABSZGXRU-ZIAGYGMSSA-N 1 1 232.371 3.655 20 0 BHADMO CC[C@@H]1CCC[N@@H+](CC2CCCC2)CC1 ZINC000604999230 350235973 /nfs/dbraw/zinc/23/59/73/350235973.db2.gz WZGCRBNHJRRAKK-CYBMUJFWSA-N 1 1 209.377 3.689 20 0 BHADMO CC[C@H]1CCC[N@@H+](CC2CCCC2)CC1 ZINC000604999231 350235525 /nfs/dbraw/zinc/23/55/25/350235525.db2.gz WZGCRBNHJRRAKK-ZDUSSCGKSA-N 1 1 209.377 3.689 20 0 BHADMO CC[C@@H](c1ccccc1)[N@H+]1CCCOC(C)(C)C1 ZINC000604999814 350235715 /nfs/dbraw/zinc/23/57/15/350235715.db2.gz SNJBMSBCOZMQLZ-HNNXBMFYSA-N 1 1 247.382 3.639 20 0 BHADMO CC[C@H](c1ccccc1)[N@H+]1CCCOC(C)(C)C1 ZINC000604999815 350236026 /nfs/dbraw/zinc/23/60/26/350236026.db2.gz SNJBMSBCOZMQLZ-OAHLLOKOSA-N 1 1 247.382 3.639 20 0 BHADMO CC(C)[C@@H]1CCCC[N@H+]1Cc1ccc(F)cc1 ZINC000605000418 350235691 /nfs/dbraw/zinc/23/56/91/350235691.db2.gz PKFKDZGJQBVKNM-HNNXBMFYSA-N 1 1 235.346 3.836 20 0 BHADMO CC(C)[C@H]1CCCC[N@H+]1Cc1ccc(F)cc1 ZINC000605000419 350235726 /nfs/dbraw/zinc/23/57/26/350235726.db2.gz PKFKDZGJQBVKNM-OAHLLOKOSA-N 1 1 235.346 3.836 20 0 BHADMO CC(C)[C@@H]1CCCC[N@H+]1CC1CCCC1 ZINC000605000621 350236681 /nfs/dbraw/zinc/23/66/81/350236681.db2.gz LHKBNDPBPMZYJA-AWEZNQCLSA-N 1 1 209.377 3.687 20 0 BHADMO CC(C)[C@H]1CCCC[N@H+]1CC1CCCC1 ZINC000605000622 350236435 /nfs/dbraw/zinc/23/64/35/350236435.db2.gz LHKBNDPBPMZYJA-CQSZACIVSA-N 1 1 209.377 3.687 20 0 BHADMO CCCCC[N@@H+](C)Cc1ccc(F)cc1F ZINC000605149736 350258275 /nfs/dbraw/zinc/25/82/75/350258275.db2.gz FLRJFNRXOPDRDC-UHFFFAOYSA-N 1 1 227.298 3.587 20 0 BHADMO CCCCC[N@@H+](C)Cc1ccc(F)c(F)c1 ZINC000605149781 350258262 /nfs/dbraw/zinc/25/82/62/350258262.db2.gz PQWLTQISZBYOMH-UHFFFAOYSA-N 1 1 227.298 3.587 20 0 BHADMO CCCCC[N@@H+](C)[C@H](C)c1ccc(OC)cc1 ZINC000605149784 350258421 /nfs/dbraw/zinc/25/84/21/350258421.db2.gz PZYCYOZHQUSXED-CYBMUJFWSA-N 1 1 235.371 3.878 20 0 BHADMO CCCCC[N@@H+](C)[C@@H](C)c1ccc(OC)cc1 ZINC000605149785 350258287 /nfs/dbraw/zinc/25/82/87/350258287.db2.gz PZYCYOZHQUSXED-ZDUSSCGKSA-N 1 1 235.371 3.878 20 0 BHADMO CCCCC[N@@H+](Cc1ccc(C)o1)C1CC1 ZINC000605149855 350259018 /nfs/dbraw/zinc/25/90/18/350259018.db2.gz HEPVQVUESDCZFF-UHFFFAOYSA-N 1 1 221.344 3.743 20 0 BHADMO CCCCC[N@@H+](C1CC1)C1CCCCC1 ZINC000605149895 350258851 /nfs/dbraw/zinc/25/88/51/350258851.db2.gz LZAJCIZMFZBFAG-UHFFFAOYSA-N 1 1 209.377 3.974 20 0 BHADMO CCCCC[N@@H+](C)[C@H](C)c1cccs1 ZINC000605149974 350259586 /nfs/dbraw/zinc/25/95/86/350259586.db2.gz ZWUMLQHTLDKETK-LLVKDONJSA-N 1 1 211.374 3.931 20 0 BHADMO CCCCC[N@@H+](C)[C@@H](C)c1cccs1 ZINC000605149975 350259314 /nfs/dbraw/zinc/25/93/14/350259314.db2.gz ZWUMLQHTLDKETK-NSHDSACASA-N 1 1 211.374 3.931 20 0 BHADMO CCCCC[N@H+]1CCC[C@H]1c1ccc(O)cc1 ZINC000605149984 350259043 /nfs/dbraw/zinc/25/90/43/350259043.db2.gz BFMYXKSQNHEQMC-HNNXBMFYSA-N 1 1 233.355 3.719 20 0 BHADMO CCCCC[N@H+]1CCC[C@@H]1c1ccc(O)cc1 ZINC000605149985 350259164 /nfs/dbraw/zinc/25/91/64/350259164.db2.gz BFMYXKSQNHEQMC-OAHLLOKOSA-N 1 1 233.355 3.719 20 0 BHADMO CCCCC[N@@H+](CC)Cc1ccc(OC)cc1 ZINC000605149991 350259373 /nfs/dbraw/zinc/25/93/73/350259373.db2.gz BSTKAYQNPIRABR-UHFFFAOYSA-N 1 1 235.371 3.707 20 0 BHADMO CCCCC[N@@H+](Cc1cccc(F)c1)C1CC1 ZINC000605150001 350259271 /nfs/dbraw/zinc/25/92/71/350259271.db2.gz DJGCPQKQTAGGAK-UHFFFAOYSA-N 1 1 235.346 3.980 20 0 BHADMO CCCCC[N@H+]1CCC[C@H]1C1CCCC1 ZINC000605150087 350259114 /nfs/dbraw/zinc/25/91/14/350259114.db2.gz OZCPOZOUOXWAOK-AWEZNQCLSA-N 1 1 209.377 3.831 20 0 BHADMO CCCCC[N@H+]1CCC[C@@H]1C1CCCC1 ZINC000605150088 350259181 /nfs/dbraw/zinc/25/91/81/350259181.db2.gz OZCPOZOUOXWAOK-CQSZACIVSA-N 1 1 209.377 3.831 20 0 BHADMO CCCCC[N@H+]1CC[C@H](c2ccccc2)C1 ZINC000605150175 350260651 /nfs/dbraw/zinc/26/06/51/350260651.db2.gz GIJMSXCBSKJXRB-HNNXBMFYSA-N 1 1 217.356 3.666 20 0 BHADMO CCCCC[N@H+]1CC[C@@H](c2ccccc2)C1 ZINC000605150176 350260682 /nfs/dbraw/zinc/26/06/82/350260682.db2.gz GIJMSXCBSKJXRB-OAHLLOKOSA-N 1 1 217.356 3.666 20 0 BHADMO CCCCC[N@@H+](CC)CCc1cccs1 ZINC000605150196 350260191 /nfs/dbraw/zinc/26/01/91/350260191.db2.gz IYTDKSFZWFTSSE-UHFFFAOYSA-N 1 1 225.401 3.803 20 0 BHADMO CCCCC[N@@H+](CCOC)[C@@H](C)c1ccccc1 ZINC000605150246 350260239 /nfs/dbraw/zinc/26/02/39/350260239.db2.gz RKNJAVSBVVJJBN-HNNXBMFYSA-N 1 1 249.398 3.886 20 0 BHADMO CCCCC[N@@H+](CCOC)[C@H](C)c1ccccc1 ZINC000605150247 350260657 /nfs/dbraw/zinc/26/06/57/350260657.db2.gz RKNJAVSBVVJJBN-OAHLLOKOSA-N 1 1 249.398 3.886 20 0 BHADMO CCCCC[N@H+]1CC[C@H](c2ccc(OC)cc2)C1 ZINC000605150305 350259976 /nfs/dbraw/zinc/25/99/76/350259976.db2.gz FGPZOEQHRODGRP-HNNXBMFYSA-N 1 1 247.382 3.675 20 0 BHADMO CCCCC[N@H+]1CC[C@@H](c2ccc(OC)cc2)C1 ZINC000605150306 350260315 /nfs/dbraw/zinc/26/03/15/350260315.db2.gz FGPZOEQHRODGRP-OAHLLOKOSA-N 1 1 247.382 3.675 20 0 BHADMO CCCCC[N@H+]1CC[C@H](c2ccccc2C)C1 ZINC000605150394 350260249 /nfs/dbraw/zinc/26/02/49/350260249.db2.gz UGIMQOOMVHXKHY-HNNXBMFYSA-N 1 1 231.383 3.975 20 0 BHADMO CCCCC[N@H+]1CC[C@@H](c2ccccc2C)C1 ZINC000605150395 350260032 /nfs/dbraw/zinc/26/00/32/350260032.db2.gz UGIMQOOMVHXKHY-OAHLLOKOSA-N 1 1 231.383 3.975 20 0 BHADMO CCCCC[N@@H+](C)C[C@H](C)c1ccccc1 ZINC000605150415 350260672 /nfs/dbraw/zinc/26/06/72/350260672.db2.gz XGQYNVPICPXJRM-AWEZNQCLSA-N 1 1 219.372 3.912 20 0 BHADMO CCCCC[N@@H+](C)C[C@@H](C)c1ccccc1 ZINC000605150416 350260297 /nfs/dbraw/zinc/26/02/97/350260297.db2.gz XGQYNVPICPXJRM-CQSZACIVSA-N 1 1 219.372 3.912 20 0 BHADMO CCCCC[N@@H+](C)Cc1ccc(C)s1 ZINC000605150477 350260985 /nfs/dbraw/zinc/26/09/85/350260985.db2.gz VMXCZZLSYHDXRT-UHFFFAOYSA-N 1 1 211.374 3.679 20 0 BHADMO c1ccc(SCC[N@H+]2CCC[C@H]2C2CC2)cc1 ZINC000605150515 350261105 /nfs/dbraw/zinc/26/11/05/350261105.db2.gz HMEONIDGYVWRBZ-HNNXBMFYSA-N 1 1 247.407 3.653 20 0 BHADMO c1ccc(SCC[N@H+]2CCC[C@@H]2C2CC2)cc1 ZINC000605150516 350261610 /nfs/dbraw/zinc/26/16/10/350261610.db2.gz HMEONIDGYVWRBZ-OAHLLOKOSA-N 1 1 247.407 3.653 20 0 BHADMO CCCCC[N@H+]1CCCO[C@H](c2ccccc2)C1 ZINC000605150706 350261411 /nfs/dbraw/zinc/26/14/11/350261411.db2.gz QZTQWGNKVBJAED-INIZCTEOSA-N 1 1 247.382 3.640 20 0 BHADMO CCCCC[N@H+]1CCCO[C@@H](c2ccccc2)C1 ZINC000605150707 350261120 /nfs/dbraw/zinc/26/11/20/350261120.db2.gz QZTQWGNKVBJAED-MRXNPFEDSA-N 1 1 247.382 3.640 20 0 BHADMO CCCCC[N@H+]1CCCc2sccc2C1 ZINC000605150775 350261624 /nfs/dbraw/zinc/26/16/24/350261624.db2.gz BCQPZMVFLWLUMQ-UHFFFAOYSA-N 1 1 223.385 3.687 20 0 BHADMO CCCCC[N@H+]1CCC[C@H](Oc2ccccc2)C1 ZINC000605150922 350262210 /nfs/dbraw/zinc/26/22/10/350262210.db2.gz FNGJNAFUKOTIIR-INIZCTEOSA-N 1 1 247.382 3.720 20 0 BHADMO CCCCC[N@H+]1CCC[C@@H](Oc2ccccc2)C1 ZINC000605150923 350262487 /nfs/dbraw/zinc/26/24/87/350262487.db2.gz FNGJNAFUKOTIIR-MRXNPFEDSA-N 1 1 247.382 3.720 20 0 BHADMO CCC[N@@H+](CCCCOC)Cc1ccc(C)cc1 ZINC000605150936 350261911 /nfs/dbraw/zinc/26/19/11/350261911.db2.gz HGXCAGPSNOIYNH-UHFFFAOYSA-N 1 1 249.398 3.634 20 0 BHADMO CCCCC[N@@H+](C)[C@H]1CCc2ccccc2C1 ZINC000605151012 350262055 /nfs/dbraw/zinc/26/20/55/350262055.db2.gz WDKDQUNOOLNHQN-INIZCTEOSA-N 1 1 231.383 3.666 20 0 BHADMO CCCCC[N@@H+](C)[C@@H]1CCc2ccccc2C1 ZINC000605151013 350262383 /nfs/dbraw/zinc/26/23/83/350262383.db2.gz WDKDQUNOOLNHQN-MRXNPFEDSA-N 1 1 231.383 3.666 20 0 BHADMO CC(C)CC[N@H+]1CCS[C@H](c2ccccc2)C1 ZINC000605154256 350264027 /nfs/dbraw/zinc/26/40/27/350264027.db2.gz MLMWRGGARMOTNT-HNNXBMFYSA-N 1 1 249.423 3.823 20 0 BHADMO CC(C)CC[N@H+]1CCS[C@@H](c2ccccc2)C1 ZINC000605154257 350264316 /nfs/dbraw/zinc/26/43/16/350264316.db2.gz MLMWRGGARMOTNT-OAHLLOKOSA-N 1 1 249.423 3.823 20 0 BHADMO CC[N@H+]1CCCCC[C@H]1c1cccc(C)c1 ZINC000605156963 350262107 /nfs/dbraw/zinc/26/21/07/350262107.db2.gz ABASRNBQDKXBIX-HNNXBMFYSA-N 1 1 217.356 3.932 20 0 BHADMO CC[N@H+]1CCCCC[C@@H]1c1cccc(C)c1 ZINC000605156964 350262353 /nfs/dbraw/zinc/26/23/53/350262353.db2.gz ABASRNBQDKXBIX-OAHLLOKOSA-N 1 1 217.356 3.932 20 0 BHADMO CCc1ccc(C[N@H+]2CCS[C@H](C)[C@H]2C)cc1 ZINC000605317201 342750177 /nfs/dbraw/zinc/75/01/77/342750177.db2.gz ILQOHZZMFSNTGL-CHWSQXEVSA-N 1 1 249.423 3.575 20 0 BHADMO CCc1ccc(C[N@H+]2CCS[C@@H](C)[C@H]2C)cc1 ZINC000605317202 342750193 /nfs/dbraw/zinc/75/01/93/342750193.db2.gz ILQOHZZMFSNTGL-OLZOCXBDSA-N 1 1 249.423 3.575 20 0 BHADMO CCc1ccc(C[N@H+]2CCS[C@H](C)[C@@H]2C)cc1 ZINC000605317203 342750494 /nfs/dbraw/zinc/75/04/94/342750494.db2.gz ILQOHZZMFSNTGL-QWHCGFSZSA-N 1 1 249.423 3.575 20 0 BHADMO CCc1ccc(C[N@H+]2CCS[C@@H](C)[C@@H]2C)cc1 ZINC000605317204 342750469 /nfs/dbraw/zinc/75/04/69/342750469.db2.gz ILQOHZZMFSNTGL-STQMWFEESA-N 1 1 249.423 3.575 20 0 BHADMO Cc1cc(C)cc(C[N@@H+]2CCS[C@@H](C)[C@@H]2C)c1 ZINC000605317311 342750375 /nfs/dbraw/zinc/75/03/75/342750375.db2.gz RJTNAZHAZLAKLY-KBPBESRZSA-N 1 1 249.423 3.629 20 0 BHADMO Cc1cc(C)cc(C[N@@H+]2CCS[C@@H](C)[C@H]2C)c1 ZINC000605317312 342750429 /nfs/dbraw/zinc/75/04/29/342750429.db2.gz RJTNAZHAZLAKLY-KGLIPLIRSA-N 1 1 249.423 3.629 20 0 BHADMO Cc1cc(C)cc(C[N@@H+]2CCS[C@H](C)[C@@H]2C)c1 ZINC000605317313 342750435 /nfs/dbraw/zinc/75/04/35/342750435.db2.gz RJTNAZHAZLAKLY-UONOGXRCSA-N 1 1 249.423 3.629 20 0 BHADMO Cc1cc(C)cc(C[N@@H+]2CCS[C@H](C)[C@H]2C)c1 ZINC000605317314 342750369 /nfs/dbraw/zinc/75/03/69/342750369.db2.gz RJTNAZHAZLAKLY-ZIAGYGMSSA-N 1 1 249.423 3.629 20 0 BHADMO CC(C)C[N@H+]1CCS[C@@H](C)[C@@H]1c1ccccc1 ZINC000605317705 342750275 /nfs/dbraw/zinc/75/02/75/342750275.db2.gz MBHOYUCXQXIHKD-DZGCQCFKSA-N 1 1 249.423 3.821 20 0 BHADMO CC(C)C[N@H+]1CCS[C@H](C)[C@H]1c1ccccc1 ZINC000605317706 342750394 /nfs/dbraw/zinc/75/03/94/342750394.db2.gz MBHOYUCXQXIHKD-HIFRSBDPSA-N 1 1 249.423 3.821 20 0 BHADMO CC(C)C[N@H+]1CCS[C@H](C)[C@@H]1c1ccccc1 ZINC000605317707 342750401 /nfs/dbraw/zinc/75/04/01/342750401.db2.gz MBHOYUCXQXIHKD-UKRRQHHQSA-N 1 1 249.423 3.821 20 0 BHADMO CC(C)C[N@H+]1CCS[C@@H](C)[C@H]1c1ccccc1 ZINC000605317708 342750477 /nfs/dbraw/zinc/75/04/77/342750477.db2.gz MBHOYUCXQXIHKD-ZFWWWQNUSA-N 1 1 249.423 3.821 20 0 BHADMO CCCC[N@H+]1CCS[C@@H](C)[C@@H]1c1ccccc1 ZINC000605317905 342750345 /nfs/dbraw/zinc/75/03/45/342750345.db2.gz WSHWFGWSVLPEGF-DZGCQCFKSA-N 1 1 249.423 3.965 20 0 BHADMO CCCC[N@H+]1CCS[C@H](C)[C@H]1c1ccccc1 ZINC000605317906 342750217 /nfs/dbraw/zinc/75/02/17/342750217.db2.gz WSHWFGWSVLPEGF-HIFRSBDPSA-N 1 1 249.423 3.965 20 0 BHADMO CCCC[N@H+]1CCS[C@H](C)[C@@H]1c1ccccc1 ZINC000605317907 342750508 /nfs/dbraw/zinc/75/05/08/342750508.db2.gz WSHWFGWSVLPEGF-UKRRQHHQSA-N 1 1 249.423 3.965 20 0 BHADMO CCCC[N@H+]1CCS[C@@H](C)[C@H]1c1ccccc1 ZINC000605317908 342750289 /nfs/dbraw/zinc/75/02/89/342750289.db2.gz WSHWFGWSVLPEGF-ZFWWWQNUSA-N 1 1 249.423 3.965 20 0 BHADMO Cc1ccc(CC[N@H+](C)Cc2ccsc2)cc1 ZINC000605572200 345968087 /nfs/dbraw/zinc/96/80/87/345968087.db2.gz VBTOWJUCHSRFPY-UHFFFAOYSA-N 1 1 245.391 3.731 20 0 BHADMO Cc1ccc(CC[N@H+](C)C2CCCCC2)cc1 ZINC000605572571 345967989 /nfs/dbraw/zinc/96/79/89/345967989.db2.gz DYXWCPXCGWEYQG-UHFFFAOYSA-N 1 1 231.383 3.802 20 0 BHADMO Cc1ccc(CC[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1 ZINC000605572881 345968139 /nfs/dbraw/zinc/96/81/39/345968139.db2.gz UCOOJCNVDRZJIG-GASCZTMLSA-N 1 1 231.383 3.515 20 0 BHADMO Cc1ccc(CC[N@H+](CC(C)C)C(C)C)cc1 ZINC000605573090 345968227 /nfs/dbraw/zinc/96/82/27/345968227.db2.gz AMZQOEBQDJTXHP-UHFFFAOYSA-N 1 1 233.399 3.904 20 0 BHADMO Cc1ccc(CC[N@H+]2CCC[C@H]2C2CCC2)cc1 ZINC000605573091 345968431 /nfs/dbraw/zinc/96/84/31/345968431.db2.gz HFXHVPAHDXLGPV-KRWDZBQOSA-N 1 1 243.394 3.802 20 0 BHADMO Cc1ccc(CC[N@H+]2CCC[C@@H]2C2CCC2)cc1 ZINC000605573101 345968041 /nfs/dbraw/zinc/96/80/41/345968041.db2.gz HFXHVPAHDXLGPV-QGZVFWFLSA-N 1 1 243.394 3.802 20 0 BHADMO Cc1ccc(CC[N@H+](C)[C@@H](C)C(C)(C)C)cc1 ZINC000605573150 345968389 /nfs/dbraw/zinc/96/83/89/345968389.db2.gz DTBNIURGRLDGBS-AWEZNQCLSA-N 1 1 233.399 3.904 20 0 BHADMO Cc1ccc(CC[N@H+](C)[C@H](C)C(C)(C)C)cc1 ZINC000605573151 345968173 /nfs/dbraw/zinc/96/81/73/345968173.db2.gz DTBNIURGRLDGBS-CQSZACIVSA-N 1 1 233.399 3.904 20 0 BHADMO Cc1ccc(CC[N@@H+](C2CC2)C2CCCC2)cc1 ZINC000605573195 345968122 /nfs/dbraw/zinc/96/81/22/345968122.db2.gz HAJCUMWOTRPTRS-UHFFFAOYSA-N 1 1 243.394 3.945 20 0 BHADMO CC[N@@H+](CCc1ccc(C)cc1)Cc1ccoc1 ZINC000605573320 345968002 /nfs/dbraw/zinc/96/80/02/345968002.db2.gz NJUCCDKMGCIFJV-UHFFFAOYSA-N 1 1 243.350 3.653 20 0 BHADMO CCCC[N@@H+](CCc1ccc(C)cc1)C1CC1 ZINC000605573326 345968370 /nfs/dbraw/zinc/96/83/70/345968370.db2.gz NEQYLPITKBEFOW-UHFFFAOYSA-N 1 1 231.383 3.802 20 0 BHADMO Cc1ccc(CC[N@H+](CC(C)C)C2CC2)cc1 ZINC000605573477 345968182 /nfs/dbraw/zinc/96/81/82/345968182.db2.gz STRJUTHOLUDADN-UHFFFAOYSA-N 1 1 231.383 3.658 20 0 BHADMO CCCC[N@@H+](CC)CCc1ccc(C)cc1 ZINC000605573490 345968096 /nfs/dbraw/zinc/96/80/96/345968096.db2.gz WMSKVAHNCJPSBK-UHFFFAOYSA-N 1 1 219.372 3.660 20 0 BHADMO CC[C@H]1CCC[N@@H+](CCc2ccc(C)cc2)C1 ZINC000605573917 345968168 /nfs/dbraw/zinc/96/81/68/345968168.db2.gz KASVPPIAWWPEFQ-HNNXBMFYSA-N 1 1 231.383 3.660 20 0 BHADMO CC[C@@H]1CCC[N@@H+](CCc2ccc(C)cc2)C1 ZINC000605573918 345969004 /nfs/dbraw/zinc/96/90/04/345969004.db2.gz KASVPPIAWWPEFQ-OAHLLOKOSA-N 1 1 231.383 3.660 20 0 BHADMO CCC[C@H](C)[N@@H+](C)CCc1ccc(C)cc1 ZINC000605573926 345968983 /nfs/dbraw/zinc/96/89/83/345968983.db2.gz LVRNJSSVTFZWQW-AWEZNQCLSA-N 1 1 219.372 3.658 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)CCc1ccc(C)cc1 ZINC000605573927 345969019 /nfs/dbraw/zinc/96/90/19/345969019.db2.gz LVRNJSSVTFZWQW-CQSZACIVSA-N 1 1 219.372 3.658 20 0 BHADMO CC[N@@H+](CCc1ccc(C)cc1)C1CCCC1 ZINC000605573941 345968745 /nfs/dbraw/zinc/96/87/45/345968745.db2.gz PBCOKULVCWWRMF-UHFFFAOYSA-N 1 1 231.383 3.802 20 0 BHADMO Cc1ccc(CC[N@@H+]2CCC[C@H](C)CC2)cc1 ZINC000605574381 345968974 /nfs/dbraw/zinc/96/89/74/345968974.db2.gz CSMHJNTWERRGJN-AWEZNQCLSA-N 1 1 231.383 3.660 20 0 BHADMO Cc1ccc(CC[N@@H+]2CCC[C@@H](C)CC2)cc1 ZINC000605574382 345968526 /nfs/dbraw/zinc/96/85/26/345968526.db2.gz CSMHJNTWERRGJN-CQSZACIVSA-N 1 1 231.383 3.660 20 0 BHADMO Cc1ccc(CC[N@H+](C)CC2CCCC2)cc1 ZINC000605574414 345968683 /nfs/dbraw/zinc/96/86/83/345968683.db2.gz JRRMSODTGYPWOO-UHFFFAOYSA-N 1 1 231.383 3.660 20 0 BHADMO Cc1ccc(CC[N@@H+]2CCC[C@H]2C(C)C)cc1 ZINC000605574553 345968614 /nfs/dbraw/zinc/96/86/14/345968614.db2.gz ZUQKVVGNTACXKT-INIZCTEOSA-N 1 1 231.383 3.658 20 0 BHADMO Cc1ccc(CC[N@@H+]2CCC[C@@H]2C(C)C)cc1 ZINC000605574554 345968731 /nfs/dbraw/zinc/96/87/31/345968731.db2.gz ZUQKVVGNTACXKT-MRXNPFEDSA-N 1 1 231.383 3.658 20 0 BHADMO CCC(C)(C)[N@@H+](C)CCc1ccc(C)cc1 ZINC000605574625 345969071 /nfs/dbraw/zinc/96/90/71/345969071.db2.gz VQLSZLFXFFOOKJ-UHFFFAOYSA-N 1 1 219.372 3.658 20 0 BHADMO CC[N@@H+](CCc1ccc(C)cc1)CC(C)C ZINC000605575102 345968775 /nfs/dbraw/zinc/96/87/75/345968775.db2.gz JWYOGNIRYZZOQS-UHFFFAOYSA-N 1 1 219.372 3.515 20 0 BHADMO Cc1ccc(CC[N@@H+]2CCCCC[C@@H]2C)cc1 ZINC000605575137 345968236 /nfs/dbraw/zinc/96/82/36/345968236.db2.gz NJYHDOYGIIWYOZ-HNNXBMFYSA-N 1 1 231.383 3.802 20 0 BHADMO Cc1ccc(CC[N@@H+]2CCCCC[C@H]2C)cc1 ZINC000605575138 345968110 /nfs/dbraw/zinc/96/81/10/345968110.db2.gz NJYHDOYGIIWYOZ-OAHLLOKOSA-N 1 1 231.383 3.802 20 0 BHADMO CCC[N@@H+](CCc1ccc(C)cc1)CC1CC1 ZINC000605575216 345967355 /nfs/dbraw/zinc/96/73/55/345967355.db2.gz SMEIISLZQLTEIZ-UHFFFAOYSA-N 1 1 231.383 3.660 20 0 BHADMO Cc1ccc(CC[N@H+](C)CCC(C)C)cc1 ZINC000605575952 346040010 /nfs/dbraw/zinc/04/00/10/346040010.db2.gz RHQIEFJMTSWFCO-UHFFFAOYSA-N 1 1 219.372 3.515 20 0 BHADMO CC[C@@H](C)C[N@@H+](C)CCc1ccc(C)cc1 ZINC000605576713 346220361 /nfs/dbraw/zinc/22/03/61/346220361.db2.gz PRDATBJKUXKNHJ-CYBMUJFWSA-N 1 1 219.372 3.515 20 0 BHADMO CC[C@H](C)C[N@@H+](C)CCc1ccc(C)cc1 ZINC000605576714 346220496 /nfs/dbraw/zinc/22/04/96/346220496.db2.gz PRDATBJKUXKNHJ-ZDUSSCGKSA-N 1 1 219.372 3.515 20 0 BHADMO CCCC[N@H+]1CCCCC[C@@H]1c1ccco1 ZINC000605747552 347435940 /nfs/dbraw/zinc/43/59/40/347435940.db2.gz UBFPCPQOUIUARQ-CYBMUJFWSA-N 1 1 221.344 3.997 20 0 BHADMO CCCC[N@H+]1CCCCC[C@H]1c1ccco1 ZINC000605747553 347435348 /nfs/dbraw/zinc/43/53/48/347435348.db2.gz UBFPCPQOUIUARQ-ZDUSSCGKSA-N 1 1 221.344 3.997 20 0 BHADMO CC(C)=CC[N@H+]1CC[C@@H](Cc2ccc(F)cc2)C1 ZINC000605759769 347440217 /nfs/dbraw/zinc/44/02/17/347440217.db2.gz LECMOFMNKBPGNM-HNNXBMFYSA-N 1 1 247.357 3.656 20 0 BHADMO CC(C)=CC[N@H+]1CC[C@H](Cc2ccc(F)cc2)C1 ZINC000605759770 347440583 /nfs/dbraw/zinc/44/05/83/347440583.db2.gz LECMOFMNKBPGNM-OAHLLOKOSA-N 1 1 247.357 3.656 20 0 BHADMO CC(C)C[N@H+]1C[C@H](c2ccc(F)cc2)C[C@@H]1C ZINC000605764176 385458685 /nfs/dbraw/zinc/45/86/85/385458685.db2.gz IIGXDSGNVAJIJR-GXTWGEPZSA-N 1 1 235.346 3.660 20 0 BHADMO CC(C)C[N@H+]1C[C@@H](c2ccc(F)cc2)C[C@@H]1C ZINC000605764177 385458994 /nfs/dbraw/zinc/45/89/94/385458994.db2.gz IIGXDSGNVAJIJR-JSGCOSHPSA-N 1 1 235.346 3.660 20 0 BHADMO CC(C)C[N@H+]1C[C@@H](c2ccc(F)cc2)C[C@H]1C ZINC000605764178 385459158 /nfs/dbraw/zinc/45/91/58/385459158.db2.gz IIGXDSGNVAJIJR-OCCSQVGLSA-N 1 1 235.346 3.660 20 0 BHADMO CC(C)C[N@H+]1C[C@H](c2ccc(F)cc2)C[C@H]1C ZINC000605764179 385458594 /nfs/dbraw/zinc/45/85/94/385458594.db2.gz IIGXDSGNVAJIJR-TZMCWYRMSA-N 1 1 235.346 3.660 20 0 BHADMO CCCC[N@H+]1C[C@H](c2ccc(F)cc2)C[C@@H]1C ZINC000605764287 385459030 /nfs/dbraw/zinc/45/90/30/385459030.db2.gz LLBDSEMINLEJCY-GXTWGEPZSA-N 1 1 235.346 3.804 20 0 BHADMO CCCC[N@H+]1C[C@@H](c2ccc(F)cc2)C[C@@H]1C ZINC000605764288 385459080 /nfs/dbraw/zinc/45/90/80/385459080.db2.gz LLBDSEMINLEJCY-JSGCOSHPSA-N 1 1 235.346 3.804 20 0 BHADMO CCCC[N@H+]1C[C@@H](c2ccc(F)cc2)C[C@H]1C ZINC000605764289 385458868 /nfs/dbraw/zinc/45/88/68/385458868.db2.gz LLBDSEMINLEJCY-OCCSQVGLSA-N 1 1 235.346 3.804 20 0 BHADMO CCCC[N@H+]1C[C@H](c2ccc(F)cc2)C[C@H]1C ZINC000605764290 385458526 /nfs/dbraw/zinc/45/85/26/385458526.db2.gz LLBDSEMINLEJCY-TZMCWYRMSA-N 1 1 235.346 3.804 20 0 BHADMO Cc1cccc(C[N@@H+](C2CC2)C2CCCCC2)n1 ZINC000605901743 348896656 /nfs/dbraw/zinc/89/66/56/348896656.db2.gz RQINWMLJAHNUEB-UHFFFAOYSA-N 1 1 244.382 3.687 20 0 BHADMO Cc1cccc(C)c1C[N@@H+]1CCC[C@H](C)C1 ZINC000606430151 350330829 /nfs/dbraw/zinc/33/08/29/350330829.db2.gz JEKNPVABAMYAJE-LBPRGKRZSA-N 1 1 217.356 3.535 20 0 BHADMO Cc1cccc(C)c1C[N@@H+](C)Cc1ccccc1 ZINC000606430323 350330492 /nfs/dbraw/zinc/33/04/92/350330492.db2.gz ZTWZQHSRQFNOTF-UHFFFAOYSA-N 1 1 239.362 3.935 20 0 BHADMO Cc1cccc(C)c1C[N@H+](C)C1CCCC1 ZINC000606431242 350331765 /nfs/dbraw/zinc/33/17/65/350331765.db2.gz OLLBEGBGDVTGOI-UHFFFAOYSA-N 1 1 217.356 3.678 20 0 BHADMO Cc1cccc(C)c1C[N@H+](C)[C@@H](C)C(C)C ZINC000606431426 350331701 /nfs/dbraw/zinc/33/17/01/350331701.db2.gz QAGSHLJUJUZNOM-AWEZNQCLSA-N 1 1 219.372 3.780 20 0 BHADMO Cc1cccc(C)c1C[N@H+](C)[C@H](C)C(C)C ZINC000606431427 350331495 /nfs/dbraw/zinc/33/14/95/350331495.db2.gz QAGSHLJUJUZNOM-CQSZACIVSA-N 1 1 219.372 3.780 20 0 BHADMO CCC[C@H](C)[N@@H+](C)Cc1c(C)cccc1C ZINC000606431513 350331431 /nfs/dbraw/zinc/33/14/31/350331431.db2.gz GCXLYERBYKYZFG-AWEZNQCLSA-N 1 1 219.372 3.924 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)Cc1c(C)cccc1C ZINC000606431514 350331423 /nfs/dbraw/zinc/33/14/23/350331423.db2.gz GCXLYERBYKYZFG-CQSZACIVSA-N 1 1 219.372 3.924 20 0 BHADMO Cc1cccc(C)c1C[N@H+](C)CCC(C)C ZINC000606431640 350331732 /nfs/dbraw/zinc/33/17/32/350331732.db2.gz FHRRYDOATCVPPP-UHFFFAOYSA-N 1 1 219.372 3.781 20 0 BHADMO Cc1cccc(C)c1C[N@@H+](C)CC1CCCC1 ZINC000606431959 350331628 /nfs/dbraw/zinc/33/16/28/350331628.db2.gz NMLFKENJKGBGJL-UHFFFAOYSA-N 1 1 231.383 3.925 20 0 BHADMO Cc1cccc(C)c1C[N@@H+]1CCC[C@H]1C(C)C ZINC000606432027 350331376 /nfs/dbraw/zinc/33/13/76/350331376.db2.gz ZXZKBELJNGGRJZ-INIZCTEOSA-N 1 1 231.383 3.924 20 0 BHADMO Cc1cccc(C)c1C[N@@H+]1CCC[C@@H]1C(C)C ZINC000606432028 350331528 /nfs/dbraw/zinc/33/15/28/350331528.db2.gz ZXZKBELJNGGRJZ-MRXNPFEDSA-N 1 1 231.383 3.924 20 0 BHADMO CC[N@@H+](Cc1ccoc1)Cc1c(C)cccc1C ZINC000606432768 350332625 /nfs/dbraw/zinc/33/26/25/350332625.db2.gz RKHRPHDCUAJYFK-UHFFFAOYSA-N 1 1 243.350 3.919 20 0 BHADMO Cc1cccc(C)c1C[N@H+](C)CC(C)(C)C ZINC000606432786 350332317 /nfs/dbraw/zinc/33/23/17/350332317.db2.gz DZMDAELXWWTKGI-UHFFFAOYSA-N 1 1 219.372 3.781 20 0 BHADMO CC[C@H]1CCC[N@H+]1Cc1c(C)cccc1C ZINC000606432839 350332462 /nfs/dbraw/zinc/33/24/62/350332462.db2.gz DILDOMCVSHWRSO-AWEZNQCLSA-N 1 1 217.356 3.678 20 0 BHADMO CC[C@@H]1CCC[N@H+]1Cc1c(C)cccc1C ZINC000606432840 350332620 /nfs/dbraw/zinc/33/26/20/350332620.db2.gz DILDOMCVSHWRSO-CQSZACIVSA-N 1 1 217.356 3.678 20 0 BHADMO Cc1cccc(C)c1C[N@H+]1CCC[C@H]1C1CC1 ZINC000606432853 350332660 /nfs/dbraw/zinc/33/26/60/350332660.db2.gz GTYFORAZEYTVGE-INIZCTEOSA-N 1 1 229.367 3.678 20 0 BHADMO Cc1cccc(C)c1C[N@H+]1CCC[C@@H]1C1CC1 ZINC000606432854 350332644 /nfs/dbraw/zinc/33/26/44/350332644.db2.gz GTYFORAZEYTVGE-MRXNPFEDSA-N 1 1 229.367 3.678 20 0 BHADMO Cc1cccc(C)c1C[N@@H+](C)CC1CCC1 ZINC000606433602 350336763 /nfs/dbraw/zinc/33/67/63/350336763.db2.gz MOEBGXDTNIZUEN-UHFFFAOYSA-N 1 1 217.356 3.535 20 0 BHADMO CCCC[N@@H+](CCOC)Cc1c(C)cccc1C ZINC000606433610 350336545 /nfs/dbraw/zinc/33/65/45/350336545.db2.gz PSOILPGELCWJBU-UHFFFAOYSA-N 1 1 249.398 3.552 20 0 BHADMO CC[N@H+](Cc1c(C)cccc1C)CC(C)C ZINC000606433686 350336564 /nfs/dbraw/zinc/33/65/64/350336564.db2.gz QHQRBSPLUCGSQM-UHFFFAOYSA-N 1 1 219.372 3.781 20 0 BHADMO CC[N@H+](Cc1c(C)cccc1C)CC1CC1 ZINC000606433705 350336670 /nfs/dbraw/zinc/33/66/70/350336670.db2.gz XZIXYZJQQYVZDH-UHFFFAOYSA-N 1 1 217.356 3.535 20 0 BHADMO CC[C@H](C)[C@@H]1CCCC[N@H+]1CCOC(C)(C)C ZINC000606433877 350336934 /nfs/dbraw/zinc/33/69/34/350336934.db2.gz AUAHVFPQSCWOHV-KBPBESRZSA-N 1 1 241.419 3.702 20 0 BHADMO CC[C@@H](C)[C@@H]1CCCC[N@H+]1CCOC(C)(C)C ZINC000606433878 350336553 /nfs/dbraw/zinc/33/65/53/350336553.db2.gz AUAHVFPQSCWOHV-KGLIPLIRSA-N 1 1 241.419 3.702 20 0 BHADMO CC[C@H](C)[C@H]1CCCC[N@H+]1CCOC(C)(C)C ZINC000606433879 350336965 /nfs/dbraw/zinc/33/69/65/350336965.db2.gz AUAHVFPQSCWOHV-UONOGXRCSA-N 1 1 241.419 3.702 20 0 BHADMO CC[C@@H](C)[C@H]1CCCC[N@H+]1CCOC(C)(C)C ZINC000606433880 350336506 /nfs/dbraw/zinc/33/65/06/350336506.db2.gz AUAHVFPQSCWOHV-ZIAGYGMSSA-N 1 1 241.419 3.702 20 0 BHADMO CC[C@@H](C)[C@H]1CCCC[N@H+]1CCc1ccncc1 ZINC000606433905 350337184 /nfs/dbraw/zinc/33/71/84/350337184.db2.gz BVOFOBTZLYIYOJ-GDBMZVCRSA-N 1 1 246.398 3.525 20 0 BHADMO CC[C@H](C)[C@H]1CCCC[N@H+]1CCc1ccncc1 ZINC000606433906 350336512 /nfs/dbraw/zinc/33/65/12/350336512.db2.gz BVOFOBTZLYIYOJ-GOEBONIOSA-N 1 1 246.398 3.525 20 0 BHADMO CC[C@H](C)[C@@H]1CCCC[N@H+]1CCc1ccncc1 ZINC000606433907 350336771 /nfs/dbraw/zinc/33/67/71/350336771.db2.gz BVOFOBTZLYIYOJ-HOCLYGCPSA-N 1 1 246.398 3.525 20 0 BHADMO CC[C@@H](C)[C@@H]1CCCC[N@H+]1CCc1ccncc1 ZINC000606433908 350336994 /nfs/dbraw/zinc/33/69/94/350336994.db2.gz BVOFOBTZLYIYOJ-ZBFHGGJFSA-N 1 1 246.398 3.525 20 0 BHADMO CC[C@H](C)[C@@H]1CCCC[N@H+]1[C@H]1C=CCCC1 ZINC000606433977 350336999 /nfs/dbraw/zinc/33/69/99/350336999.db2.gz FOWLDXVEJXDBDE-KKUMJFAQSA-N 1 1 221.388 3.996 20 0 BHADMO CC[C@H](C)[C@H]1CCCC[N@H+]1[C@@H]1C=CCCC1 ZINC000606433978 350336779 /nfs/dbraw/zinc/33/67/79/350336779.db2.gz FOWLDXVEJXDBDE-RRFJBIMHSA-N 1 1 221.388 3.996 20 0 BHADMO CC[C@H](C)[C@H]1CCCC[N@H+]1[C@H]1C=CCCC1 ZINC000606433979 350336487 /nfs/dbraw/zinc/33/64/87/350336487.db2.gz FOWLDXVEJXDBDE-SOUVJXGZSA-N 1 1 221.388 3.996 20 0 BHADMO CC[C@H](C)[C@@H]1CCCC[N@H+]1[C@@H]1C=CCCC1 ZINC000606433980 350336679 /nfs/dbraw/zinc/33/66/79/350336679.db2.gz FOWLDXVEJXDBDE-ZNMIVQPWSA-N 1 1 221.388 3.996 20 0 BHADMO CC[C@H](C)[C@@H]1CCCC[N@H+]1CC=C(C)C ZINC000606434001 350337121 /nfs/dbraw/zinc/33/71/21/350337121.db2.gz GOADDQRVOZJKFS-KBPBESRZSA-N 1 1 209.377 3.853 20 0 BHADMO CC[C@@H](C)[C@@H]1CCCC[N@H+]1CC=C(C)C ZINC000606434002 350336602 /nfs/dbraw/zinc/33/66/02/350336602.db2.gz GOADDQRVOZJKFS-KGLIPLIRSA-N 1 1 209.377 3.853 20 0 BHADMO CC[C@H](C)[C@H]1CCCC[N@H+]1CC=C(C)C ZINC000606434003 350337019 /nfs/dbraw/zinc/33/70/19/350337019.db2.gz GOADDQRVOZJKFS-UONOGXRCSA-N 1 1 209.377 3.853 20 0 BHADMO CC[C@@H](C)[C@H]1CCCC[N@H+]1CC=C(C)C ZINC000606434004 350337009 /nfs/dbraw/zinc/33/70/09/350337009.db2.gz GOADDQRVOZJKFS-ZIAGYGMSSA-N 1 1 209.377 3.853 20 0 BHADMO CC[N@@H+](Cc1cccc(OC(C)C)c1)C1CCC1 ZINC000606434457 350337701 /nfs/dbraw/zinc/33/77/01/350337701.db2.gz AQKAPVNSCUMAEA-UHFFFAOYSA-N 1 1 247.382 3.848 20 0 BHADMO CC[N@@H+](Cc1c(C)cc(C)cc1C)C1CCC1 ZINC000606434485 350337400 /nfs/dbraw/zinc/33/74/00/350337400.db2.gz FOASMTSKMXYPIX-UHFFFAOYSA-N 1 1 231.383 3.986 20 0 BHADMO CC[N@@H+](Cc1c(C)cccc1C)C1CCC1 ZINC000606434511 350337485 /nfs/dbraw/zinc/33/74/85/350337485.db2.gz JFDMNZIRQPTCCF-UHFFFAOYSA-N 1 1 217.356 3.678 20 0 BHADMO CC[N@@H+](CCOc1cc(C)cc(C)c1)C1CCC1 ZINC000606434584 350337312 /nfs/dbraw/zinc/33/73/12/350337312.db2.gz WCVZQIZMNRITCA-UHFFFAOYSA-N 1 1 247.382 3.557 20 0 BHADMO CC[N@@H+](CCSc1ccccc1)C1CCC1 ZINC000606434588 350337826 /nfs/dbraw/zinc/33/78/26/350337826.db2.gz WVTFOMQEEFWRLL-UHFFFAOYSA-N 1 1 235.396 3.653 20 0 BHADMO CC[N@@H+](CCOc1cc(C)ccc1C)C1CCC1 ZINC000606434908 350333156 /nfs/dbraw/zinc/33/31/56/350333156.db2.gz NUBACWXIIILEJZ-UHFFFAOYSA-N 1 1 247.382 3.557 20 0 BHADMO CCCC[N@H+]1C[C@@H](c2ccccc2C)C[C@H]1C ZINC000606435143 350333053 /nfs/dbraw/zinc/33/30/53/350333053.db2.gz JWYVDAPQWJBIFW-CABCVRRESA-N 1 1 231.383 3.973 20 0 BHADMO CCCC[N@H+]1C[C@@H](c2ccccc2C)C[C@@H]1C ZINC000606435144 350333201 /nfs/dbraw/zinc/33/32/01/350333201.db2.gz JWYVDAPQWJBIFW-GJZGRUSLSA-N 1 1 231.383 3.973 20 0 BHADMO CCCC[N@H+]1C[C@H](c2ccccc2C)C[C@H]1C ZINC000606435145 350333219 /nfs/dbraw/zinc/33/32/19/350333219.db2.gz JWYVDAPQWJBIFW-HUUCEWRRSA-N 1 1 231.383 3.973 20 0 BHADMO CCCC[N@H+]1C[C@H](c2ccccc2C)C[C@@H]1C ZINC000606435146 350333020 /nfs/dbraw/zinc/33/30/20/350333020.db2.gz JWYVDAPQWJBIFW-LSDHHAIUSA-N 1 1 231.383 3.973 20 0 BHADMO Cc1ccccc1[C@H]1C[C@@H](C)[N@@H+](CC(C)C)C1 ZINC000606435221 350333259 /nfs/dbraw/zinc/33/32/59/350333259.db2.gz OEWPHONXUBCMKT-CABCVRRESA-N 1 1 231.383 3.829 20 0 BHADMO Cc1ccccc1[C@H]1C[C@H](C)[N@@H+](CC(C)C)C1 ZINC000606435222 350333029 /nfs/dbraw/zinc/33/30/29/350333029.db2.gz OEWPHONXUBCMKT-GJZGRUSLSA-N 1 1 231.383 3.829 20 0 BHADMO Cc1ccccc1[C@@H]1C[C@@H](C)[N@@H+](CC(C)C)C1 ZINC000606435223 350332979 /nfs/dbraw/zinc/33/29/79/350332979.db2.gz OEWPHONXUBCMKT-HUUCEWRRSA-N 1 1 231.383 3.829 20 0 BHADMO Cc1ccccc1[C@@H]1C[C@H](C)[N@@H+](CC(C)C)C1 ZINC000606435224 350333061 /nfs/dbraw/zinc/33/30/61/350333061.db2.gz OEWPHONXUBCMKT-LSDHHAIUSA-N 1 1 231.383 3.829 20 0 BHADMO Cc1ccc(C[C@H](C)[N@@H+](C)[C@@H]2C=CCCC2)cc1 ZINC000606447049 350334259 /nfs/dbraw/zinc/33/42/59/350334259.db2.gz BXYVQIDGEMAVOU-DOTOQJQBSA-N 1 1 243.394 3.967 20 0 BHADMO Cc1ccc(C[C@@H](C)[N@@H+](C)[C@@H]2C=CCCC2)cc1 ZINC000606447050 350334205 /nfs/dbraw/zinc/33/42/05/350334205.db2.gz BXYVQIDGEMAVOU-NVXWUHKLSA-N 1 1 243.394 3.967 20 0 BHADMO Cc1ccc(C[C@H](C)[N@@H+](C)[C@H]2C=CCCC2)cc1 ZINC000606447051 350334280 /nfs/dbraw/zinc/33/42/80/350334280.db2.gz BXYVQIDGEMAVOU-RDJZCZTQSA-N 1 1 243.394 3.967 20 0 BHADMO Cc1ccc(C[C@@H](C)[N@@H+](C)[C@H]2C=CCCC2)cc1 ZINC000606447052 350334304 /nfs/dbraw/zinc/33/43/04/350334304.db2.gz BXYVQIDGEMAVOU-WBVHZDCISA-N 1 1 243.394 3.967 20 0 BHADMO CCCC[N@@H+](C)[C@@H](C)Cc1ccc(C)cc1 ZINC000606447508 350338504 /nfs/dbraw/zinc/33/85/04/350338504.db2.gz ZVCUDARHUPAXON-AWEZNQCLSA-N 1 1 219.372 3.658 20 0 BHADMO CCCC[N@@H+](C)[C@H](C)Cc1ccc(C)cc1 ZINC000606447509 350338387 /nfs/dbraw/zinc/33/83/87/350338387.db2.gz ZVCUDARHUPAXON-CQSZACIVSA-N 1 1 219.372 3.658 20 0 BHADMO C[C@@H]1c2ccc(F)cc2CC[N@H+]1[C@H]1C=CCCC1 ZINC000606448529 350338591 /nfs/dbraw/zinc/33/85/91/350338591.db2.gz AESWJDZIVKZXOX-DOMZBBRYSA-N 1 1 245.341 3.854 20 0 BHADMO C[C@@H]1c2ccc(F)cc2CC[N@H+]1[C@@H]1C=CCCC1 ZINC000606448530 350338355 /nfs/dbraw/zinc/33/83/55/350338355.db2.gz AESWJDZIVKZXOX-IUODEOHRSA-N 1 1 245.341 3.854 20 0 BHADMO C[C@H]1c2ccc(F)cc2CC[N@H+]1[C@@H]1C=CCCC1 ZINC000606448531 350338518 /nfs/dbraw/zinc/33/85/18/350338518.db2.gz AESWJDZIVKZXOX-SWLSCSKDSA-N 1 1 245.341 3.854 20 0 BHADMO C[C@H]1c2ccc(F)cc2CC[N@H+]1[C@H]1C=CCCC1 ZINC000606448532 350338573 /nfs/dbraw/zinc/33/85/73/350338573.db2.gz AESWJDZIVKZXOX-WFASDCNBSA-N 1 1 245.341 3.854 20 0 BHADMO CCCCC[N@H+]1CCc2cc(F)ccc2[C@H]1C ZINC000606448891 350338659 /nfs/dbraw/zinc/33/86/59/350338659.db2.gz JEUVBEWUEJAWIB-GFCCVEGCSA-N 1 1 235.346 3.935 20 0 BHADMO CCCCC[N@H+]1CCc2cc(F)ccc2[C@@H]1C ZINC000606448892 350339170 /nfs/dbraw/zinc/33/91/70/350339170.db2.gz JEUVBEWUEJAWIB-LBPRGKRZSA-N 1 1 235.346 3.935 20 0 BHADMO CCCC[N@H+]1CCc2cc(F)ccc2[C@H]1C ZINC000606449137 350338937 /nfs/dbraw/zinc/33/89/37/350338937.db2.gz OJCSBJSIWQPNHM-LLVKDONJSA-N 1 1 221.319 3.545 20 0 BHADMO CCCC[N@H+]1CCc2cc(F)ccc2[C@@H]1C ZINC000606449138 350338922 /nfs/dbraw/zinc/33/89/22/350338922.db2.gz OJCSBJSIWQPNHM-NSHDSACASA-N 1 1 221.319 3.545 20 0 BHADMO CC(C)=CC[N@H+]1CCc2cc(F)ccc2[C@H]1C ZINC000606449471 350339236 /nfs/dbraw/zinc/33/92/36/350339236.db2.gz XHBOFTJQDWCHKV-GFCCVEGCSA-N 1 1 233.330 3.711 20 0 BHADMO CC(C)=CC[N@H+]1CCc2cc(F)ccc2[C@@H]1C ZINC000606449472 350339297 /nfs/dbraw/zinc/33/92/97/350339297.db2.gz XHBOFTJQDWCHKV-LBPRGKRZSA-N 1 1 233.330 3.711 20 0 BHADMO CC(C)CC[N@H+]1CCc2cc(F)ccc2[C@H]1C ZINC000606449575 350339001 /nfs/dbraw/zinc/33/90/01/350339001.db2.gz YYNZLDVYMLPKMY-GFCCVEGCSA-N 1 1 235.346 3.791 20 0 BHADMO CC(C)CC[N@H+]1CCc2cc(F)ccc2[C@@H]1C ZINC000606449576 350339014 /nfs/dbraw/zinc/33/90/14/350339014.db2.gz YYNZLDVYMLPKMY-LBPRGKRZSA-N 1 1 235.346 3.791 20 0 BHADMO CCCCC[N@H+]1CCc2cccc(F)c2[C@H]1C ZINC000606450353 350339357 /nfs/dbraw/zinc/33/93/57/350339357.db2.gz XLXGDLIRLSYWCT-GFCCVEGCSA-N 1 1 235.346 3.935 20 0 BHADMO CCCCC[N@H+]1CCc2cccc(F)c2[C@@H]1C ZINC000606450354 350338909 /nfs/dbraw/zinc/33/89/09/350338909.db2.gz XLXGDLIRLSYWCT-LBPRGKRZSA-N 1 1 235.346 3.935 20 0 BHADMO CC(C)=CC[N@H+]1CCc2cccc(F)c2[C@H]1C ZINC000606450449 350339444 /nfs/dbraw/zinc/33/94/44/350339444.db2.gz AKWOWZKFZAQLRN-GFCCVEGCSA-N 1 1 233.330 3.711 20 0 BHADMO CC(C)=CC[N@H+]1CCc2cccc(F)c2[C@@H]1C ZINC000606450450 350339364 /nfs/dbraw/zinc/33/93/64/350339364.db2.gz AKWOWZKFZAQLRN-LBPRGKRZSA-N 1 1 233.330 3.711 20 0 BHADMO CCCC[N@H+]1CCc2cccc(F)c2[C@H]1C ZINC000606450489 350339398 /nfs/dbraw/zinc/33/93/98/350339398.db2.gz CKWGWKKWIVICOG-LLVKDONJSA-N 1 1 221.319 3.545 20 0 BHADMO CCCC[N@H+]1CCc2cccc(F)c2[C@@H]1C ZINC000606450490 350338986 /nfs/dbraw/zinc/33/89/86/350338986.db2.gz CKWGWKKWIVICOG-NSHDSACASA-N 1 1 221.319 3.545 20 0 BHADMO C[C@H]1c2c(F)cccc2CC[N@H+]1[C@@H]1C=CCCC1 ZINC000606450513 350339391 /nfs/dbraw/zinc/33/93/91/350339391.db2.gz DMUJTQZFEBSMCZ-GXTWGEPZSA-N 1 1 245.341 3.854 20 0 BHADMO C[C@H]1c2c(F)cccc2CC[N@H+]1[C@H]1C=CCCC1 ZINC000606450514 350339439 /nfs/dbraw/zinc/33/94/39/350339439.db2.gz DMUJTQZFEBSMCZ-JSGCOSHPSA-N 1 1 245.341 3.854 20 0 BHADMO C[C@@H]1c2c(F)cccc2CC[N@H+]1[C@H]1C=CCCC1 ZINC000606450515 350339474 /nfs/dbraw/zinc/33/94/74/350339474.db2.gz DMUJTQZFEBSMCZ-OCCSQVGLSA-N 1 1 245.341 3.854 20 0 BHADMO C[C@@H]1c2c(F)cccc2CC[N@H+]1[C@@H]1C=CCCC1 ZINC000606450516 350339434 /nfs/dbraw/zinc/33/94/34/350339434.db2.gz DMUJTQZFEBSMCZ-TZMCWYRMSA-N 1 1 245.341 3.854 20 0 BHADMO CC(C)CC[N@H+]1CCc2cccc(F)c2[C@H]1C ZINC000606450783 350339374 /nfs/dbraw/zinc/33/93/74/350339374.db2.gz RAQXNZCIBYZUCG-GFCCVEGCSA-N 1 1 235.346 3.791 20 0 BHADMO CC(C)CC[N@H+]1CCc2cccc(F)c2[C@@H]1C ZINC000606450784 350339462 /nfs/dbraw/zinc/33/94/62/350339462.db2.gz RAQXNZCIBYZUCG-LBPRGKRZSA-N 1 1 235.346 3.791 20 0 BHADMO Cc1cc(C)c(C[N@@H+]2CCSC[C@@H]2C)c(C)c1 ZINC000606451807 350340263 /nfs/dbraw/zinc/34/02/63/350340263.db2.gz WWXVOSUBIGADSW-AWEZNQCLSA-N 1 1 249.423 3.549 20 0 BHADMO Cc1cc(C)c(C[N@@H+]2CCSC[C@H]2C)c(C)c1 ZINC000606451808 350340177 /nfs/dbraw/zinc/34/01/77/350340177.db2.gz WWXVOSUBIGADSW-CQSZACIVSA-N 1 1 249.423 3.549 20 0 BHADMO CC(C)=CC[N@H+]1CCc2c(Cl)cccc2C1 ZINC000606896957 350621222 /nfs/dbraw/zinc/62/12/22/350621222.db2.gz TXGZQHLOFLVOLC-UHFFFAOYSA-N 1 1 235.758 3.664 20 0 BHADMO CC(C)CC[N@H+]1CCc2c(Cl)cccc2C1 ZINC000606897222 350622792 /nfs/dbraw/zinc/62/27/92/350622792.db2.gz SUFGLWNQHFDSKT-UHFFFAOYSA-N 1 1 237.774 3.744 20 0 BHADMO CCCCC[N@H+]1CCc2c(Cl)cccc2C1 ZINC000606897572 350622157 /nfs/dbraw/zinc/62/21/57/350622157.db2.gz QCCVQNIYPSLDQL-UHFFFAOYSA-N 1 1 237.774 3.888 20 0 BHADMO CCc1ccc([C@H]2CCCCC[N@@H+]2CC)o1 ZINC000606899071 350626361 /nfs/dbraw/zinc/62/63/61/350626361.db2.gz GOJJRRBKWDXPFL-CYBMUJFWSA-N 1 1 221.344 3.779 20 0 BHADMO CCc1ccc([C@@H]2CCCCC[N@@H+]2CC)o1 ZINC000606899081 350626298 /nfs/dbraw/zinc/62/62/98/350626298.db2.gz GOJJRRBKWDXPFL-ZDUSSCGKSA-N 1 1 221.344 3.779 20 0 BHADMO CC[C@H]1CCCCC[N@H+]1Cc1ccccc1F ZINC000606901052 350626811 /nfs/dbraw/zinc/62/68/11/350626811.db2.gz XJHIULBYIZXWNM-AWEZNQCLSA-N 1 1 235.346 3.980 20 0 BHADMO CC[C@@H]1CCCCC[N@H+]1Cc1ccccc1F ZINC000606901053 350627151 /nfs/dbraw/zinc/62/71/51/350627151.db2.gz XJHIULBYIZXWNM-CQSZACIVSA-N 1 1 235.346 3.980 20 0 BHADMO CC[C@H]1CCCCC[N@H+]1CC1CCCC1 ZINC000606901117 350627027 /nfs/dbraw/zinc/62/70/27/350627027.db2.gz BZNQTVKRDJQWCB-AWEZNQCLSA-N 1 1 209.377 3.831 20 0 BHADMO CC[C@@H]1CCCCC[N@H+]1CC1CCCC1 ZINC000606901118 350626879 /nfs/dbraw/zinc/62/68/79/350626879.db2.gz BZNQTVKRDJQWCB-CQSZACIVSA-N 1 1 209.377 3.831 20 0 BHADMO CC[C@H]1CCCCC[N@H+]1Cc1cccc(F)c1 ZINC000606901139 350627187 /nfs/dbraw/zinc/62/71/87/350627187.db2.gz FPXAQHQIVWZNEH-HNNXBMFYSA-N 1 1 235.346 3.980 20 0 BHADMO CC[C@@H]1CCCCC[N@H+]1Cc1cccc(F)c1 ZINC000606901140 350627018 /nfs/dbraw/zinc/62/70/18/350627018.db2.gz FPXAQHQIVWZNEH-OAHLLOKOSA-N 1 1 235.346 3.980 20 0 BHADMO CC[C@@H](C)[C@@H]1CCCC[N@H+]1CCCOC(C)C ZINC000606934877 350629449 /nfs/dbraw/zinc/62/94/49/350629449.db2.gz CDNASZWUEJOEKZ-CABCVRRESA-N 1 1 241.419 3.702 20 0 BHADMO CC[C@H](C)[C@@H]1CCCC[N@H+]1CCCOC(C)C ZINC000606934878 350629886 /nfs/dbraw/zinc/62/98/86/350629886.db2.gz CDNASZWUEJOEKZ-GJZGRUSLSA-N 1 1 241.419 3.702 20 0 BHADMO CC[C@@H](C)[C@H]1CCCC[N@H+]1CCCOC(C)C ZINC000606934879 350629442 /nfs/dbraw/zinc/62/94/42/350629442.db2.gz CDNASZWUEJOEKZ-HUUCEWRRSA-N 1 1 241.419 3.702 20 0 BHADMO CC[C@H](C)[C@H]1CCCC[N@H+]1CCCOC(C)C ZINC000606934880 350629639 /nfs/dbraw/zinc/62/96/39/350629639.db2.gz CDNASZWUEJOEKZ-LSDHHAIUSA-N 1 1 241.419 3.702 20 0 BHADMO CC[C@H]1CCCCC[N@H+]1CCOCCC(C)C ZINC000606936201 350629418 /nfs/dbraw/zinc/62/94/18/350629418.db2.gz FQGOXCIGOVIXSW-HNNXBMFYSA-N 1 1 241.419 3.704 20 0 BHADMO CC[C@@H]1CCCCC[N@H+]1CCOCCC(C)C ZINC000606936203 350629659 /nfs/dbraw/zinc/62/96/59/350629659.db2.gz FQGOXCIGOVIXSW-OAHLLOKOSA-N 1 1 241.419 3.704 20 0 BHADMO CC[C@H]1CCCCC[N@H+]1Cc1cccc(OC)c1 ZINC000606936850 350629735 /nfs/dbraw/zinc/62/97/35/350629735.db2.gz OUVGNBZIZIQWIX-HNNXBMFYSA-N 1 1 247.382 3.850 20 0 BHADMO CC[C@@H]1CCCCC[N@H+]1Cc1cccc(OC)c1 ZINC000606936851 350629380 /nfs/dbraw/zinc/62/93/80/350629380.db2.gz OUVGNBZIZIQWIX-OAHLLOKOSA-N 1 1 247.382 3.850 20 0 BHADMO C[N@@H+](CCOC1CCCCCC1)C1CCCC1 ZINC000607150553 351029363 /nfs/dbraw/zinc/02/93/63/351029363.db2.gz WSHTYHAGIJXDLS-UHFFFAOYSA-N 1 1 239.403 3.600 20 0 BHADMO FC(F)(F)CC[N@@H+](C1CC1)C1CCCCC1 ZINC000607150809 351029403 /nfs/dbraw/zinc/02/94/03/351029403.db2.gz WQBLWRKNOOSITG-UHFFFAOYSA-N 1 1 235.293 3.736 20 0 BHADMO CC1CCC([N@@H+](CCC(F)(F)F)C2CC2)CC1 ZINC000607150846 351029484 /nfs/dbraw/zinc/02/94/84/351029484.db2.gz CSSVCJMZICDETR-UHFFFAOYSA-N 1 1 249.320 3.982 20 0 BHADMO Cc1ccc(C[N@@H+](CCC(F)(F)F)C2CC2)o1 ZINC000607150899 351029512 /nfs/dbraw/zinc/02/95/12/351029512.db2.gz LGAJICILQQOSOU-UHFFFAOYSA-N 1 1 247.260 3.505 20 0 BHADMO Cc1ccc(C[N@H+](CCC(F)(F)F)C2CC2)o1 ZINC000607150899 351029509 /nfs/dbraw/zinc/02/95/09/351029509.db2.gz LGAJICILQQOSOU-UHFFFAOYSA-N 1 1 247.260 3.505 20 0 BHADMO FC(F)(F)CC[N@H+]1CCC[C@@H]1C1CCCC1 ZINC000607151109 351029596 /nfs/dbraw/zinc/02/95/96/351029596.db2.gz ZOTZOEAWCSWAOG-LLVKDONJSA-N 1 1 235.293 3.593 20 0 BHADMO FC(F)(F)CC[N@H+]1CCC[C@H]1C1CCCC1 ZINC000607151110 351029544 /nfs/dbraw/zinc/02/95/44/351029544.db2.gz ZOTZOEAWCSWAOG-NSHDSACASA-N 1 1 235.293 3.593 20 0 BHADMO CCC[C@H](C)[N@@H+](C)CCOC1CCCCCC1 ZINC000607151119 351029616 /nfs/dbraw/zinc/02/96/16/351029616.db2.gz DDTXDZDQNQFXAF-AWEZNQCLSA-N 1 1 241.419 3.846 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)CCOC1CCCCCC1 ZINC000607151120 351029738 /nfs/dbraw/zinc/02/97/38/351029738.db2.gz DDTXDZDQNQFXAF-CQSZACIVSA-N 1 1 241.419 3.846 20 0 BHADMO CC(C)C[N@@H+](C)CCCc1ccc(Cl)cc1 ZINC000607151283 351029411 /nfs/dbraw/zinc/02/94/11/351029411.db2.gz VUPVVCSHCKXZBQ-UHFFFAOYSA-N 1 1 239.790 3.860 20 0 BHADMO FC(F)(F)CC[N@H+]1CCCC2(CCCCC2)C1 ZINC000607152425 351030430 /nfs/dbraw/zinc/03/04/30/351030430.db2.gz LVDBSOPHBCRRQJ-UHFFFAOYSA-N 1 1 249.320 3.985 20 0 BHADMO CC[C@H](C)C[N@@H+](C)CCOC1CCCCCC1 ZINC000607152426 351030913 /nfs/dbraw/zinc/03/09/13/351030913.db2.gz LVEFSXGIEIHYOI-AWEZNQCLSA-N 1 1 241.419 3.704 20 0 BHADMO CC[C@@H](C)C[N@@H+](C)CCOC1CCCCCC1 ZINC000607152427 351030376 /nfs/dbraw/zinc/03/03/76/351030376.db2.gz LVEFSXGIEIHYOI-CQSZACIVSA-N 1 1 241.419 3.704 20 0 BHADMO CC[N@@H+](CCOC1CCCCCC1)CC(C)C ZINC000607152797 351030985 /nfs/dbraw/zinc/03/09/85/351030985.db2.gz SQTRFXKYTQEAAW-UHFFFAOYSA-N 1 1 241.419 3.704 20 0 BHADMO C[C@@H]1CC[N@@H+](CCC(F)(F)F)[C@@H]2CCCC[C@@H]12 ZINC000607152863 351030236 /nfs/dbraw/zinc/03/02/36/351030236.db2.gz ZUEDUNNYSKXKAX-GRYCIOLGSA-N 1 1 249.320 3.839 20 0 BHADMO C[C@@H]1CC[N@@H+](CCC(F)(F)F)[C@@H]2CCCC[C@H]12 ZINC000607152864 351030290 /nfs/dbraw/zinc/03/02/90/351030290.db2.gz ZUEDUNNYSKXKAX-IJLUTSLNSA-N 1 1 249.320 3.839 20 0 BHADMO C[C@@H]1CC[N@@H+](CCC(F)(F)F)[C@H]2CCCC[C@H]12 ZINC000607152865 351030774 /nfs/dbraw/zinc/03/07/74/351030774.db2.gz ZUEDUNNYSKXKAX-UTUOFQBUSA-N 1 1 249.320 3.839 20 0 BHADMO C[C@@H]1CC[N@@H+](CCC(F)(F)F)[C@H]2CCCC[C@@H]12 ZINC000607152866 351031008 /nfs/dbraw/zinc/03/10/08/351031008.db2.gz ZUEDUNNYSKXKAX-WOPDTQHZSA-N 1 1 249.320 3.839 20 0 BHADMO CC(C)Oc1ccccc1C[N@H+]1C[C@@H](C)C[C@@H]1C ZINC000607154202 351030324 /nfs/dbraw/zinc/03/03/24/351030324.db2.gz DVFGKSLNKJIRCF-KBPBESRZSA-N 1 1 247.382 3.704 20 0 BHADMO CC(C)Oc1ccccc1C[N@H+]1C[C@H](C)C[C@@H]1C ZINC000607154203 351031018 /nfs/dbraw/zinc/03/10/18/351031018.db2.gz DVFGKSLNKJIRCF-KGLIPLIRSA-N 1 1 247.382 3.704 20 0 BHADMO CC(C)Oc1ccccc1C[N@H+]1C[C@@H](C)C[C@H]1C ZINC000607154204 351030614 /nfs/dbraw/zinc/03/06/14/351030614.db2.gz DVFGKSLNKJIRCF-UONOGXRCSA-N 1 1 247.382 3.704 20 0 BHADMO CC(C)Oc1ccccc1C[N@H+]1C[C@H](C)C[C@H]1C ZINC000607154205 351030799 /nfs/dbraw/zinc/03/07/99/351030799.db2.gz DVFGKSLNKJIRCF-ZIAGYGMSSA-N 1 1 247.382 3.704 20 0 BHADMO CCc1ccc(CC[N@H+]2C[C@@H](C)C[C@@H]2C)cc1 ZINC000607154218 351030792 /nfs/dbraw/zinc/03/07/92/351030792.db2.gz GNKUCPDEVOTGKF-KBPBESRZSA-N 1 1 231.383 3.522 20 0 BHADMO CCc1ccc(CC[N@H+]2C[C@H](C)C[C@@H]2C)cc1 ZINC000607154219 351030387 /nfs/dbraw/zinc/03/03/87/351030387.db2.gz GNKUCPDEVOTGKF-KGLIPLIRSA-N 1 1 231.383 3.522 20 0 BHADMO CCc1ccc(CC[N@H+]2C[C@@H](C)C[C@H]2C)cc1 ZINC000607154220 351030786 /nfs/dbraw/zinc/03/07/86/351030786.db2.gz GNKUCPDEVOTGKF-UONOGXRCSA-N 1 1 231.383 3.522 20 0 BHADMO CCc1ccc(CC[N@H+]2C[C@H](C)C[C@H]2C)cc1 ZINC000607154221 351030953 /nfs/dbraw/zinc/03/09/53/351030953.db2.gz GNKUCPDEVOTGKF-ZIAGYGMSSA-N 1 1 231.383 3.522 20 0 BHADMO C[C@@H]1C[C@@H](C)[N@@H+](Cc2cccc(Cl)c2)C1 ZINC000607155060 351031662 /nfs/dbraw/zinc/03/16/62/351031662.db2.gz IEDOFCACCXRSSX-GHMZBOCLSA-N 1 1 223.747 3.570 20 0 BHADMO C[C@@H]1C[C@H](C)[N@@H+](Cc2cccc(Cl)c2)C1 ZINC000607155061 351031481 /nfs/dbraw/zinc/03/14/81/351031481.db2.gz IEDOFCACCXRSSX-MNOVXSKESA-N 1 1 223.747 3.570 20 0 BHADMO C[C@H]1C[C@H](C)[N@@H+](Cc2cccc(Cl)c2)C1 ZINC000607155062 351031912 /nfs/dbraw/zinc/03/19/12/351031912.db2.gz IEDOFCACCXRSSX-QWRGUYRKSA-N 1 1 223.747 3.570 20 0 BHADMO C[C@@H]1C[C@H](C)C[N@@H+]1Cc1cccc(Cl)c1 ZINC000607155063 351031893 /nfs/dbraw/zinc/03/18/93/351031893.db2.gz IEDOFCACCXRSSX-WDEREUQCSA-N 1 1 223.747 3.570 20 0 BHADMO Cc1ccc(C)c(C[N@H+]2C[C@@H](C)C[C@H]2C)c1 ZINC000607155072 351031582 /nfs/dbraw/zinc/03/15/82/351031582.db2.gz INOOVAKFSJKSNL-GXTWGEPZSA-N 1 1 217.356 3.534 20 0 BHADMO Cc1ccc(C)c(C[N@H+]2C[C@@H](C)C[C@@H]2C)c1 ZINC000607155073 351031766 /nfs/dbraw/zinc/03/17/66/351031766.db2.gz INOOVAKFSJKSNL-JSGCOSHPSA-N 1 1 217.356 3.534 20 0 BHADMO Cc1ccc(C)c(C[N@H+]2C[C@H](C)C[C@@H]2C)c1 ZINC000607155074 351032090 /nfs/dbraw/zinc/03/20/90/351032090.db2.gz INOOVAKFSJKSNL-OCCSQVGLSA-N 1 1 217.356 3.534 20 0 BHADMO Cc1ccc(C)c(C[N@H+]2C[C@H](C)C[C@H]2C)c1 ZINC000607155075 351031993 /nfs/dbraw/zinc/03/19/93/351031993.db2.gz INOOVAKFSJKSNL-TZMCWYRMSA-N 1 1 217.356 3.534 20 0 BHADMO Cc1cc(C[N@H+]2C[C@H](C)C[C@H]2C)c(C)s1 ZINC000607155537 351033031 /nfs/dbraw/zinc/03/30/31/351033031.db2.gz RYPYBCRQZRDISA-NXEZZACHSA-N 1 1 223.385 3.595 20 0 BHADMO Cc1cc(C[N@H+]2C[C@@H](C)C[C@@H]2C)c(C)s1 ZINC000607155553 351032660 /nfs/dbraw/zinc/03/26/60/351032660.db2.gz RYPYBCRQZRDISA-UWVGGRQHSA-N 1 1 223.385 3.595 20 0 BHADMO Cc1cc(C[N@H+]2C[C@@H](C)C[C@H]2C)c(C)s1 ZINC000607155554 351033125 /nfs/dbraw/zinc/03/31/25/351033125.db2.gz RYPYBCRQZRDISA-VHSXEESVSA-N 1 1 223.385 3.595 20 0 BHADMO Cc1cc(C[N@H+]2C[C@H](C)C[C@@H]2C)c(C)s1 ZINC000607155555 351032553 /nfs/dbraw/zinc/03/25/53/351032553.db2.gz RYPYBCRQZRDISA-ZJUUUORDSA-N 1 1 223.385 3.595 20 0 BHADMO CC(C)[N@@H+](CC1CCCCC1)C1CCC1 ZINC000607155951 351032814 /nfs/dbraw/zinc/03/28/14/351032814.db2.gz RERBLWYVFPAWEF-UHFFFAOYSA-N 1 1 209.377 3.830 20 0 BHADMO CCC[N@@H+](Cc1ccc(C)c(C)c1)C1CC1 ZINC000607156280 351033077 /nfs/dbraw/zinc/03/30/77/351033077.db2.gz LJYCTMPQOFTBBL-UHFFFAOYSA-N 1 1 217.356 3.678 20 0 BHADMO CC(C)C[C@H]1CCCCC[N@H+]1CC(F)F ZINC000607156921 351028026 /nfs/dbraw/zinc/02/80/26/351028026.db2.gz HRFPQBAVQIXNGA-LLVKDONJSA-N 1 1 219.319 3.542 20 0 BHADMO CC(C)C[C@@H]1CCCCC[N@H+]1CC(F)F ZINC000607156922 351028186 /nfs/dbraw/zinc/02/81/86/351028186.db2.gz HRFPQBAVQIXNGA-NSHDSACASA-N 1 1 219.319 3.542 20 0 BHADMO CO[C@@H](C)C[N@@H+](C[C@@H](C)c1ccccc1)C(C)C ZINC000607157391 351028277 /nfs/dbraw/zinc/02/82/77/351028277.db2.gz UAMWELGASVGOCD-CABCVRRESA-N 1 1 249.398 3.535 20 0 BHADMO CO[C@@H](C)C[N@@H+](C[C@H](C)c1ccccc1)C(C)C ZINC000607157392 351028039 /nfs/dbraw/zinc/02/80/39/351028039.db2.gz UAMWELGASVGOCD-GJZGRUSLSA-N 1 1 249.398 3.535 20 0 BHADMO CO[C@H](C)C[N@@H+](C[C@@H](C)c1ccccc1)C(C)C ZINC000607157393 351028105 /nfs/dbraw/zinc/02/81/05/351028105.db2.gz UAMWELGASVGOCD-HUUCEWRRSA-N 1 1 249.398 3.535 20 0 BHADMO CO[C@H](C)C[N@@H+](C[C@H](C)c1ccccc1)C(C)C ZINC000607157394 351028203 /nfs/dbraw/zinc/02/82/03/351028203.db2.gz UAMWELGASVGOCD-LSDHHAIUSA-N 1 1 249.398 3.535 20 0 BHADMO CO[C@@H](C)C[N@@H+](Cc1c(C)cccc1C)C(C)C ZINC000607157471 351028282 /nfs/dbraw/zinc/02/82/82/351028282.db2.gz XYTNJNSCNLNLGL-HNNXBMFYSA-N 1 1 249.398 3.549 20 0 BHADMO CO[C@H](C)C[N@@H+](Cc1c(C)cccc1C)C(C)C ZINC000607157472 351028078 /nfs/dbraw/zinc/02/80/78/351028078.db2.gz XYTNJNSCNLNLGL-OAHLLOKOSA-N 1 1 249.398 3.549 20 0 BHADMO CO[C@@H](C)C[N@@H+](Cc1cc(C)ccc1C)C(C)C ZINC000607157565 351028089 /nfs/dbraw/zinc/02/80/89/351028089.db2.gz MEJZIIIJQAUZAE-HNNXBMFYSA-N 1 1 249.398 3.549 20 0 BHADMO CO[C@H](C)C[N@@H+](Cc1cc(C)ccc1C)C(C)C ZINC000607157566 351028273 /nfs/dbraw/zinc/02/82/73/351028273.db2.gz MEJZIIIJQAUZAE-OAHLLOKOSA-N 1 1 249.398 3.549 20 0 BHADMO CC(C)C[C@@H]1CCCCC[N@H+]1Cc1ccccn1 ZINC000607192406 351064271 /nfs/dbraw/zinc/06/42/71/351064271.db2.gz GPCOZDOZFVKMGP-INIZCTEOSA-N 1 1 246.398 3.872 20 0 BHADMO CC(C)C[C@H]1CCCCC[N@H+]1Cc1ccccn1 ZINC000607192407 351064127 /nfs/dbraw/zinc/06/41/27/351064127.db2.gz GPCOZDOZFVKMGP-MRXNPFEDSA-N 1 1 246.398 3.872 20 0 BHADMO CN(C)c1cccc(C[N@@H+](C)C2CCCCC2)c1 ZINC000607723856 342780301 /nfs/dbraw/zinc/78/03/01/342780301.db2.gz QEXFRIGRXHVZHF-UHFFFAOYSA-N 1 1 246.398 3.517 20 0 BHADMO c1ccc2c(c1)CC[N@H+](CCC1CCCC1)C2 ZINC000607725051 342781949 /nfs/dbraw/zinc/78/19/49/342781949.db2.gz BNAAESZYHCTOHU-UHFFFAOYSA-N 1 1 229.367 3.625 20 0 BHADMO C[C@H]1CCC[N@@H+](CCCCOc2ccccc2)C1 ZINC000607725054 342781858 /nfs/dbraw/zinc/78/18/58/342781858.db2.gz CRJCTQDGUBIASJ-HNNXBMFYSA-N 1 1 247.382 3.578 20 0 BHADMO C[C@@H]1CCC[N@@H+](CCCCOc2ccccc2)C1 ZINC000607725055 342781967 /nfs/dbraw/zinc/78/19/67/342781967.db2.gz CRJCTQDGUBIASJ-OAHLLOKOSA-N 1 1 247.382 3.578 20 0 BHADMO C[C@@H]1C[C@H](C)C[N@H+](CCC2CCCC2)C1 ZINC000607725085 342781901 /nfs/dbraw/zinc/78/19/01/342781901.db2.gz NJYSAUULHDQAHF-BETUJISGSA-N 1 1 209.377 3.545 20 0 BHADMO C[N@@H+](CCC1CCCC1)Cc1cccc(F)c1 ZINC000607725146 342781955 /nfs/dbraw/zinc/78/19/55/342781955.db2.gz JDHPWQQDBBYRKP-UHFFFAOYSA-N 1 1 235.346 3.838 20 0 BHADMO COc1ccccc1C[N@@H+](C)CCC1CCCC1 ZINC000607725158 342781852 /nfs/dbraw/zinc/78/18/52/342781852.db2.gz MFXDWMREYLFZIQ-UHFFFAOYSA-N 1 1 247.382 3.707 20 0 BHADMO COc1cccc(C[N@@H+](C)CCC2CCCC2)c1 ZINC000607725192 342782010 /nfs/dbraw/zinc/78/20/10/342782010.db2.gz WQQNEDZYLMRWFX-UHFFFAOYSA-N 1 1 247.382 3.707 20 0 BHADMO CCOCCC[N@@H+](C)Cc1ccc(C(C)C)cc1 ZINC000607725264 342781880 /nfs/dbraw/zinc/78/18/80/342781880.db2.gz JKFPICMTXJWUNI-UHFFFAOYSA-N 1 1 249.398 3.668 20 0 BHADMO CCOCCC[N@@H+](Cc1ccccc1)[C@@H](C)CC ZINC000607725527 342782270 /nfs/dbraw/zinc/78/22/70/342782270.db2.gz CYFGQTGOFAQBIV-HNNXBMFYSA-N 1 1 249.398 3.714 20 0 BHADMO CCOCCC[N@@H+](Cc1ccccc1)[C@H](C)CC ZINC000607725528 342782158 /nfs/dbraw/zinc/78/21/58/342782158.db2.gz CYFGQTGOFAQBIV-OAHLLOKOSA-N 1 1 249.398 3.714 20 0 BHADMO C[N@@H+](CCC1CCCC1)Cc1ccsc1 ZINC000607725676 342782163 /nfs/dbraw/zinc/78/21/63/342782163.db2.gz MAORQUIUTMDNFA-UHFFFAOYSA-N 1 1 223.385 3.760 20 0 BHADMO c1cc2c(s1)CC[N@H+](CCC1CCCC1)C2 ZINC000607726008 342782197 /nfs/dbraw/zinc/78/21/97/342782197.db2.gz MBIRGNIVUQFKGW-UHFFFAOYSA-N 1 1 235.396 3.687 20 0 BHADMO CCCC[N@@H+](CC)CCCc1cccc(OC)c1 ZINC000607726215 342782206 /nfs/dbraw/zinc/78/22/06/342782206.db2.gz BBGXUFQINJYUKX-UHFFFAOYSA-N 1 1 249.398 3.750 20 0 BHADMO CC[C@@H]1CCC[N@@H+](CCC2CCCC2)C1 ZINC000607726469 342782200 /nfs/dbraw/zinc/78/22/00/342782200.db2.gz ANMMPUALNOXWMW-CYBMUJFWSA-N 1 1 209.377 3.689 20 0 BHADMO CC[C@H]1CCC[N@@H+](CCC2CCCC2)C1 ZINC000607726470 342782246 /nfs/dbraw/zinc/78/22/46/342782246.db2.gz ANMMPUALNOXWMW-ZDUSSCGKSA-N 1 1 209.377 3.689 20 0 BHADMO CCCC[N@@H+](CCC1CCCC1)C1CC1 ZINC000607726547 342782183 /nfs/dbraw/zinc/78/21/83/342782183.db2.gz PQYPEHPFVCPATJ-UHFFFAOYSA-N 1 1 209.377 3.831 20 0 BHADMO CCC[C@H](C)[N@@H+](C)CCCc1cccc(OC)c1 ZINC000607726649 342782212 /nfs/dbraw/zinc/78/22/12/342782212.db2.gz JJDMQTJWHSHXSU-AWEZNQCLSA-N 1 1 249.398 3.748 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)CCCc1cccc(OC)c1 ZINC000607726650 342782193 /nfs/dbraw/zinc/78/21/93/342782193.db2.gz JJDMQTJWHSHXSU-CQSZACIVSA-N 1 1 249.398 3.748 20 0 BHADMO C[N@H+](CCc1ccccc1)CCC1CCCC1 ZINC000607726891 342782411 /nfs/dbraw/zinc/78/24/11/342782411.db2.gz FPKKDSPPWOZTBN-UHFFFAOYSA-N 1 1 231.383 3.741 20 0 BHADMO COc1cccc(CCC[N@@H+](C)CCC(C)C)c1 ZINC000607727193 342782470 /nfs/dbraw/zinc/78/24/70/342782470.db2.gz LRPYFWMJUUYELR-UHFFFAOYSA-N 1 1 249.398 3.606 20 0 BHADMO CC(C)CC[N@@H+](C)CCCCOc1ccccc1 ZINC000607727243 342782438 /nfs/dbraw/zinc/78/24/38/342782438.db2.gz SBHGETGFZXLUIT-UHFFFAOYSA-N 1 1 249.398 3.824 20 0 BHADMO CCOCCC[N@@H+](C)[C@@H](C)c1ccc(C)cc1C ZINC000607727360 342782620 /nfs/dbraw/zinc/78/26/20/342782620.db2.gz LZFSJUHKJQFPIR-HNNXBMFYSA-N 1 1 249.398 3.723 20 0 BHADMO CCOCCC[N@@H+](C)[C@H](C)c1ccc(C)cc1C ZINC000607727361 342782450 /nfs/dbraw/zinc/78/24/50/342782450.db2.gz LZFSJUHKJQFPIR-OAHLLOKOSA-N 1 1 249.398 3.723 20 0 BHADMO CCC[N@@H+](CCCOCC)CC1CCCCC1 ZINC000607727484 342782835 /nfs/dbraw/zinc/78/28/35/342782835.db2.gz KFVCBTXAGNYMKB-UHFFFAOYSA-N 1 1 241.419 3.705 20 0 BHADMO C[N@H+](CCc1ccc(F)cc1)CCC1CCCC1 ZINC000607727601 342782856 /nfs/dbraw/zinc/78/28/56/342782856.db2.gz ZVSXVLKASRPOLZ-UHFFFAOYSA-N 1 1 249.373 3.880 20 0 BHADMO CCOCCC[N@@H+](CC)[C@@H](CC)c1ccccc1 ZINC000607727891 342782802 /nfs/dbraw/zinc/78/28/02/342782802.db2.gz CKSIBAOFBODCQR-INIZCTEOSA-N 1 1 249.398 3.886 20 0 BHADMO CCOCCC[N@@H+](CC)[C@H](CC)c1ccccc1 ZINC000607727892 342782892 /nfs/dbraw/zinc/78/28/92/342782892.db2.gz CKSIBAOFBODCQR-MRXNPFEDSA-N 1 1 249.398 3.886 20 0 BHADMO CC[N@@H+](CCC1CCCC1)CCC(F)(F)F ZINC000607728237 342781532 /nfs/dbraw/zinc/78/15/32/342781532.db2.gz ZALZYZQMRXMMDA-UHFFFAOYSA-N 1 1 237.309 3.841 20 0 BHADMO CC[N@@H+](CCC1CCCC1)Cc1ccoc1 ZINC000607728955 342783738 /nfs/dbraw/zinc/78/37/38/342783738.db2.gz VYMUBLCVYDKJSX-UHFFFAOYSA-N 1 1 221.344 3.682 20 0 BHADMO CCC(CC)[N@@H+](CCOC)CCC1CCCC1 ZINC000607729107 342783983 /nfs/dbraw/zinc/78/39/83/342783983.db2.gz FHFGNIWFPNBNDY-UHFFFAOYSA-N 1 1 241.419 3.704 20 0 BHADMO COc1cccc(CCC[N@H+]2CCCC2(C)C)c1 ZINC000607729108 342783874 /nfs/dbraw/zinc/78/38/74/342783874.db2.gz GCXFUIMTSAJVSU-UHFFFAOYSA-N 1 1 247.382 3.502 20 0 BHADMO c1coc([C@H]2CC[N@H+](CCC3CCCC3)C2)c1 ZINC000607731542 342783137 /nfs/dbraw/zinc/78/31/37/342783137.db2.gz BKOFKVJHGCWIPR-AWEZNQCLSA-N 1 1 233.355 3.649 20 0 BHADMO c1coc([C@@H]2CC[N@H+](CCC3CCCC3)C2)c1 ZINC000607731547 342783173 /nfs/dbraw/zinc/78/31/73/342783173.db2.gz BKOFKVJHGCWIPR-CQSZACIVSA-N 1 1 233.355 3.649 20 0 BHADMO CCOCCC[N@@H+](C)[C@H](c1ccccc1)C(C)C ZINC000607732165 342783515 /nfs/dbraw/zinc/78/35/15/342783515.db2.gz VURXEMYSOOCYGI-INIZCTEOSA-N 1 1 249.398 3.742 20 0 BHADMO CCOCCC[N@@H+](C)[C@@H](c1ccccc1)C(C)C ZINC000607732166 342783342 /nfs/dbraw/zinc/78/33/42/342783342.db2.gz VURXEMYSOOCYGI-MRXNPFEDSA-N 1 1 249.398 3.742 20 0 BHADMO CCC[N@@H+](CCCOCC)Cc1ccc(C)cc1 ZINC000607732227 342783379 /nfs/dbraw/zinc/78/33/79/342783379.db2.gz AAQKTBZPQPNWFQ-UHFFFAOYSA-N 1 1 249.398 3.634 20 0 BHADMO CC[N@@H+](CCc1ccc(C)cc1)[C@@H](C)C(C)C ZINC000607732877 342783451 /nfs/dbraw/zinc/78/34/51/342783451.db2.gz ZIFISWPFQJAVMO-HNNXBMFYSA-N 1 1 233.399 3.904 20 0 BHADMO CC[N@@H+](CCc1ccc(C)cc1)[C@H](C)C(C)C ZINC000607732878 342783481 /nfs/dbraw/zinc/78/34/81/342783481.db2.gz ZIFISWPFQJAVMO-OAHLLOKOSA-N 1 1 233.399 3.904 20 0 BHADMO CCOCCC[N@H+]1CCC[C@H](C(C)(C)C)CC1 ZINC000607734869 342785925 /nfs/dbraw/zinc/78/59/25/342785925.db2.gz UDPREROBSJNJMZ-AWEZNQCLSA-N 1 1 241.419 3.561 20 0 BHADMO CCOCCC[N@H+]1CCC[C@@H](C(C)(C)C)CC1 ZINC000607734870 342785957 /nfs/dbraw/zinc/78/59/57/342785957.db2.gz UDPREROBSJNJMZ-CQSZACIVSA-N 1 1 241.419 3.561 20 0 BHADMO CCOCCC[N@H+]1CCCCC[C@H]1CC(C)C ZINC000607735531 342784874 /nfs/dbraw/zinc/78/48/74/342784874.db2.gz ILFGPBZYTAVFCI-HNNXBMFYSA-N 1 1 241.419 3.704 20 0 BHADMO CCOCCC[N@H+]1CCCCC[C@@H]1CC(C)C ZINC000607735532 342784640 /nfs/dbraw/zinc/78/46/40/342784640.db2.gz ILFGPBZYTAVFCI-OAHLLOKOSA-N 1 1 241.419 3.704 20 0 BHADMO c1ccc(C[C@@H]2CC[N@H+](CC3CCCC3)C2)cc1 ZINC000607739844 342786203 /nfs/dbraw/zinc/78/62/03/342786203.db2.gz FRMCWNXJKLOEDF-KRWDZBQOSA-N 1 1 243.394 3.741 20 0 BHADMO c1ccc(C[C@H]2CC[N@H+](CC3CCCC3)C2)cc1 ZINC000607739845 342786201 /nfs/dbraw/zinc/78/62/01/342786201.db2.gz FRMCWNXJKLOEDF-QGZVFWFLSA-N 1 1 243.394 3.741 20 0 BHADMO Cc1ccc(CC[N@@H+]2CCC[C@@H](C)[C@@H]2C)cc1 ZINC000607740226 342786242 /nfs/dbraw/zinc/78/62/42/342786242.db2.gz BDDRHFAQJSRLCS-CABCVRRESA-N 1 1 231.383 3.658 20 0 BHADMO Cc1ccc(CC[N@@H+]2CCC[C@H](C)[C@@H]2C)cc1 ZINC000607740227 342786208 /nfs/dbraw/zinc/78/62/08/342786208.db2.gz BDDRHFAQJSRLCS-GJZGRUSLSA-N 1 1 231.383 3.658 20 0 BHADMO Cc1ccc(CC[N@@H+]2CCC[C@@H](C)[C@H]2C)cc1 ZINC000607740228 342786184 /nfs/dbraw/zinc/78/61/84/342786184.db2.gz BDDRHFAQJSRLCS-HUUCEWRRSA-N 1 1 231.383 3.658 20 0 BHADMO Cc1ccc(CC[N@@H+]2CCC[C@H](C)[C@H]2C)cc1 ZINC000607740229 342786193 /nfs/dbraw/zinc/78/61/93/342786193.db2.gz BDDRHFAQJSRLCS-LSDHHAIUSA-N 1 1 231.383 3.658 20 0 BHADMO C[C@H](C[N@H+]1CCC[C@@H](C)[C@@H]1C)c1ccccc1 ZINC000607740360 342786227 /nfs/dbraw/zinc/78/62/27/342786227.db2.gz NKBYKTFPBGANQU-KFWWJZLASA-N 1 1 231.383 3.911 20 0 BHADMO C[C@H](C[N@H+]1CCC[C@@H](C)[C@H]1C)c1ccccc1 ZINC000607740361 342786159 /nfs/dbraw/zinc/78/61/59/342786159.db2.gz NKBYKTFPBGANQU-RBSFLKMASA-N 1 1 231.383 3.911 20 0 BHADMO C[C@H](C[N@H+]1CCC[C@H](C)[C@H]1C)c1ccccc1 ZINC000607740362 342786222 /nfs/dbraw/zinc/78/62/22/342786222.db2.gz NKBYKTFPBGANQU-RRFJBIMHSA-N 1 1 231.383 3.911 20 0 BHADMO C[C@H](C[N@H+]1CCC[C@H](C)[C@@H]1C)c1ccccc1 ZINC000607740363 342786245 /nfs/dbraw/zinc/78/62/45/342786245.db2.gz NKBYKTFPBGANQU-ZNMIVQPWSA-N 1 1 231.383 3.911 20 0 BHADMO C[C@@H]1CCC[N@@H+](Cc2cccc(Cl)c2)[C@H]1C ZINC000607740376 342786320 /nfs/dbraw/zinc/78/63/20/342786320.db2.gz OLIZJMAPPJFUAI-NEPJUHHUSA-N 1 1 237.774 3.960 20 0 BHADMO C[C@@H]1[C@@H](C)CCC[N@H+]1Cc1cccc(Cl)c1 ZINC000607740377 342786338 /nfs/dbraw/zinc/78/63/38/342786338.db2.gz OLIZJMAPPJFUAI-NWDGAFQWSA-N 1 1 237.774 3.960 20 0 BHADMO C[C@H]1CCC[N@@H+](Cc2cccc(Cl)c2)[C@H]1C ZINC000607740378 342786151 /nfs/dbraw/zinc/78/61/51/342786151.db2.gz OLIZJMAPPJFUAI-RYUDHWBXSA-N 1 1 237.774 3.960 20 0 BHADMO C[C@@H]1CCC[N@@H+](Cc2cccc(Cl)c2)[C@@H]1C ZINC000607740379 342786179 /nfs/dbraw/zinc/78/61/79/342786179.db2.gz OLIZJMAPPJFUAI-VXGBXAGGSA-N 1 1 237.774 3.960 20 0 BHADMO C[C@@H]1CCC[N@@H+](CCCOc2ccccc2)[C@H]1C ZINC000607740406 342786215 /nfs/dbraw/zinc/78/62/15/342786215.db2.gz RAJBWNVQCCGVGL-CABCVRRESA-N 1 1 247.382 3.576 20 0 BHADMO C[C@H]1CCC[N@@H+](CCCOc2ccccc2)[C@H]1C ZINC000607740407 342786173 /nfs/dbraw/zinc/78/61/73/342786173.db2.gz RAJBWNVQCCGVGL-GJZGRUSLSA-N 1 1 247.382 3.576 20 0 BHADMO C[C@@H]1CCC[N@@H+](CCCOc2ccccc2)[C@@H]1C ZINC000607740408 342786345 /nfs/dbraw/zinc/78/63/45/342786345.db2.gz RAJBWNVQCCGVGL-HUUCEWRRSA-N 1 1 247.382 3.576 20 0 BHADMO C[C@@H]1[C@@H](C)CCC[N@H+]1CCCOc1ccccc1 ZINC000607740409 342786234 /nfs/dbraw/zinc/78/62/34/342786234.db2.gz RAJBWNVQCCGVGL-LSDHHAIUSA-N 1 1 247.382 3.576 20 0 BHADMO C[C@@H]1CCC[N@@H+](C/C=C/c2ccccc2)[C@H]1C ZINC000607740436 342786307 /nfs/dbraw/zinc/78/63/07/342786307.db2.gz SYWAMDJRLXEPGS-CYSMCQCQSA-N 1 1 229.367 3.820 20 0 BHADMO C[C@@H]1CCC[N@@H+](C/C=C\c2ccccc2)[C@@H]1C ZINC000607740437 342786280 /nfs/dbraw/zinc/78/62/80/342786280.db2.gz SYWAMDJRLXEPGS-LNVAGALZSA-N 1 1 229.367 3.820 20 0 BHADMO C[C@@H]1CCC[N@@H+](C/C=C\c2ccccc2)[C@H]1C ZINC000607740438 342786146 /nfs/dbraw/zinc/78/61/46/342786146.db2.gz SYWAMDJRLXEPGS-PHACEPHWSA-N 1 1 229.367 3.820 20 0 BHADMO C[C@@H]1CCC[N@@H+](C/C=C/c2ccccc2)[C@@H]1C ZINC000607740439 342786217 /nfs/dbraw/zinc/78/62/17/342786217.db2.gz SYWAMDJRLXEPGS-SNVZYIDKSA-N 1 1 229.367 3.820 20 0 BHADMO C[C@@H]1CCC[N@@H+](Cc2ccc(Cl)cc2)[C@H]1C ZINC000607741039 342786590 /nfs/dbraw/zinc/78/65/90/342786590.db2.gz LWKGZNFPKBMRPN-NEPJUHHUSA-N 1 1 237.774 3.960 20 0 BHADMO C[C@@H]1[C@@H](C)CCC[N@H+]1Cc1ccc(Cl)cc1 ZINC000607741040 342786482 /nfs/dbraw/zinc/78/64/82/342786482.db2.gz LWKGZNFPKBMRPN-NWDGAFQWSA-N 1 1 237.774 3.960 20 0 BHADMO C[C@H]1CCC[N@@H+](Cc2ccc(Cl)cc2)[C@H]1C ZINC000607741041 342786725 /nfs/dbraw/zinc/78/67/25/342786725.db2.gz LWKGZNFPKBMRPN-RYUDHWBXSA-N 1 1 237.774 3.960 20 0 BHADMO C[C@@H]1CCC[N@@H+](Cc2ccc(Cl)cc2)[C@@H]1C ZINC000607741042 342786678 /nfs/dbraw/zinc/78/66/78/342786678.db2.gz LWKGZNFPKBMRPN-VXGBXAGGSA-N 1 1 237.774 3.960 20 0 BHADMO CCOCC[N@H+]1CCCC[C@H]1c1ccc(C)cc1 ZINC000607741625 342786472 /nfs/dbraw/zinc/78/64/72/342786472.db2.gz CVYUAWYCUGBUOF-INIZCTEOSA-N 1 1 247.382 3.559 20 0 BHADMO CCOCC[N@H+]1CCCC[C@@H]1c1ccc(C)cc1 ZINC000607741626 342786582 /nfs/dbraw/zinc/78/65/82/342786582.db2.gz CVYUAWYCUGBUOF-MRXNPFEDSA-N 1 1 247.382 3.559 20 0 BHADMO C[C@@H]1CCC[C@@H](C)[N@@H+](Cc2ccc(F)cc2)C1 ZINC000607742515 342787008 /nfs/dbraw/zinc/78/70/08/342787008.db2.gz JWTPAEFUHJRFOO-CHWSQXEVSA-N 1 1 235.346 3.836 20 0 BHADMO C[C@@H]1CCC[C@H](C)[N@@H+](Cc2ccc(F)cc2)C1 ZINC000607742516 342786989 /nfs/dbraw/zinc/78/69/89/342786989.db2.gz JWTPAEFUHJRFOO-OLZOCXBDSA-N 1 1 235.346 3.836 20 0 BHADMO C[C@@H]1CCC[C@H](C)C[N@@H+]1Cc1ccc(F)cc1 ZINC000607742517 342786902 /nfs/dbraw/zinc/78/69/02/342786902.db2.gz JWTPAEFUHJRFOO-QWHCGFSZSA-N 1 1 235.346 3.836 20 0 BHADMO C[C@H]1CCC[C@H](C)[N@@H+](Cc2ccc(F)cc2)C1 ZINC000607742518 342786930 /nfs/dbraw/zinc/78/69/30/342786930.db2.gz JWTPAEFUHJRFOO-STQMWFEESA-N 1 1 235.346 3.836 20 0 BHADMO C[C@@H]1CCC[C@H](C)[N@@H+](CCOc2ccccc2)C1 ZINC000607742581 342786769 /nfs/dbraw/zinc/78/67/69/342786769.db2.gz QUGGQOPLAVAUAY-CABCVRRESA-N 1 1 247.382 3.576 20 0 BHADMO C[C@H]1CCC[C@H](C)[N@@H+](CCOc2ccccc2)C1 ZINC000607742582 342786983 /nfs/dbraw/zinc/78/69/83/342786983.db2.gz QUGGQOPLAVAUAY-GJZGRUSLSA-N 1 1 247.382 3.576 20 0 BHADMO C[C@@H]1CCC[C@@H](C)[N@@H+](CCOc2ccccc2)C1 ZINC000607742583 342786855 /nfs/dbraw/zinc/78/68/55/342786855.db2.gz QUGGQOPLAVAUAY-HUUCEWRRSA-N 1 1 247.382 3.576 20 0 BHADMO C[C@@H]1CCC[C@H](C)C[N@@H+]1CCOc1ccccc1 ZINC000607742584 342787011 /nfs/dbraw/zinc/78/70/11/342787011.db2.gz QUGGQOPLAVAUAY-LSDHHAIUSA-N 1 1 247.382 3.576 20 0 BHADMO C[C@@H]1CCC[C@H](C)[N@H+]([C@@H]2C=CCCC2)C1 ZINC000607742627 342786847 /nfs/dbraw/zinc/78/68/47/342786847.db2.gz YANOFUPSCJIZCU-HZSPNIEDSA-N 1 1 207.361 3.606 20 0 BHADMO C[C@@H]1CCC[C@@H](C)[N@H+]([C@H]2C=CCCC2)C1 ZINC000607742628 342786844 /nfs/dbraw/zinc/78/68/44/342786844.db2.gz YANOFUPSCJIZCU-MCIONIFRSA-N 1 1 207.361 3.606 20 0 BHADMO C[C@@H]1CCC[C@@H](C)[N@H+]([C@@H]2C=CCCC2)C1 ZINC000607742629 342786927 /nfs/dbraw/zinc/78/69/27/342786927.db2.gz YANOFUPSCJIZCU-MGPQQGTHSA-N 1 1 207.361 3.606 20 0 BHADMO C[C@@H]1CCC[C@H](C)[N@H+]([C@H]2C=CCCC2)C1 ZINC000607742630 342786943 /nfs/dbraw/zinc/78/69/43/342786943.db2.gz YANOFUPSCJIZCU-RDBSUJKOSA-N 1 1 207.361 3.606 20 0 BHADMO C[C@@H]1CCC[C@@H](C)[N@@H+](CC2CCCC2)C1 ZINC000607742689 342786959 /nfs/dbraw/zinc/78/69/59/342786959.db2.gz GVKHCUHNLTVDRM-CHWSQXEVSA-N 1 1 209.377 3.687 20 0 BHADMO C[C@@H]1CCC[C@H](C)[N@@H+](CC2CCCC2)C1 ZINC000607742690 342786841 /nfs/dbraw/zinc/78/68/41/342786841.db2.gz GVKHCUHNLTVDRM-OLZOCXBDSA-N 1 1 209.377 3.687 20 0 BHADMO C[C@@H]1CCC[C@H](C)C[N@@H+]1CC1CCCC1 ZINC000607742691 342787020 /nfs/dbraw/zinc/78/70/20/342787020.db2.gz GVKHCUHNLTVDRM-QWHCGFSZSA-N 1 1 209.377 3.687 20 0 BHADMO C[C@H]1CCC[C@H](C)[N@@H+](CC2CCCC2)C1 ZINC000607742692 342786880 /nfs/dbraw/zinc/78/68/80/342786880.db2.gz GVKHCUHNLTVDRM-STQMWFEESA-N 1 1 209.377 3.687 20 0 BHADMO C[C@@H]1CCC[C@@H](C)[N@@H+](Cc2cccc(F)c2)C1 ZINC000607742877 342786962 /nfs/dbraw/zinc/78/69/62/342786962.db2.gz WNPBCJOODSTWNY-CHWSQXEVSA-N 1 1 235.346 3.836 20 0 BHADMO C[C@@H]1CCC[C@H](C)[N@@H+](Cc2cccc(F)c2)C1 ZINC000607742878 342786968 /nfs/dbraw/zinc/78/69/68/342786968.db2.gz WNPBCJOODSTWNY-OLZOCXBDSA-N 1 1 235.346 3.836 20 0 BHADMO C[C@@H]1CCC[C@H](C)C[N@@H+]1Cc1cccc(F)c1 ZINC000607742879 342786762 /nfs/dbraw/zinc/78/67/62/342786762.db2.gz WNPBCJOODSTWNY-QWHCGFSZSA-N 1 1 235.346 3.836 20 0 BHADMO C[C@H]1CCC[C@H](C)[N@@H+](Cc2cccc(F)c2)C1 ZINC000607742880 342786866 /nfs/dbraw/zinc/78/68/66/342786866.db2.gz WNPBCJOODSTWNY-STQMWFEESA-N 1 1 235.346 3.836 20 0 BHADMO CCCCC[N@H+]1CCO[C@H](c2ccccc2C)C1 ZINC000607745921 342787382 /nfs/dbraw/zinc/78/73/82/342787382.db2.gz UZGQKFUZJPVRBF-INIZCTEOSA-N 1 1 247.382 3.559 20 0 BHADMO CCCCC[N@H+]1CCO[C@@H](c2ccccc2C)C1 ZINC000607745922 342787352 /nfs/dbraw/zinc/78/73/52/342787352.db2.gz UZGQKFUZJPVRBF-MRXNPFEDSA-N 1 1 247.382 3.559 20 0 BHADMO C[C@H]1Cc2ccccc2C[N@H+]1[C@H]1C=CCCC1 ZINC000607747585 342786905 /nfs/dbraw/zinc/78/69/05/342786905.db2.gz RAXUGLJOQGKBDF-BBRMVZONSA-N 1 1 227.351 3.542 20 0 BHADMO C[C@@H]1Cc2ccccc2C[N@H+]1[C@H]1C=CCCC1 ZINC000607747589 342786935 /nfs/dbraw/zinc/78/69/35/342786935.db2.gz RAXUGLJOQGKBDF-CJNGLKHVSA-N 1 1 227.351 3.542 20 0 BHADMO C[C@@H]1Cc2ccccc2C[N@H+]1[C@@H]1C=CCCC1 ZINC000607747590 342786810 /nfs/dbraw/zinc/78/68/10/342786810.db2.gz RAXUGLJOQGKBDF-CZUORRHYSA-N 1 1 227.351 3.542 20 0 BHADMO C[C@H]1Cc2ccccc2C[N@H+]1[C@@H]1C=CCCC1 ZINC000607747591 342786939 /nfs/dbraw/zinc/78/69/39/342786939.db2.gz RAXUGLJOQGKBDF-XJKSGUPXSA-N 1 1 227.351 3.542 20 0 BHADMO CC1(C)CCC[N@H+]([C@@H]2C=CCCC2)CC1 ZINC000607748485 342787113 /nfs/dbraw/zinc/78/71/13/342787113.db2.gz IEWILTSHDUMNMA-CYBMUJFWSA-N 1 1 207.361 3.607 20 0 BHADMO CC1(C)CCC[N@H+]([C@H]2C=CCCC2)CC1 ZINC000607748486 342787240 /nfs/dbraw/zinc/78/72/40/342787240.db2.gz IEWILTSHDUMNMA-ZDUSSCGKSA-N 1 1 207.361 3.607 20 0 BHADMO C[C@H](c1ccncc1)[N@H+]1CCCC(C)(C)CC1 ZINC000607748740 342787220 /nfs/dbraw/zinc/78/72/20/342787220.db2.gz ARIDAUKKZGXAMH-CYBMUJFWSA-N 1 1 232.371 3.655 20 0 BHADMO C[C@@H](c1ccncc1)[N@H+]1CCCC(C)(C)CC1 ZINC000607748741 342787209 /nfs/dbraw/zinc/78/72/09/342787209.db2.gz ARIDAUKKZGXAMH-ZDUSSCGKSA-N 1 1 232.371 3.655 20 0 BHADMO CC1(C)CCC[N@@H+](CC2CCCC2)CC1 ZINC000607748784 342787141 /nfs/dbraw/zinc/78/71/41/342787141.db2.gz QNBMSFAYRDIXLD-UHFFFAOYSA-N 1 1 209.377 3.689 20 0 BHADMO CC1(C)CCC[N@@H+](Cc2cccc(F)c2)CC1 ZINC000607748808 342787253 /nfs/dbraw/zinc/78/72/53/342787253.db2.gz ZUAFARZRMVFLAO-UHFFFAOYSA-N 1 1 235.346 3.838 20 0 BHADMO CC[C@@H](Cc1ccccc1)[N@@H+](C)CC(C)C ZINC000607751248 342788187 /nfs/dbraw/zinc/78/81/87/342788187.db2.gz WJNFLTFBURUXQZ-HNNXBMFYSA-N 1 1 219.372 3.596 20 0 BHADMO CC[C@H](Cc1ccccc1)[N@@H+](C)CC(C)C ZINC000607751249 342788154 /nfs/dbraw/zinc/78/81/54/342788154.db2.gz WJNFLTFBURUXQZ-OAHLLOKOSA-N 1 1 219.372 3.596 20 0 BHADMO CC(C)=CC[N@H+]1CCC2(C1)CCCCC2 ZINC000607752474 342787607 /nfs/dbraw/zinc/78/76/07/342787607.db2.gz DEOMJESBVPPXTO-UHFFFAOYSA-N 1 1 207.361 3.609 20 0 BHADMO C1=C[C@H]([N@H+]2CCC3(C2)CCCCC3)CCC1 ZINC000607752561 342787617 /nfs/dbraw/zinc/78/76/17/342787617.db2.gz OQCJHQASEBGNKA-AWEZNQCLSA-N 1 1 219.372 3.751 20 0 BHADMO C1=C[C@@H]([N@H+]2CCC3(C2)CCCCC3)CCC1 ZINC000607752562 342787619 /nfs/dbraw/zinc/78/76/19/342787619.db2.gz OQCJHQASEBGNKA-CQSZACIVSA-N 1 1 219.372 3.751 20 0 BHADMO c1ccc(C[N@H+]2CCC3(C2)CCCCC3)cc1 ZINC000607752583 342788042 /nfs/dbraw/zinc/78/80/42/342788042.db2.gz SGTSRSQTGIYFCT-UHFFFAOYSA-N 1 1 229.367 3.843 20 0 BHADMO C[C@@H](c1ccncc1)[N@H+]1CCC2(C1)CCCCC2 ZINC000607752697 342789114 /nfs/dbraw/zinc/78/91/14/342789114.db2.gz LHJYFUAAWVQYSR-AWEZNQCLSA-N 1 1 244.382 3.799 20 0 BHADMO C[C@H](c1ccncc1)[N@H+]1CCC2(C1)CCCCC2 ZINC000607752698 342789096 /nfs/dbraw/zinc/78/90/96/342789096.db2.gz LHJYFUAAWVQYSR-CQSZACIVSA-N 1 1 244.382 3.799 20 0 BHADMO Fc1ccccc1C[N@H+]1CCC2(C1)CCCCC2 ZINC000607752702 342789103 /nfs/dbraw/zinc/78/91/03/342789103.db2.gz MIOOGDCOINJBOT-UHFFFAOYSA-N 1 1 247.357 3.982 20 0 BHADMO Fc1cccc(C[N@H+]2CCC3(C2)CCCCC3)c1 ZINC000607752740 342789176 /nfs/dbraw/zinc/78/91/76/342789176.db2.gz YWVSUZYJYKGVIG-UHFFFAOYSA-N 1 1 247.357 3.982 20 0 BHADMO CC[C@H](c1ccc(F)cc1)[N@@H+]1C[C@@H]2[C@H](C1)C2(C)C ZINC000607753200 342788632 /nfs/dbraw/zinc/78/86/32/342788632.db2.gz IQDFSLYUXPGKGE-QLFBSQMISA-N 1 1 247.357 3.865 20 0 BHADMO CC[C@@H](c1ccc(F)cc1)[N@@H+]1C[C@@H]2[C@H](C1)C2(C)C ZINC000607753203 342788778 /nfs/dbraw/zinc/78/87/78/342788778.db2.gz IQDFSLYUXPGKGE-ZNMIVQPWSA-N 1 1 247.357 3.865 20 0 BHADMO CC(C)C[C@@H]1CCCCC[N@H+]1Cc1ccncc1 ZINC000607754092 342789913 /nfs/dbraw/zinc/78/99/13/342789913.db2.gz CHNAOCNCHNMONS-INIZCTEOSA-N 1 1 246.398 3.872 20 0 BHADMO CC(C)C[C@H]1CCCCC[N@H+]1Cc1ccncc1 ZINC000607754093 342789875 /nfs/dbraw/zinc/78/98/75/342789875.db2.gz CHNAOCNCHNMONS-MRXNPFEDSA-N 1 1 246.398 3.872 20 0 BHADMO COc1cccc(C[N@H+]2CCCC(C)(C)CC2)c1 ZINC000607755309 342790716 /nfs/dbraw/zinc/79/07/16/342790716.db2.gz ZNHYTPMMYDLYHG-UHFFFAOYSA-N 1 1 247.382 3.707 20 0 BHADMO CCC(CC)(CC)[NH2+]Cc1n[nH]c2ccccc21 ZINC000608060897 386737140 /nfs/dbraw/zinc/73/71/40/386737140.db2.gz FYSXBCMQTGSGKK-UHFFFAOYSA-N 1 1 245.370 3.621 20 0 BHADMO Cc1occc1CNc1cc[nH+]c2ccsc21 ZINC000608080422 352727609 /nfs/dbraw/zinc/72/76/09/352727609.db2.gz ZEIDZGHCPHTUMQ-UHFFFAOYSA-N 1 1 244.319 3.810 20 0 BHADMO CC(C)CCN(C)c1cc[nH+]c2ccsc21 ZINC000608080481 352728285 /nfs/dbraw/zinc/72/82/85/352728285.db2.gz FNQMJWOTAJWSIQ-UHFFFAOYSA-N 1 1 234.368 3.779 20 0 BHADMO CCO[C@@H]1CCC[N@H+]([C@H](C)c2cccc(C)c2)C1 ZINC000608373109 355382356 /nfs/dbraw/zinc/38/23/56/355382356.db2.gz YVMUVUOZNDJKGR-GDBMZVCRSA-N 1 1 247.382 3.557 20 0 BHADMO CCO[C@@H]1CCC[N@H+]([C@@H](C)c2cccc(C)c2)C1 ZINC000608373116 355382742 /nfs/dbraw/zinc/38/27/42/355382742.db2.gz YVMUVUOZNDJKGR-GOEBONIOSA-N 1 1 247.382 3.557 20 0 BHADMO CCO[C@H]1CCC[N@H+]([C@@H](C)c2cccc(C)c2)C1 ZINC000608373117 355382510 /nfs/dbraw/zinc/38/25/10/355382510.db2.gz YVMUVUOZNDJKGR-HOCLYGCPSA-N 1 1 247.382 3.557 20 0 BHADMO CCO[C@H]1CCC[N@H+]([C@H](C)c2cccc(C)c2)C1 ZINC000608373118 355382283 /nfs/dbraw/zinc/38/22/83/355382283.db2.gz YVMUVUOZNDJKGR-ZBFHGGJFSA-N 1 1 247.382 3.557 20 0 BHADMO CC[N@@H+](Cc1cccs1)[C@H](C)c1ccncc1 ZINC000608491442 355814852 /nfs/dbraw/zinc/81/48/52/355814852.db2.gz JYIUFUAJMKDQCX-GFCCVEGCSA-N 1 1 246.379 3.726 20 0 BHADMO CC[N@@H+](Cc1cccs1)[C@@H](C)c1ccncc1 ZINC000608491443 355814339 /nfs/dbraw/zinc/81/43/39/355814339.db2.gz JYIUFUAJMKDQCX-LBPRGKRZSA-N 1 1 246.379 3.726 20 0 BHADMO C[N@@H+](CCC1CC1)Cc1cccc(Cl)c1 ZINC000608492044 355809221 /nfs/dbraw/zinc/80/92/21/355809221.db2.gz MSHHZRQFNOLILP-UHFFFAOYSA-N 1 1 223.747 3.572 20 0 BHADMO CCC(C)(C)CC[N@@H+](CC(C)C)C1CC1 ZINC000608492237 355809217 /nfs/dbraw/zinc/80/92/17/355809217.db2.gz OTIGZPPZWPGAAE-UHFFFAOYSA-N 1 1 211.393 3.933 20 0 BHADMO C(C1CCC1)[N@@H+](C1CC1)C1CCCCC1 ZINC000608492550 355809332 /nfs/dbraw/zinc/80/93/32/355809332.db2.gz RPOAMMODOWVDKV-UHFFFAOYSA-N 1 1 207.361 3.584 20 0 BHADMO C(C[N@@H+](C1CC1)C1CCCCC1)C1CC1 ZINC000608492553 355809289 /nfs/dbraw/zinc/80/92/89/355809289.db2.gz SHTHUEUZGRPSBV-UHFFFAOYSA-N 1 1 207.361 3.584 20 0 BHADMO CC[N@@H+](Cc1cccc(N(C)C)c1)C1CCCC1 ZINC000608492572 355818183 /nfs/dbraw/zinc/81/81/83/355818183.db2.gz AOWQQUCSUZOSSX-UHFFFAOYSA-N 1 1 246.398 3.517 20 0 BHADMO CCC(C)(C)CC[N@@H+](CCOC)C1CCCC1 ZINC000608493140 355819530 /nfs/dbraw/zinc/81/95/30/355819530.db2.gz FFMKXVXJNIESAS-UHFFFAOYSA-N 1 1 241.419 3.704 20 0 BHADMO CCCC[N@@H+](Cc1cccc(N(C)C)c1)C1CC1 ZINC000608493322 355819851 /nfs/dbraw/zinc/81/98/51/355819851.db2.gz IJJPNVFTUYSZTG-UHFFFAOYSA-N 1 1 246.398 3.517 20 0 BHADMO CC(C)C[N@@H+](Cc1cccc(N(C)C)c1)C(C)C ZINC000608493462 355819361 /nfs/dbraw/zinc/81/93/61/355819361.db2.gz PGPIPIOZBYBNMZ-UHFFFAOYSA-N 1 1 248.414 3.619 20 0 BHADMO CCC[N@@H+](CCC1CC1)Cc1ccc(OC)cc1 ZINC000608493598 355819936 /nfs/dbraw/zinc/81/99/36/355819936.db2.gz HKDQJUWTXGIGGZ-UHFFFAOYSA-N 1 1 247.382 3.707 20 0 BHADMO CCC[N@@H+](CC(C)C)[C@H](C)c1ccncc1 ZINC000608493646 355819835 /nfs/dbraw/zinc/81/98/35/355819835.db2.gz VVNFDIGKVRQTTA-CYBMUJFWSA-N 1 1 220.360 3.511 20 0 BHADMO CCC[N@@H+](CC(C)C)[C@@H](C)c1ccncc1 ZINC000608493647 355819550 /nfs/dbraw/zinc/81/95/50/355819550.db2.gz VVNFDIGKVRQTTA-ZDUSSCGKSA-N 1 1 220.360 3.511 20 0 BHADMO CCC[N@H+](Cc1ccc(OC)cc1)CC1CCC1 ZINC000608493651 355819675 /nfs/dbraw/zinc/81/96/75/355819675.db2.gz WGIDRECSFXWPGV-UHFFFAOYSA-N 1 1 247.382 3.707 20 0 BHADMO CCC[N@H+](Cc1cccc(N(C)C)c1)CC(C)C ZINC000608493652 355819512 /nfs/dbraw/zinc/81/95/12/355819512.db2.gz WUMFBKRAGVUFTO-UHFFFAOYSA-N 1 1 248.414 3.621 20 0 BHADMO CCC[N@H+](Cc1ccccc1F)CC1CCC1 ZINC000608493774 355819664 /nfs/dbraw/zinc/81/96/64/355819664.db2.gz YBHMPIBROLDERG-UHFFFAOYSA-N 1 1 235.346 3.838 20 0 BHADMO COc1c(C)cc(C[N@@H+](C)CCC2CC2)cc1C ZINC000608494625 355817812 /nfs/dbraw/zinc/81/78/12/355817812.db2.gz DDUNBQLLZBELBJ-UHFFFAOYSA-N 1 1 247.382 3.544 20 0 BHADMO CC[N@@H+](CCC(C)(C)CC)Cc1ccoc1 ZINC000608494645 355817847 /nfs/dbraw/zinc/81/78/47/355817847.db2.gz GAFASBYPRIFGBS-UHFFFAOYSA-N 1 1 223.360 3.928 20 0 BHADMO CCC(C)(C)CC[N@H+]1CCC[C@@H]1C1CC1 ZINC000608495287 355821001 /nfs/dbraw/zinc/82/10/01/355821001.db2.gz FQKUBOMACJMDAY-CYBMUJFWSA-N 1 1 209.377 3.687 20 0 BHADMO CCC(C)(C)CC[N@H+]1CCC[C@H]1C1CC1 ZINC000608495291 355820784 /nfs/dbraw/zinc/82/07/84/355820784.db2.gz FQKUBOMACJMDAY-ZDUSSCGKSA-N 1 1 209.377 3.687 20 0 BHADMO CCC(C)(C)CC[N@H+]1CC[C@@H](c2ccco2)C1 ZINC000608497033 355823364 /nfs/dbraw/zinc/82/33/64/355823364.db2.gz SYLZSFLYVKYONV-CYBMUJFWSA-N 1 1 235.371 3.895 20 0 BHADMO CCC(C)(C)CC[N@H+]1CC[C@H](c2ccco2)C1 ZINC000608497034 355823442 /nfs/dbraw/zinc/82/34/42/355823442.db2.gz SYLZSFLYVKYONV-ZDUSSCGKSA-N 1 1 235.371 3.895 20 0 BHADMO C[N@@H+](CCC1CC1)Cc1ccc(F)cc1Cl ZINC000608497117 355823460 /nfs/dbraw/zinc/82/34/60/355823460.db2.gz GGCRIBBIWRDXCK-UHFFFAOYSA-N 1 1 241.737 3.711 20 0 BHADMO C[C@H]1CCCCC[N@H+]1Cc1cccc(N(C)C)c1 ZINC000608497430 355824259 /nfs/dbraw/zinc/82/42/59/355824259.db2.gz QHFFAOFDDBXYHB-AWEZNQCLSA-N 1 1 246.398 3.517 20 0 BHADMO C[C@@H]1CCCCC[N@H+]1Cc1cccc(N(C)C)c1 ZINC000608497431 355824229 /nfs/dbraw/zinc/82/42/29/355824229.db2.gz QHFFAOFDDBXYHB-CQSZACIVSA-N 1 1 246.398 3.517 20 0 BHADMO CC[C@H]1c2ccccc2CC[N@@H+]1CC1CCC1 ZINC000608497445 355824545 /nfs/dbraw/zinc/82/45/45/355824545.db2.gz WAPNBPSJABKLLY-INIZCTEOSA-N 1 1 229.367 3.796 20 0 BHADMO CC[C@@H]1c2ccccc2CC[N@@H+]1CC1CCC1 ZINC000608497446 355824468 /nfs/dbraw/zinc/82/44/68/355824468.db2.gz WAPNBPSJABKLLY-MRXNPFEDSA-N 1 1 229.367 3.796 20 0 BHADMO CC[C@H]1c2ccccc2CC[N@@H+]1CCC1CC1 ZINC000608497451 355824178 /nfs/dbraw/zinc/82/41/78/355824178.db2.gz XNEIXDCCOSTOJM-INIZCTEOSA-N 1 1 229.367 3.796 20 0 BHADMO CC[C@@H]1c2ccccc2CC[N@@H+]1CCC1CC1 ZINC000608497452 355824268 /nfs/dbraw/zinc/82/42/68/355824268.db2.gz XNEIXDCCOSTOJM-MRXNPFEDSA-N 1 1 229.367 3.796 20 0 BHADMO C[C@@H]1c2ccc(F)cc2CC[N@@H+]1CC1CCC1 ZINC000608497458 355824311 /nfs/dbraw/zinc/82/43/11/355824311.db2.gz COSGXVFGJRPFJE-LLVKDONJSA-N 1 1 233.330 3.545 20 0 BHADMO C[C@H]1c2ccc(F)cc2CC[N@@H+]1CC1CCC1 ZINC000608497459 355824152 /nfs/dbraw/zinc/82/41/52/355824152.db2.gz COSGXVFGJRPFJE-NSHDSACASA-N 1 1 233.330 3.545 20 0 BHADMO c1ccc([C@@H]2C[N@@H+](CC3CCC3)CCS2)cc1 ZINC000608497539 355824204 /nfs/dbraw/zinc/82/42/04/355824204.db2.gz DTQCLROXNFHLIX-HNNXBMFYSA-N 1 1 247.407 3.577 20 0 BHADMO c1ccc([C@H]2C[N@@H+](CC3CCC3)CCS2)cc1 ZINC000608497550 355824565 /nfs/dbraw/zinc/82/45/65/355824565.db2.gz DTQCLROXNFHLIX-OAHLLOKOSA-N 1 1 247.407 3.577 20 0 BHADMO C[C@@H]1c2ccc(F)cc2CC[N@@H+]1CCC1CC1 ZINC000608497553 355824200 /nfs/dbraw/zinc/82/42/00/355824200.db2.gz USDRVXRLIIFKJH-LLVKDONJSA-N 1 1 233.330 3.545 20 0 BHADMO C[C@H]1c2ccc(F)cc2CC[N@@H+]1CCC1CC1 ZINC000608497554 355824188 /nfs/dbraw/zinc/82/41/88/355824188.db2.gz USDRVXRLIIFKJH-NSHDSACASA-N 1 1 233.330 3.545 20 0 BHADMO CCC(C)(C)CC[N@@H+](C)CCCOC(C)C ZINC000608497681 355824272 /nfs/dbraw/zinc/82/42/72/355824272.db2.gz UUAQFGIKXQFSLM-UHFFFAOYSA-N 1 1 229.408 3.560 20 0 BHADMO c1ccc([C@@H]2C[N@@H+](CCC3CC3)CCS2)cc1 ZINC000608497777 355824194 /nfs/dbraw/zinc/82/41/94/355824194.db2.gz XMHBTXUOVMCXNR-HNNXBMFYSA-N 1 1 247.407 3.577 20 0 BHADMO c1ccc([C@H]2C[N@@H+](CCC3CC3)CCS2)cc1 ZINC000608497778 355824297 /nfs/dbraw/zinc/82/42/97/355824297.db2.gz XMHBTXUOVMCXNR-OAHLLOKOSA-N 1 1 247.407 3.577 20 0 BHADMO C[C@@H]1CCC[C@H](C)[N@@H+]1Cc1cccc(N(C)C)c1 ZINC000608498124 355825087 /nfs/dbraw/zinc/82/50/87/355825087.db2.gz OOXIXAJBKKBJEP-OKILXGFUSA-N 1 1 246.398 3.516 20 0 BHADMO C[C@@H]1C[C@H]2CCCC[C@H]2[N@H+]1CCC(F)(F)F ZINC000608500141 387044576 /nfs/dbraw/zinc/04/45/76/387044576.db2.gz QJPDAIGCDGYKDO-GMTAPVOTSA-N 1 1 235.293 3.592 20 0 BHADMO C[C@@H]1C[C@H]2CCCC[C@@H]2[N@H+]1CCC(F)(F)F ZINC000608500147 387044531 /nfs/dbraw/zinc/04/45/31/387044531.db2.gz QJPDAIGCDGYKDO-MXWKQRLJSA-N 1 1 235.293 3.592 20 0 BHADMO C[C@@H]1C[C@@H]2CCCC[C@H]2[N@H+]1CCC(F)(F)F ZINC000608500148 387044862 /nfs/dbraw/zinc/04/48/62/387044862.db2.gz QJPDAIGCDGYKDO-OUAUKWLOSA-N 1 1 235.293 3.592 20 0 BHADMO C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@H+]1CCC(F)(F)F ZINC000608500149 355828601 /nfs/dbraw/zinc/82/86/01/355828601.db2.gz QJPDAIGCDGYKDO-VWYCJHECSA-N 1 1 235.293 3.592 20 0 BHADMO C[N@@H+](Cc1cc(Cl)ccc1Cl)C1CCC1 ZINC000608500618 355826774 /nfs/dbraw/zinc/82/67/74/355826774.db2.gz HXKGDHCXARDSBY-UHFFFAOYSA-N 1 1 244.165 3.978 20 0 BHADMO CCC[N@@H+](CC)CC(C)(C)c1ccccc1 ZINC000608501274 355829091 /nfs/dbraw/zinc/82/90/91/355829091.db2.gz PSHDQBMKIUCFAZ-UHFFFAOYSA-N 1 1 219.372 3.696 20 0 BHADMO Cc1ccc(C)c(C[N@H+]2C[C@@H](C)S[C@@H](C)C2)c1 ZINC000608502093 355829109 /nfs/dbraw/zinc/82/91/09/355829109.db2.gz OKWXHQOZTWNYBK-OKILXGFUSA-N 1 1 249.423 3.629 20 0 BHADMO CC(C)C[N@H+]1C[C@H](C)C[C@H]1c1ccccc1F ZINC000608502343 355830039 /nfs/dbraw/zinc/83/00/39/355830039.db2.gz CFUPMLKFCZAXSW-DOMZBBRYSA-N 1 1 235.346 3.865 20 0 BHADMO CC(C)C[N@H+]1C[C@H](C)C[C@@H]1c1ccccc1F ZINC000608502348 355829826 /nfs/dbraw/zinc/82/98/26/355829826.db2.gz CFUPMLKFCZAXSW-IUODEOHRSA-N 1 1 235.346 3.865 20 0 BHADMO CC(C)C[N@H+]1C[C@@H](C)C[C@@H]1c1ccccc1F ZINC000608502350 355830341 /nfs/dbraw/zinc/83/03/41/355830341.db2.gz CFUPMLKFCZAXSW-SWLSCSKDSA-N 1 1 235.346 3.865 20 0 BHADMO CC(C)C[N@H+]1C[C@@H](C)C[C@H]1c1ccccc1F ZINC000608502351 355830421 /nfs/dbraw/zinc/83/04/21/355830421.db2.gz CFUPMLKFCZAXSW-WFASDCNBSA-N 1 1 235.346 3.865 20 0 BHADMO C[C@H](c1ccccc1)[N@@H+]1C[C@@H](C)S[C@@H](C)C1 ZINC000608502753 355830251 /nfs/dbraw/zinc/83/02/51/355830251.db2.gz WGBUAXIAVSDDFB-FRRDWIJNSA-N 1 1 235.396 3.573 20 0 BHADMO CC(C)C[N@H+]1CC[C@H](CSc2ccccc2)C1 ZINC000608506101 387044503 /nfs/dbraw/zinc/04/45/03/387044503.db2.gz ORPYPDNJWCTCLL-AWEZNQCLSA-N 1 1 249.423 3.757 20 0 BHADMO CC(C)C[N@H+]1CC[C@@H](CSc2ccccc2)C1 ZINC000608506102 387044836 /nfs/dbraw/zinc/04/48/36/387044836.db2.gz ORPYPDNJWCTCLL-CQSZACIVSA-N 1 1 249.423 3.757 20 0 BHADMO CC[C@@]1(C)CCC[N@H+]([C@H](C)c2ccncc2)C1 ZINC000608507259 355831978 /nfs/dbraw/zinc/83/19/78/355831978.db2.gz FJYYQNSSHMBWIY-HIFRSBDPSA-N 1 1 232.371 3.655 20 0 BHADMO CC[C@]1(C)CCC[N@H+]([C@H](C)c2ccncc2)C1 ZINC000608507261 355831593 /nfs/dbraw/zinc/83/15/93/355831593.db2.gz FJYYQNSSHMBWIY-UKRRQHHQSA-N 1 1 232.371 3.655 20 0 BHADMO CC(C)Oc1ccccc1C[N@H+]1CCC(C)(C)C1 ZINC000608508631 355830969 /nfs/dbraw/zinc/83/09/69/355830969.db2.gz AFQFJXPSSNKFFD-UHFFFAOYSA-N 1 1 247.382 3.706 20 0 BHADMO CC[C@H]1C[N@@H+](C/C=C\c2ccccc2)CCS1 ZINC000608510583 355833394 /nfs/dbraw/zinc/83/33/94/355833394.db2.gz JKFJMEMUQLZFBW-AJHXJQRKSA-N 1 1 247.407 3.527 20 0 BHADMO CC[C@H]1C[N@@H+](C/C=C/c2ccccc2)CCS1 ZINC000608510584 355833340 /nfs/dbraw/zinc/83/33/40/355833340.db2.gz JKFJMEMUQLZFBW-PPYMECGQSA-N 1 1 247.407 3.527 20 0 BHADMO CC[C@@H]1C[N@@H+](C/C=C/c2ccccc2)CCS1 ZINC000608510585 355833384 /nfs/dbraw/zinc/83/33/84/355833384.db2.gz JKFJMEMUQLZFBW-RZIFZGNASA-N 1 1 247.407 3.527 20 0 BHADMO CC[C@@H]1C[N@@H+](C/C=C\c2ccccc2)CCS1 ZINC000608510586 355833607 /nfs/dbraw/zinc/83/36/07/355833607.db2.gz JKFJMEMUQLZFBW-WUKHSURWSA-N 1 1 247.407 3.527 20 0 BHADMO COc1ccc(C)cc1C[N@H+]1C[C@@H](C)CC[C@@H]1C ZINC000608511127 355831495 /nfs/dbraw/zinc/83/14/95/355831495.db2.gz QHJBIZPOCLQSPL-KBPBESRZSA-N 1 1 247.382 3.624 20 0 BHADMO COc1ccc(C)cc1C[N@H+]1C[C@H](C)CC[C@@H]1C ZINC000608511128 355831516 /nfs/dbraw/zinc/83/15/16/355831516.db2.gz QHJBIZPOCLQSPL-KGLIPLIRSA-N 1 1 247.382 3.624 20 0 BHADMO COc1ccc(C)cc1C[N@H+]1C[C@@H](C)CC[C@H]1C ZINC000608511129 355831864 /nfs/dbraw/zinc/83/18/64/355831864.db2.gz QHJBIZPOCLQSPL-UONOGXRCSA-N 1 1 247.382 3.624 20 0 BHADMO COc1ccc(C)cc1C[N@H+]1C[C@H](C)CC[C@H]1C ZINC000608511130 355831456 /nfs/dbraw/zinc/83/14/56/355831456.db2.gz QHJBIZPOCLQSPL-ZIAGYGMSSA-N 1 1 247.382 3.624 20 0 BHADMO CCC(C)(C)CC[N@H+]1CCC[C@H]1c1cccn1C ZINC000608559888 355858529 /nfs/dbraw/zinc/85/85/29/355858529.db2.gz NFURBXOFJYGVCH-HNNXBMFYSA-N 1 1 248.414 3.988 20 0 BHADMO CCC(C)(C)CC[N@H+]1CCC[C@@H]1c1cccn1C ZINC000608559889 355858210 /nfs/dbraw/zinc/85/82/10/355858210.db2.gz NFURBXOFJYGVCH-OAHLLOKOSA-N 1 1 248.414 3.988 20 0 BHADMO C[N@@H+](CCC1CCCCC1)C1CCCC1 ZINC000608559960 355858227 /nfs/dbraw/zinc/85/82/27/355858227.db2.gz DULIRCALZWVYLD-UHFFFAOYSA-N 1 1 209.377 3.831 20 0 BHADMO CCC(C)(C)CC[N@@H+](CC1CC1)C(C)C ZINC000608560383 355858497 /nfs/dbraw/zinc/85/84/97/355858497.db2.gz GPHNSHHWCIIPNA-UHFFFAOYSA-N 1 1 211.393 3.933 20 0 BHADMO CC[N@@H+](CCC1CC1)[C@H]1CCc2ccccc21 ZINC000608561091 355859236 /nfs/dbraw/zinc/85/92/36/355859236.db2.gz IMLMAJNIDLDATE-INIZCTEOSA-N 1 1 229.367 3.796 20 0 BHADMO CC[N@@H+](CCC1CC1)[C@@H]1CCc2ccccc21 ZINC000608561095 355858921 /nfs/dbraw/zinc/85/89/21/355858921.db2.gz IMLMAJNIDLDATE-MRXNPFEDSA-N 1 1 229.367 3.796 20 0 BHADMO CC[N@@H+](CC1CCC1)[C@H]1CCc2ccccc21 ZINC000608561103 355859068 /nfs/dbraw/zinc/85/90/68/355859068.db2.gz SAKFGKYEKSLVKW-INIZCTEOSA-N 1 1 229.367 3.796 20 0 BHADMO CC[N@@H+](CC1CCC1)[C@@H]1CCc2ccccc21 ZINC000608561104 355859275 /nfs/dbraw/zinc/85/92/75/355859275.db2.gz SAKFGKYEKSLVKW-MRXNPFEDSA-N 1 1 229.367 3.796 20 0 BHADMO CCC[N@@H+](CCC1CCCCC1)CC(F)F ZINC000608561669 355859181 /nfs/dbraw/zinc/85/91/81/355859181.db2.gz GELVJTMICITQMD-UHFFFAOYSA-N 1 1 233.346 3.934 20 0 BHADMO CCC[N@H+](CCC1CCCCC1)CC(F)F ZINC000608561669 355859177 /nfs/dbraw/zinc/85/91/77/355859177.db2.gz GELVJTMICITQMD-UHFFFAOYSA-N 1 1 233.346 3.934 20 0 BHADMO C[C@@H]([N@@H+](C)Cc1ccccc1N(C)C)C(C)(C)C ZINC000608562840 355860205 /nfs/dbraw/zinc/86/02/05/355860205.db2.gz PJZJFOAUQCUPDY-CYBMUJFWSA-N 1 1 248.414 3.619 20 0 BHADMO C[C@H]([N@@H+](C)Cc1ccccc1N(C)C)C(C)(C)C ZINC000608562841 355860253 /nfs/dbraw/zinc/86/02/53/355860253.db2.gz PJZJFOAUQCUPDY-ZDUSSCGKSA-N 1 1 248.414 3.619 20 0 BHADMO C[C@@H]([N@@H+](C)Cc1cccc(N(C)C)c1)C(C)(C)C ZINC000608562842 355860163 /nfs/dbraw/zinc/86/01/63/355860163.db2.gz PVMVKALODXCOPM-CYBMUJFWSA-N 1 1 248.414 3.619 20 0 BHADMO C[C@H]([N@@H+](C)Cc1cccc(N(C)C)c1)C(C)(C)C ZINC000608562843 355860181 /nfs/dbraw/zinc/86/01/81/355860181.db2.gz PVMVKALODXCOPM-ZDUSSCGKSA-N 1 1 248.414 3.619 20 0 BHADMO CC[N@@H+](Cc1cccc(N(C)C)c1)[C@@H](C)C(C)C ZINC000608563663 355860480 /nfs/dbraw/zinc/86/04/80/355860480.db2.gz VKJZLOAKKKZUSX-AWEZNQCLSA-N 1 1 248.414 3.619 20 0 BHADMO CC[N@@H+](Cc1cccc(N(C)C)c1)[C@H](C)C(C)C ZINC000608563664 355860732 /nfs/dbraw/zinc/86/07/32/355860732.db2.gz VKJZLOAKKKZUSX-CQSZACIVSA-N 1 1 248.414 3.619 20 0 BHADMO Cc1cccc([C@H](C)[N@H+]2CCCOC(C)(C)C2)c1 ZINC000608564257 355860739 /nfs/dbraw/zinc/86/07/39/355860739.db2.gz GUMFCAGALRFZPJ-AWEZNQCLSA-N 1 1 247.382 3.557 20 0 BHADMO Cc1cccc([C@@H](C)[N@H+]2CCCOC(C)(C)C2)c1 ZINC000608564259 355861082 /nfs/dbraw/zinc/86/10/82/355861082.db2.gz GUMFCAGALRFZPJ-CQSZACIVSA-N 1 1 247.382 3.557 20 0 BHADMO CCC(C)(C)CC[N@@H+](C(C)C)C1CCOCC1 ZINC000608564416 355860594 /nfs/dbraw/zinc/86/05/94/355860594.db2.gz ALQHBWCAKLELPE-UHFFFAOYSA-N 1 1 241.419 3.702 20 0 BHADMO Cc1ccc(CC[N@H+]2CCC[C@@H]3CCC[C@H]32)cc1 ZINC000608564649 355860862 /nfs/dbraw/zinc/86/08/62/355860862.db2.gz RQRWFCIXNGUWBL-DLBZAZTESA-N 1 1 243.394 3.802 20 0 BHADMO Cc1ccc(CC[N@H+]2CCC[C@H]3CCC[C@H]32)cc1 ZINC000608564650 355860827 /nfs/dbraw/zinc/86/08/27/355860827.db2.gz RQRWFCIXNGUWBL-IAGOWNOFSA-N 1 1 243.394 3.802 20 0 BHADMO Cc1ccc(CC[N@H+]2CCC[C@@H]3CCC[C@@H]32)cc1 ZINC000608564651 355860916 /nfs/dbraw/zinc/86/09/16/355860916.db2.gz RQRWFCIXNGUWBL-IRXDYDNUSA-N 1 1 243.394 3.802 20 0 BHADMO Cc1ccc(CC[N@H+]2CCC[C@H]3CCC[C@@H]32)cc1 ZINC000608564652 355861090 /nfs/dbraw/zinc/86/10/90/355861090.db2.gz RQRWFCIXNGUWBL-SJORKVTESA-N 1 1 243.394 3.802 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CCSCC[N@H+]1CCC[C@@H]1c1ccc(C)cc1 ZINC000609851336 356487823 /nfs/dbraw/zinc/48/78/23/356487823.db2.gz QCBAQVQSDLAQFS-OAHLLOKOSA-N 1 1 249.423 3.885 20 0 BHADMO CSCCC[N@H+]1CCC[C@H]1c1ccc(C)cc1 ZINC000610211512 357277772 /nfs/dbraw/zinc/27/77/72/357277772.db2.gz CHRIHIYBJPQJKI-HNNXBMFYSA-N 1 1 249.423 3.885 20 0 BHADMO CSCCC[N@H+]1CCC[C@@H]1c1ccc(C)cc1 ZINC000610211513 357277647 /nfs/dbraw/zinc/27/76/47/357277647.db2.gz CHRIHIYBJPQJKI-OAHLLOKOSA-N 1 1 249.423 3.885 20 0 BHADMO CCSCC[N@@H+](C1CC1)C1CCCCC1 ZINC000610212599 357281806 /nfs/dbraw/zinc/28/18/06/357281806.db2.gz KOURZCYEGHFJNA-UHFFFAOYSA-N 1 1 227.417 3.537 20 0 BHADMO CCSCC[N@H+]1CCC[C@H]1C1CCCCC1 ZINC000610212684 357281422 /nfs/dbraw/zinc/28/14/22/357281422.db2.gz SREBKBDYSDQBHA-AWEZNQCLSA-N 1 1 241.444 3.784 20 0 BHADMO CCSCC[N@H+]1CCC[C@@H]1C1CCCCC1 ZINC000610212685 357281735 /nfs/dbraw/zinc/28/17/35/357281735.db2.gz SREBKBDYSDQBHA-CQSZACIVSA-N 1 1 241.444 3.784 20 0 BHADMO CCSCC[N@@H+](CC1CCCCC1)C1CC1 ZINC000610212715 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249.423 3.713 20 0 BHADMO CS[C@@H]1CCCC[N@@H+](Cc2cccc(C)c2)C1 ZINC000610990547 358423217 /nfs/dbraw/zinc/42/32/17/358423217.db2.gz IVLDWOCZDKXWJC-OAHLLOKOSA-N 1 1 249.423 3.713 20 0 BHADMO CC(C)CSCCC[N@H+]1CCC[C@H]1C1CC1 ZINC000611032748 358488274 /nfs/dbraw/zinc/48/82/74/358488274.db2.gz GQXYVZIRJXCAGV-AWEZNQCLSA-N 1 1 241.444 3.640 20 0 BHADMO CC(C)CSCCC[N@H+]1CCC[C@@H]1C1CC1 ZINC000611032749 358488573 /nfs/dbraw/zinc/48/85/73/358488573.db2.gz GQXYVZIRJXCAGV-CQSZACIVSA-N 1 1 241.444 3.640 20 0 BHADMO c1ccc(CSCCC[N@@H+]2CC=CCC2)cc1 ZINC000611517588 359387445 /nfs/dbraw/zinc/38/74/45/359387445.db2.gz UGGVTYPOMXHZFE-UHFFFAOYSA-N 1 1 247.407 3.572 20 0 BHADMO C[C@H]1CCCC[N@H+]1C/C=C\c1ccccc1 ZINC000612867228 360130107 /nfs/dbraw/zinc/13/01/07/360130107.db2.gz RNGWPMMLFFDXJJ-JOHMGYAOSA-N 1 1 215.340 3.574 20 0 BHADMO C[C@@H]1CCCC[N@H+]1C/C=C\c1ccccc1 ZINC000612867229 360130447 /nfs/dbraw/zinc/13/04/47/360130447.db2.gz RNGWPMMLFFDXJJ-SMJHDNPOSA-N 1 1 215.340 3.574 20 0 BHADMO 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BHADMO C[C@@H](c1c(F)cccc1F)[N@H+]1CCC[C@H](C)C1 ZINC000613315608 363099504 /nfs/dbraw/zinc/09/95/04/363099504.db2.gz QHVDIODAIQBYJS-QWRGUYRKSA-N 1 1 239.309 3.758 20 0 BHADMO C[C@H](c1c(F)cccc1F)[N@H+]1CCC[C@H](C)C1 ZINC000613315609 363099561 /nfs/dbraw/zinc/09/95/61/363099561.db2.gz QHVDIODAIQBYJS-WDEREUQCSA-N 1 1 239.309 3.758 20 0 BHADMO C[C@H](c1ccccc1F)[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC000613319795 363105364 /nfs/dbraw/zinc/10/53/64/363105364.db2.gz PCWIIKRLANOQDF-FRRDWIJNSA-N 1 1 235.346 3.865 20 0 BHADMO C[C@@H](c1ccccc1F)[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC000613319800 363105346 /nfs/dbraw/zinc/10/53/46/363105346.db2.gz PCWIIKRLANOQDF-XQQFMLRXSA-N 1 1 235.346 3.865 20 0 BHADMO CC(C)Oc1cccc(C[N@H+]2CCCC[C@@H]2C)c1 ZINC000613333452 363112935 /nfs/dbraw/zinc/11/29/35/363112935.db2.gz AQUOEDDUKHXJNC-AWEZNQCLSA-N 1 1 247.382 3.848 20 0 BHADMO CC(C)Oc1cccc(C[N@H+]2CCCC[C@H]2C)c1 ZINC000613333455 363113463 /nfs/dbraw/zinc/11/34/63/363113463.db2.gz AQUOEDDUKHXJNC-CQSZACIVSA-N 1 1 247.382 3.848 20 0 BHADMO CCC[N@@H+](C/C=C/c1ccccc1)CC1CC1 ZINC000613342956 363125989 /nfs/dbraw/zinc/12/59/89/363125989.db2.gz NETOSRKNPCYQGD-RMKNXTFCSA-N 1 1 229.367 3.822 20 0 BHADMO CCC[N@@H+](C/C=C\c1ccccc1)CC1CC1 ZINC000613342957 363126292 /nfs/dbraw/zinc/12/62/92/363126292.db2.gz NETOSRKNPCYQGD-TWGQIWQCSA-N 1 1 229.367 3.822 20 0 BHADMO CC(C)Oc1cccc(C[N@@H+](C)[C@@H](C)C(C)C)c1 ZINC000613391072 363163065 /nfs/dbraw/zinc/16/30/65/363163065.db2.gz HKXBKJHWOVIBEP-AWEZNQCLSA-N 1 1 249.398 3.950 20 0 BHADMO CC(C)Oc1cccc(C[N@@H+](C)[C@H](C)C(C)C)c1 ZINC000613391073 363162663 /nfs/dbraw/zinc/16/26/63/363162663.db2.gz HKXBKJHWOVIBEP-CQSZACIVSA-N 1 1 249.398 3.950 20 0 BHADMO CC[C@@H]1CCC[N@@H+](C/C=C\c2ccccc2)C1 ZINC000613391116 363163207 /nfs/dbraw/zinc/16/32/07/363163207.db2.gz MPLZPEZGZTZDMT-OCOPJHETSA-N 1 1 229.367 3.822 20 0 BHADMO CC[C@H]1CCC[N@@H+](C/C=C\c2ccccc2)C1 ZINC000613391117 363162739 /nfs/dbraw/zinc/16/27/39/363162739.db2.gz MPLZPEZGZTZDMT-QARUFBMTSA-N 1 1 229.367 3.822 20 0 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ZINC000613502595 363465242 /nfs/dbraw/zinc/46/52/42/363465242.db2.gz OUPFIKWFQFENSY-UHFFFAOYSA-N 1 1 221.388 3.997 20 0 BHADMO CC(C)CC[N@@H+](C)CCO[C@H]1CCCC[C@H]1C ZINC000613502633 363465626 /nfs/dbraw/zinc/46/56/26/363465626.db2.gz VIFPRGOMIISZRL-CABCVRRESA-N 1 1 241.419 3.560 20 0 BHADMO CC(C)CC[N@@H+](C)CCO[C@H]1CCCC[C@@H]1C ZINC000613502635 363465314 /nfs/dbraw/zinc/46/53/14/363465314.db2.gz VIFPRGOMIISZRL-GJZGRUSLSA-N 1 1 241.419 3.560 20 0 BHADMO CC(C)CC[N@@H+](C)CCO[C@@H]1CCCC[C@H]1C ZINC000613502637 363465449 /nfs/dbraw/zinc/46/54/49/363465449.db2.gz VIFPRGOMIISZRL-HUUCEWRRSA-N 1 1 241.419 3.560 20 0 BHADMO CC(C)CC[N@@H+](C)CCO[C@@H]1CCCC[C@@H]1C ZINC000613502638 363465735 /nfs/dbraw/zinc/46/57/35/363465735.db2.gz VIFPRGOMIISZRL-LSDHHAIUSA-N 1 1 241.419 3.560 20 0 BHADMO CC(C)CC[N@@H+](C)Cc1cccc(OC(C)C)c1 ZINC000613502767 363466059 /nfs/dbraw/zinc/46/60/59/363466059.db2.gz ZSILAYXRUFHAQT-UHFFFAOYSA-N 1 1 249.398 3.952 20 0 BHADMO Cc1cccc(C[N@@H+](C)CC2CCCC2)c1 ZINC000613506977 363467981 /nfs/dbraw/zinc/46/79/81/363467981.db2.gz WLBWYWGEXUGKCS-UHFFFAOYSA-N 1 1 217.356 3.617 20 0 BHADMO CC(C)=CC[N@H+]1CCC[C@H]1c1cccc(F)c1 ZINC000613560569 363485774 /nfs/dbraw/zinc/48/57/74/363485774.db2.gz FVKXHBVPFQSTPW-HNNXBMFYSA-N 1 1 233.330 3.929 20 0 BHADMO CC(C)=CC[N@H+]1CCC[C@@H]1c1cccc(F)c1 ZINC000613560577 363485761 /nfs/dbraw/zinc/48/57/61/363485761.db2.gz FVKXHBVPFQSTPW-OAHLLOKOSA-N 1 1 233.330 3.929 20 0 BHADMO Cc1ccc2c(C)cc(N(C)CC3CC3)[nH+]c2c1 ZINC000613565367 363494379 /nfs/dbraw/zinc/49/43/79/363494379.db2.gz MHTXDKLWYCWPBX-UHFFFAOYSA-N 1 1 240.350 3.698 20 0 BHADMO Cc1ccccc1OCCC[N@H+](C)CCC(C)C ZINC000613565660 363495676 /nfs/dbraw/zinc/49/56/76/363495676.db2.gz SCGMLOYUUJSYPS-UHFFFAOYSA-N 1 1 249.398 3.742 20 0 BHADMO CC(C)=CC[N@@H+](C)CCCOc1ccccc1C ZINC000613565722 363496577 /nfs/dbraw/zinc/49/65/77/363496577.db2.gz UZCKBDGLGHWFCS-UHFFFAOYSA-N 1 1 247.382 3.662 20 0 BHADMO CC[N@@H+](Cc1cccc(OC(C)C)c1)C(C)C ZINC000613570127 363511649 /nfs/dbraw/zinc/51/16/49/363511649.db2.gz CTLGKCCVUGOJQT-UHFFFAOYSA-N 1 1 235.371 3.704 20 0 BHADMO CC[N@@H+](CCCOc1cc(C)ccc1C)C(C)C ZINC000613570142 363512122 /nfs/dbraw/zinc/51/21/22/363512122.db2.gz FRQKAJAJGFGTPI-UHFFFAOYSA-N 1 1 249.398 3.803 20 0 BHADMO CC[N@@H+](CCCOc1ccc(C)c(C)c1)C(C)C ZINC000613570170 363512307 /nfs/dbraw/zinc/51/23/07/363512307.db2.gz JMLUCWZBZIILAK-UHFFFAOYSA-N 1 1 249.398 3.803 20 0 BHADMO CC[N@@H+](Cc1cc(C)cc(C)c1)C(C)C ZINC000613570191 363511020 /nfs/dbraw/zinc/51/10/20/363511020.db2.gz PHJGAEUZDWYJOP-UHFFFAOYSA-N 1 1 205.345 3.534 20 0 BHADMO CC[N@@H+](CCSc1ccc(F)cc1)C(C)C ZINC000613570224 363510754 /nfs/dbraw/zinc/51/07/54/363510754.db2.gz YQDZLYGNHNWNFE-UHFFFAOYSA-N 1 1 241.375 3.648 20 0 BHADMO C[C@H]([N@@H+](C)Cc1cc(F)ccc1F)C(C)(C)C ZINC000613599248 363531141 /nfs/dbraw/zinc/53/11/41/363531141.db2.gz MOUNXLXRMADXNN-JTQLQIEISA-N 1 1 241.325 3.831 20 0 BHADMO C[C@@H]([N@@H+](C)Cc1cc(F)ccc1F)C(C)(C)C ZINC000613599251 363530516 /nfs/dbraw/zinc/53/05/16/363530516.db2.gz MOUNXLXRMADXNN-SNVBAGLBSA-N 1 1 241.325 3.831 20 0 BHADMO CCC[N@H+]1CCC[C@H](c2cc3ccccc3[nH]2)C1 ZINC000613733021 363628188 /nfs/dbraw/zinc/62/81/88/363628188.db2.gz JWWSVVXCIPJUIJ-AWEZNQCLSA-N 1 1 242.366 3.757 20 0 BHADMO CCC[N@H+]1CCC[C@@H](c2cc3ccccc3[nH]2)C1 ZINC000613733049 363628176 /nfs/dbraw/zinc/62/81/76/363628176.db2.gz JWWSVVXCIPJUIJ-CQSZACIVSA-N 1 1 242.366 3.757 20 0 BHADMO Cc1[nH+]ccn1CCSCCCC(C)(C)C ZINC000614804973 363981629 /nfs/dbraw/zinc/98/16/29/363981629.db2.gz KNDJPGJDACOYMR-UHFFFAOYSA-N 1 1 240.416 3.751 20 0 BHADMO C[C@@H](CCc1ccccc1)[N@H+]1CCC[C@@H](C)C1 ZINC000615084901 364469478 /nfs/dbraw/zinc/46/94/78/364469478.db2.gz KCXCJUFLUSXFNF-CABCVRRESA-N 1 1 231.383 3.740 20 0 BHADMO C[C@@H](CCc1ccccc1)[N@H+]1CCC[C@H](C)C1 ZINC000615084902 364469544 /nfs/dbraw/zinc/46/95/44/364469544.db2.gz KCXCJUFLUSXFNF-GJZGRUSLSA-N 1 1 231.383 3.740 20 0 BHADMO C[C@H](CCc1ccccc1)[N@H+]1CCC[C@@H](C)C1 ZINC000615084903 364469325 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367903850 /nfs/dbraw/zinc/90/38/50/367903850.db2.gz QDIMBJNVPXXZJR-OAHLLOKOSA-N 1 1 249.398 3.742 20 0 BHADMO CC(C)CCOCC[N@@H+](C)C1CCC(C)CC1 ZINC000615454084 367903242 /nfs/dbraw/zinc/90/32/42/367903242.db2.gz RPAMEBPMXBWWOI-UHFFFAOYSA-N 1 1 241.419 3.560 20 0 BHADMO C[C@H](c1cccc(F)c1)[N@H+]1CCC[C@H](C)C1 ZINC000615454343 367905047 /nfs/dbraw/zinc/90/50/47/367905047.db2.gz QDBZCBNBJCWTBW-NWDGAFQWSA-N 1 1 221.319 3.619 20 0 BHADMO C[C@H](c1cccc(F)c1)[N@H+]1CCC[C@@H](C)C1 ZINC000615454344 367905457 /nfs/dbraw/zinc/90/54/57/367905457.db2.gz QDBZCBNBJCWTBW-VXGBXAGGSA-N 1 1 221.319 3.619 20 0 BHADMO CC(C)CCOCC[N@@H+](CCC(C)C)C1CC1 ZINC000615455859 367911438 /nfs/dbraw/zinc/91/14/38/367911438.db2.gz BDJJBRXJJPOSHB-UHFFFAOYSA-N 1 1 241.419 3.560 20 0 BHADMO CC[N@@H+](CCOCCC(C)C)C1CCCCC1 ZINC000615455926 367910682 /nfs/dbraw/zinc/91/06/82/367910682.db2.gz SNOCJVQJBUVMAB-UHFFFAOYSA-N 1 1 241.419 3.704 20 0 BHADMO CCCCOCC[N@@H+](C1CC1)C1CCCCC1 ZINC000615455935 367911066 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367963103 /nfs/dbraw/zinc/96/31/03/367963103.db2.gz QSVBAHWFLHOFAG-HNNXBMFYSA-N 1 1 249.398 3.721 20 0 BHADMO Cc1ccc([C@@H](C)[N@H+](C)CCOC(C)C)c(C)c1 ZINC000615464023 367962863 /nfs/dbraw/zinc/96/28/63/367962863.db2.gz QSVBAHWFLHOFAG-OAHLLOKOSA-N 1 1 249.398 3.721 20 0 BHADMO CC[N@@H+](CC(C)C)[C@H]1CCc2ccccc21 ZINC000618986638 369251734 /nfs/dbraw/zinc/25/17/34/369251734.db2.gz KSRZDRUSADZVFG-HNNXBMFYSA-N 1 1 217.356 3.652 20 0 BHADMO CC[N@@H+](CC(C)C)[C@@H]1CCc2ccccc21 ZINC000618986639 369252159 /nfs/dbraw/zinc/25/21/59/369252159.db2.gz KSRZDRUSADZVFG-OAHLLOKOSA-N 1 1 217.356 3.652 20 0 BHADMO CSCCC[N@@H+](C)Cc1cscc1Cl ZINC000619613122 369494209 /nfs/dbraw/zinc/49/42/09/369494209.db2.gz KWDCKNMPYXSTFC-UHFFFAOYSA-N 1 1 249.832 3.586 20 0 BHADMO CSCCC[N@@H+](C)Cc1ccccc1C1CC1 ZINC000619613150 369493687 /nfs/dbraw/zinc/49/36/87/369493687.db2.gz OQYXWXVAXAEXPV-UHFFFAOYSA-N 1 1 249.423 3.749 20 0 BHADMO CC(C)SCC[N@@H+](C1CC1)C1CCCCC1 ZINC000619779240 369583936 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/nfs/dbraw/zinc/62/47/99/369624799.db2.gz UZFPDKQXYKDSQM-UHFFFAOYSA-N 1 1 211.374 3.759 20 0 BHADMO Cc1ccc(C[N@@H+](C)CCOC(C)(C)C)c(C)c1 ZINC000619971451 369644363 /nfs/dbraw/zinc/64/43/63/369644363.db2.gz YVQFAYRMPWCDHW-UHFFFAOYSA-N 1 1 249.398 3.550 20 0 BHADMO CCC(CC)[N@@H+](Cc1ccc(F)cc1)C1CC1 ZINC000620119414 343673072 /nfs/dbraw/zinc/67/30/72/343673072.db2.gz BAKZPDOAWXEHDI-UHFFFAOYSA-N 1 1 235.346 3.979 20 0 BHADMO CCC(CC)[N@@H+](Cc1cccc(F)c1)C1CC1 ZINC000620119537 369739329 /nfs/dbraw/zinc/73/93/29/369739329.db2.gz KLKXINJOSCPKIK-UHFFFAOYSA-N 1 1 235.346 3.979 20 0 BHADMO Cc1cc(C[N@H+](C)CCC(C)C)c(C)s1 ZINC000620119606 369739498 /nfs/dbraw/zinc/73/94/98/369739498.db2.gz PJNQVMIZWFMIFL-UHFFFAOYSA-N 1 1 225.401 3.843 20 0 BHADMO CC(C)C[N@@H+](C)[C@@H](C)c1c(F)cccc1F ZINC000620133054 369743005 /nfs/dbraw/zinc/74/30/05/369743005.db2.gz SPCXNWIFADHEJF-JTQLQIEISA-N 1 1 227.298 3.614 20 0 BHADMO CC(C)C[N@@H+](C)[C@H](C)c1c(F)cccc1F ZINC000620133068 369742647 /nfs/dbraw/zinc/74/26/47/369742647.db2.gz SPCXNWIFADHEJF-SNVBAGLBSA-N 1 1 227.298 3.614 20 0 BHADMO CC(C)[C@H]1CCC[N@H+]1Cc1ccccc1Cl ZINC000620139793 369745731 /nfs/dbraw/zinc/74/57/31/369745731.db2.gz BZMJYEIWLOCNSY-CQSZACIVSA-N 1 1 237.774 3.960 20 0 BHADMO CCC[N@H+]1CCC[C@@H]1c1ccc(C)c(C)c1 ZINC000620141394 369745797 /nfs/dbraw/zinc/74/57/97/369745797.db2.gz TTZNRBFLMPXWLQ-OAHLLOKOSA-N 1 1 217.356 3.850 20 0 BHADMO Cc1ccc(C[N@H+](C)Cc2ccccc2C)s1 ZINC000620235073 369779102 /nfs/dbraw/zinc/77/91/02/369779102.db2.gz WNGCTTRTBUCXLX-UHFFFAOYSA-N 1 1 245.391 3.997 20 0 BHADMO Cc1ccc(C[N@H+](C)Cc2cccc(C)c2)s1 ZINC000620235652 369779179 /nfs/dbraw/zinc/77/91/79/369779179.db2.gz LHMMXDNZNXYUDP-UHFFFAOYSA-N 1 1 245.391 3.997 20 0 BHADMO CCC(CC)[N@@H+](Cc1ccccc1F)C1CC1 ZINC000620803435 388650984 /nfs/dbraw/zinc/65/09/84/388650984.db2.gz GYNHDKKHPZNCGS-UHFFFAOYSA-N 1 1 235.346 3.979 20 0 BHADMO CC[N@@H+](CCOc1ccccc1C)[C@@H](C)C(C)C ZINC000620807863 345794192 /nfs/dbraw/zinc/79/41/92/345794192.db2.gz SYZZSRDIAJZKAP-HNNXBMFYSA-N 1 1 249.398 3.740 20 0 BHADMO CC[N@@H+](CCOc1ccccc1C)[C@H](C)C(C)C ZINC000620807864 345793816 /nfs/dbraw/zinc/79/38/16/345793816.db2.gz SYZZSRDIAJZKAP-OAHLLOKOSA-N 1 1 249.398 3.740 20 0 BHADMO CC[N@@H+](CCCc1ccccc1)[C@H](C)C(C)C ZINC000620807866 370001073 /nfs/dbraw/zinc/00/10/73/370001073.db2.gz WMQBVBOJPIFVFN-OAHLLOKOSA-N 1 1 233.399 3.986 20 0 BHADMO CC(C)CC[N@H+]1CCC[C@H]1c1ccc(O)cc1 ZINC000620934738 370063666 /nfs/dbraw/zinc/06/36/66/370063666.db2.gz PCFFCFXFTRETBZ-HNNXBMFYSA-N 1 1 233.355 3.575 20 0 BHADMO CC(C)CC[N@H+]1CCC[C@@H]1c1ccc(O)cc1 ZINC000620934739 370063687 /nfs/dbraw/zinc/06/36/87/370063687.db2.gz PCFFCFXFTRETBZ-OAHLLOKOSA-N 1 1 233.355 3.575 20 0 BHADMO CCCCC[N@@H+](Cc1ccnc(C)c1)C(C)C ZINC000621246629 370181808 /nfs/dbraw/zinc/18/18/08/370181808.db2.gz LSFMOKUNLVRBFJ-UHFFFAOYSA-N 1 1 234.387 3.791 20 0 BHADMO C[C@H]([N@@H+](C)Cc1cncc(Cl)c1)C(C)(C)C ZINC000621246730 370181922 /nfs/dbraw/zinc/18/19/22/370181922.db2.gz PYTAOYVQWRCMPH-JTQLQIEISA-N 1 1 240.778 3.601 20 0 BHADMO C[C@@H]([N@@H+](C)Cc1cncc(Cl)c1)C(C)(C)C ZINC000621246731 370181516 /nfs/dbraw/zinc/18/15/16/370181516.db2.gz PYTAOYVQWRCMPH-SNVBAGLBSA-N 1 1 240.778 3.601 20 0 BHADMO Cc1cc(C[N@@H+](C2CC2)C2CCCCC2)ccn1 ZINC000621247040 370181958 /nfs/dbraw/zinc/18/19/58/370181958.db2.gz DGRJVJDGWQQFKL-UHFFFAOYSA-N 1 1 244.382 3.687 20 0 BHADMO CC(C)C[N@@H+](Cc1cncc(Cl)c1)C(C)C ZINC000621247241 350027117 /nfs/dbraw/zinc/02/71/17/350027117.db2.gz MHVMODMASHJHNW-UHFFFAOYSA-N 1 1 240.778 3.601 20 0 BHADMO CC[N@@H+](Cc1cncc(Cl)c1)[C@H](C)C(C)C ZINC000621251427 370185158 /nfs/dbraw/zinc/18/51/58/370185158.db2.gz UHGGOTPZBJDPAT-LLVKDONJSA-N 1 1 240.778 3.601 20 0 BHADMO CC[N@@H+](Cc1cncc(Cl)c1)[C@@H](C)C(C)C ZINC000621251428 370185533 /nfs/dbraw/zinc/18/55/33/370185533.db2.gz UHGGOTPZBJDPAT-NSHDSACASA-N 1 1 240.778 3.601 20 0 BHADMO CCC[N@H+](Cc1cncc(Cl)c1)CC(C)C ZINC000621251742 370184936 /nfs/dbraw/zinc/18/49/36/370184936.db2.gz GNGDNSYSMLUCIW-UHFFFAOYSA-N 1 1 240.778 3.603 20 0 BHADMO CC[C@@H](C)C[N@@H+](CC)Cc1cncc(Cl)c1 ZINC000621261214 350226799 /nfs/dbraw/zinc/22/67/99/350226799.db2.gz ILEGMJKOLNUXDV-LLVKDONJSA-N 1 1 240.778 3.603 20 0 BHADMO CC[C@H](C)C[N@@H+](CC)Cc1cncc(Cl)c1 ZINC000621261215 350226687 /nfs/dbraw/zinc/22/66/87/350226687.db2.gz ILEGMJKOLNUXDV-NSHDSACASA-N 1 1 240.778 3.603 20 0 BHADMO Cc1cc(C[N@H+](C(C)C)C2CCCC2)ccn1 ZINC000621265699 370198019 /nfs/dbraw/zinc/19/80/19/370198019.db2.gz NDECHLQSOSSXLP-UHFFFAOYSA-N 1 1 232.371 3.543 20 0 BHADMO Cc1[nH+]ccn1CCCCc1cccc(Cl)c1 ZINC000621270279 370201707 /nfs/dbraw/zinc/20/17/07/370201707.db2.gz VQNFHGPTXWLUBP-UHFFFAOYSA-N 1 1 248.757 3.868 20 0 BHADMO CC[C@@H](c1ccccc1)[N@@H+](C)CCOC(C)(C)C ZINC000621277064 370207761 /nfs/dbraw/zinc/20/77/61/370207761.db2.gz QKQJVYDOQAIENG-HNNXBMFYSA-N 1 1 249.398 3.885 20 0 BHADMO CC[C@H](c1ccccc1)[N@@H+](C)CCOC(C)(C)C ZINC000621277065 370207847 /nfs/dbraw/zinc/20/78/47/370207847.db2.gz QKQJVYDOQAIENG-OAHLLOKOSA-N 1 1 249.398 3.885 20 0 BHADMO COc1cccc([C@@H](C)[N@@H+](C)CCC(C)C)c1 ZINC000621279634 370210668 /nfs/dbraw/zinc/21/06/68/370210668.db2.gz AHNDONFMDQLZRE-CYBMUJFWSA-N 1 1 235.371 3.734 20 0 BHADMO COc1cccc([C@H](C)[N@@H+](C)CCC(C)C)c1 ZINC000621279635 370210956 /nfs/dbraw/zinc/21/09/56/370210956.db2.gz AHNDONFMDQLZRE-ZDUSSCGKSA-N 1 1 235.371 3.734 20 0 BHADMO Cc1ccc(C)c([C@H](C)[N@H+](C)CC(C)C)c1 ZINC000621280637 370212001 /nfs/dbraw/zinc/21/20/01/370212001.db2.gz QFSRBVQBFTWHQD-AWEZNQCLSA-N 1 1 219.372 3.952 20 0 BHADMO Cc1ccc(C)c([C@@H](C)[N@H+](C)CC(C)C)c1 ZINC000621280638 370211750 /nfs/dbraw/zinc/21/17/50/370211750.db2.gz QFSRBVQBFTWHQD-CQSZACIVSA-N 1 1 219.372 3.952 20 0 BHADMO CCC[N@@H+](C)[C@H](C)c1cc(C)ccc1C ZINC000621281469 370212818 /nfs/dbraw/zinc/21/28/18/370212818.db2.gz QLZGHYIITFTOMZ-CYBMUJFWSA-N 1 1 205.345 3.706 20 0 BHADMO CCC[N@@H+](C)[C@@H](C)c1cc(C)ccc1C ZINC000621281470 370213263 /nfs/dbraw/zinc/21/32/63/370213263.db2.gz QLZGHYIITFTOMZ-ZDUSSCGKSA-N 1 1 205.345 3.706 20 0 BHADMO CCC[N@@H+](Cc1ccco1)Cc1ccccc1F ZINC000621283123 370213796 /nfs/dbraw/zinc/21/37/96/370213796.db2.gz BGLMZYNXOWSYEQ-UHFFFAOYSA-N 1 1 247.313 3.831 20 0 BHADMO CCC[N@H+](Cc1ccco1)Cc1ccccc1F ZINC000621283123 370213790 /nfs/dbraw/zinc/21/37/90/370213790.db2.gz BGLMZYNXOWSYEQ-UHFFFAOYSA-N 1 1 247.313 3.831 20 0 BHADMO CCC[N@@H+](Cc1ccc(OC)cc1)C1CCCC1 ZINC000621292517 370219681 /nfs/dbraw/zinc/21/96/81/370219681.db2.gz FKMUGXBMXNQWRA-UHFFFAOYSA-N 1 1 247.382 3.850 20 0 BHADMO CCC[N@@H+](Cc1ccccc1F)C1CCCC1 ZINC000621292519 370218768 /nfs/dbraw/zinc/21/87/68/370218768.db2.gz FNPMGRKKFXLBDJ-UHFFFAOYSA-N 1 1 235.346 3.980 20 0 BHADMO CCC[N@@H+](CC=C(C)C)Cc1ccc(OC)cc1 ZINC000621292773 370218716 /nfs/dbraw/zinc/21/87/16/370218716.db2.gz RYDVFTAHISJCIL-UHFFFAOYSA-N 1 1 247.382 3.873 20 0 BHADMO CCC[N@@H+](CCC(C)C)Cc1ccc(OC)cc1 ZINC000621292781 370219287 /nfs/dbraw/zinc/21/92/87/370219287.db2.gz SIAVWEMQPKMDMH-UHFFFAOYSA-N 1 1 249.398 3.953 20 0 BHADMO CCC[N@@H+](Cc1ccc(F)cc1)C1CCCC1 ZINC000621292827 370219299 /nfs/dbraw/zinc/21/92/99/370219299.db2.gz VEOOOMUSMPOZAH-UHFFFAOYSA-N 1 1 235.346 3.980 20 0 BHADMO CCC(CC)[N@@H+](CC)Cc1cncc(Cl)c1 ZINC000621295970 370223895 /nfs/dbraw/zinc/22/38/95/370223895.db2.gz BEGFFZBTRFZPOY-UHFFFAOYSA-N 1 1 240.778 3.746 20 0 BHADMO CC[N@@H+](Cc1cncc(Cl)c1)CC(C)(C)C ZINC000621296440 370223480 /nfs/dbraw/zinc/22/34/80/370223480.db2.gz SPNYZYCWXXZUEK-UHFFFAOYSA-N 1 1 240.778 3.603 20 0 BHADMO CCCC[C@@H](C)[N@@H+](C)Cc1cncc(Cl)c1 ZINC000621296492 370223745 /nfs/dbraw/zinc/22/37/45/370223745.db2.gz VDCNKUQUPOEENP-LLVKDONJSA-N 1 1 240.778 3.746 20 0 BHADMO CCCC[C@H](C)[N@@H+](C)Cc1cncc(Cl)c1 ZINC000621296493 370223687 /nfs/dbraw/zinc/22/36/87/370223687.db2.gz VDCNKUQUPOEENP-NSHDSACASA-N 1 1 240.778 3.746 20 0 BHADMO CCc1ccc(C[N@@H+](CC)CC(C)C)cc1 ZINC000621299287 370228018 /nfs/dbraw/zinc/22/80/18/370228018.db2.gz KZXMZZUQABGADR-UHFFFAOYSA-N 1 1 219.372 3.727 20 0 BHADMO CCCC[N@@H+](CCCOC)[C@@H](C)c1ccccc1 ZINC000621301610 370231476 /nfs/dbraw/zinc/23/14/76/370231476.db2.gz ZHPJZZGKIQMTEV-HNNXBMFYSA-N 1 1 249.398 3.886 20 0 BHADMO CCCC[N@@H+](CCCOC)[C@H](C)c1ccccc1 ZINC000621301611 370231642 /nfs/dbraw/zinc/23/16/42/370231642.db2.gz ZHPJZZGKIQMTEV-OAHLLOKOSA-N 1 1 249.398 3.886 20 0 BHADMO CCCC[N@@H+](C[C@@H]1CCCO1)C1CCCCC1 ZINC000621302303 370231909 /nfs/dbraw/zinc/23/19/09/370231909.db2.gz PYLFZTRAFPPREB-HNNXBMFYSA-N 1 1 239.403 3.600 20 0 BHADMO CC[C@H](C)[N@@H+](CC)Cc1ccc(F)cc1F ZINC000621309324 342749731 /nfs/dbraw/zinc/74/97/31/342749731.db2.gz BZPNKFBPXLESKC-JTQLQIEISA-N 1 1 227.298 3.585 20 0 BHADMO CC[C@@H](C)[N@@H+](CC)Cc1ccc(F)cc1F ZINC000621309325 342749723 /nfs/dbraw/zinc/74/97/23/342749723.db2.gz BZPNKFBPXLESKC-SNVBAGLBSA-N 1 1 227.298 3.585 20 0 BHADMO CC[C@H](C)[N@@H+](CC)Cc1ccc(F)c(F)c1 ZINC000621309348 370235095 /nfs/dbraw/zinc/23/50/95/370235095.db2.gz KTJYHSRQWFFFMN-JTQLQIEISA-N 1 1 227.298 3.585 20 0 BHADMO CC[C@@H](C)[N@@H+](CC)Cc1ccc(F)c(F)c1 ZINC000621309349 370235184 /nfs/dbraw/zinc/23/51/84/370235184.db2.gz KTJYHSRQWFFFMN-SNVBAGLBSA-N 1 1 227.298 3.585 20 0 BHADMO CCC[N@@H+](Cc1ccc(OC)cc1)[C@H](C)CC ZINC000621309359 370235394 /nfs/dbraw/zinc/23/53/94/370235394.db2.gz NFQCLXHQWAVFFF-CYBMUJFWSA-N 1 1 235.371 3.706 20 0 BHADMO CCC[N@@H+](Cc1ccc(OC)cc1)[C@@H](C)CC ZINC000621309360 370234930 /nfs/dbraw/zinc/23/49/30/370234930.db2.gz NFQCLXHQWAVFFF-ZDUSSCGKSA-N 1 1 235.371 3.706 20 0 BHADMO CCC[N@@H+](Cc1ccccc1F)[C@H](C)CC ZINC000621311074 370236148 /nfs/dbraw/zinc/23/61/48/370236148.db2.gz SYZWRYLOMWUBIX-GFCCVEGCSA-N 1 1 223.335 3.836 20 0 BHADMO CCC[N@@H+](Cc1ccccc1F)[C@@H](C)CC ZINC000621311075 370236143 /nfs/dbraw/zinc/23/61/43/370236143.db2.gz SYZWRYLOMWUBIX-LBPRGKRZSA-N 1 1 223.335 3.836 20 0 BHADMO Cc1cc(C[N@H+]2CCCC[C@H]2C2CCC2)ccn1 ZINC000621312253 342768262 /nfs/dbraw/zinc/76/82/62/342768262.db2.gz OEXHSMYHNNUFGU-INIZCTEOSA-N 1 1 244.382 3.545 20 0 BHADMO Cc1cc(C[N@H+]2CCCC[C@@H]2C2CCC2)ccn1 ZINC000621312254 342768202 /nfs/dbraw/zinc/76/82/02/342768202.db2.gz OEXHSMYHNNUFGU-MRXNPFEDSA-N 1 1 244.382 3.545 20 0 BHADMO C[N@@H+](CCC(C)(C)C)Cc1cncc(Cl)c1 ZINC000621312382 370237334 /nfs/dbraw/zinc/23/73/34/370237334.db2.gz SNHSWFZGIYUPQN-UHFFFAOYSA-N 1 1 240.778 3.603 20 0 BHADMO CCC[N@@H+](Cc1ccccc1)[C@@H](C)C(C)C ZINC000621315653 370239467 /nfs/dbraw/zinc/23/94/67/370239467.db2.gz QASRQQDYILLWPD-AWEZNQCLSA-N 1 1 219.372 3.943 20 0 BHADMO CCC[N@@H+](Cc1ccccc1)[C@H](C)C(C)C ZINC000621315654 370239700 /nfs/dbraw/zinc/23/97/00/370239700.db2.gz QASRQQDYILLWPD-CQSZACIVSA-N 1 1 219.372 3.943 20 0 BHADMO CCC[N@@H+](CCc1ccc(F)cc1)CC(C)C ZINC000621316536 370243748 /nfs/dbraw/zinc/24/37/48/370243748.db2.gz DYSVOFFGKWBFKO-UHFFFAOYSA-N 1 1 237.362 3.736 20 0 BHADMO CCCC[N@@H+](CC)[C@H](C)c1ccc(C)o1 ZINC000621317489 370241787 /nfs/dbraw/zinc/24/17/87/370241787.db2.gz GMELZXARDMBGPH-GFCCVEGCSA-N 1 1 209.333 3.771 20 0 BHADMO CCCC[N@@H+](CC)[C@@H](C)c1ccc(C)o1 ZINC000621317490 370242691 /nfs/dbraw/zinc/24/26/91/370242691.db2.gz GMELZXARDMBGPH-LBPRGKRZSA-N 1 1 209.333 3.771 20 0 BHADMO CCCC[N@H+](Cc1cccc(OC)c1)CC(C)C ZINC000621317649 370244926 /nfs/dbraw/zinc/24/49/26/370244926.db2.gz PZJWGYWODMRIIF-UHFFFAOYSA-N 1 1 249.398 3.953 20 0 BHADMO CCC[N@@H+](Cc1ccc(OC)cc1)[C@@H](C)C(C)C ZINC000621319391 370247109 /nfs/dbraw/zinc/24/71/09/370247109.db2.gz MXUVIVKDPHCFHU-AWEZNQCLSA-N 1 1 249.398 3.952 20 0 BHADMO CCC[N@@H+](Cc1ccc(OC)cc1)[C@H](C)C(C)C ZINC000621319392 370246358 /nfs/dbraw/zinc/24/63/58/370246358.db2.gz MXUVIVKDPHCFHU-CQSZACIVSA-N 1 1 249.398 3.952 20 0 BHADMO CC[N@@H+](CCc1cccs1)[C@@H](C)C(C)C ZINC000621320776 370248354 /nfs/dbraw/zinc/24/83/54/370248354.db2.gz IXNJJXPHGVSYOO-LBPRGKRZSA-N 1 1 225.401 3.657 20 0 BHADMO CCOCCC[N@@H+](CCC(C)C)C1CCCC1 ZINC000621321828 370249758 /nfs/dbraw/zinc/24/97/58/370249758.db2.gz YBAAHMNOKOYNEL-UHFFFAOYSA-N 1 1 241.419 3.704 20 0 BHADMO CC[C@@H]1CCC[C@H](C)[N@H+]1Cc1ccnc(C)c1 ZINC000621322175 370250557 /nfs/dbraw/zinc/25/05/57/370250557.db2.gz MMBZMEHIMZBLBK-DZGCQCFKSA-N 1 1 232.371 3.543 20 0 BHADMO Cc1cc(C[N@H+]2CCC[C@@H]3CCCC[C@@H]32)ccn1 ZINC000621322890 370250696 /nfs/dbraw/zinc/25/06/96/370250696.db2.gz LXFPKOBHPQBFAB-HOTGVXAUSA-N 1 1 244.382 3.545 20 0 BHADMO C[C@H](c1ccncc1)[N@H+]1Cc2ccccc2[C@@H]1C ZINC000621398227 370335510 /nfs/dbraw/zinc/33/55/10/370335510.db2.gz VOCRVOUEBRAYFI-OLZOCXBDSA-N 1 1 238.334 3.719 20 0 BHADMO C[C@@H](c1ccncc1)[N@H+]1Cc2ccccc2[C@@H]1C ZINC000621398228 370336257 /nfs/dbraw/zinc/33/62/57/370336257.db2.gz VOCRVOUEBRAYFI-STQMWFEESA-N 1 1 238.334 3.719 20 0 BHADMO C[C@H]1c2ccccc2C[N@@H+]1CCCOC(C)(C)C ZINC000621398790 370336067 /nfs/dbraw/zinc/33/60/67/370336067.db2.gz REZGTUUUNSAWDJ-ZDUSSCGKSA-N 1 1 247.382 3.768 20 0 BHADMO C[C@H]1c2ccccc2C[N@@H+]1C[C@@H]1C[C@H]2C[C@H]2C1 ZINC000621400611 370338594 /nfs/dbraw/zinc/33/85/94/370338594.db2.gz MMGRROSJECLIDK-VIRABCJISA-N 1 1 227.351 3.609 20 0 BHADMO C[C@H]1c2ccccc2C[N@@H+]1CC1=CCCC1 ZINC000621400668 370338697 /nfs/dbraw/zinc/33/86/97/370338697.db2.gz OKJNTPUSFMABAX-LBPRGKRZSA-N 1 1 213.324 3.674 20 0 BHADMO C[C@H]1c2ccccc2C[N@@H+]1CC1CC=CC1 ZINC000621400757 343458764 /nfs/dbraw/zinc/45/87/64/343458764.db2.gz QPYJMAGWHHMESN-LBPRGKRZSA-N 1 1 213.324 3.529 20 0 BHADMO CCCc1ccc(C[N@@H+](C)Cc2ccc[nH]2)s1 ZINC000621719259 370469373 /nfs/dbraw/zinc/46/93/73/370469373.db2.gz GSHCVVNDDRKPNB-UHFFFAOYSA-N 1 1 248.395 3.661 20 0 BHADMO CCCC[N@@H+](Cc1ccc(F)cc1)C(C)C ZINC000621731075 370484197 /nfs/dbraw/zinc/48/41/97/370484197.db2.gz WOPPJNLFYVOHOD-UHFFFAOYSA-N 1 1 223.335 3.836 20 0 BHADMO CCCC[N@@H+](Cc1ccccc1F)C(C)C ZINC000621731786 370485224 /nfs/dbraw/zinc/48/52/24/370485224.db2.gz ORHWJIBNCRQMDI-UHFFFAOYSA-N 1 1 223.335 3.836 20 0 BHADMO CCCC[N@@H+](CCOCC)[C@@H](C)c1ccccc1 ZINC000621736251 370492856 /nfs/dbraw/zinc/49/28/56/370492856.db2.gz PCZXEEBXUJPWBG-HNNXBMFYSA-N 1 1 249.398 3.886 20 0 BHADMO CCCC[N@@H+](CCOCC)[C@H](C)c1ccccc1 ZINC000621736252 370493379 /nfs/dbraw/zinc/49/33/79/370493379.db2.gz PCZXEEBXUJPWBG-OAHLLOKOSA-N 1 1 249.398 3.886 20 0 BHADMO Clc1ccc(C[NH+]2CC(CC3CC3)C2)s1 ZINC000621740169 370497981 /nfs/dbraw/zinc/49/79/81/370497981.db2.gz BMIOXOOVHBAGRL-UHFFFAOYSA-N 1 1 241.787 3.633 20 0 BHADMO Clc1sccc1C[NH+]1CC(CC2CC2)C1 ZINC000621740270 370499277 /nfs/dbraw/zinc/49/92/77/370499277.db2.gz HOLZSZISXMHZHM-UHFFFAOYSA-N 1 1 241.787 3.633 20 0 BHADMO Clc1cscc1C[NH+]1CC(CC2CC2)C1 ZINC000621740620 370500710 /nfs/dbraw/zinc/50/07/10/370500710.db2.gz ZQZSPBGJQBYPDY-UHFFFAOYSA-N 1 1 241.787 3.633 20 0 BHADMO C[N@@H+](CCc1ccccc1Cl)C1CCCC1 ZINC000622020245 370666517 /nfs/dbraw/zinc/66/65/17/370666517.db2.gz XWACZGYJSFOJFC-UHFFFAOYSA-N 1 1 237.774 3.757 20 0 BHADMO CCC[N@@H+](CC)CCc1ccccc1Cl ZINC000622032901 370670479 /nfs/dbraw/zinc/67/04/79/370670479.db2.gz HQVKWUGUEFFPNS-UHFFFAOYSA-N 1 1 225.763 3.614 20 0 BHADMO CC[C@@H](c1ccccc1)[N@H+]1CCC[C@@H](C)C1 ZINC000622260765 370808280 /nfs/dbraw/zinc/80/82/80/370808280.db2.gz GYFLAYWBAXMINE-HIFRSBDPSA-N 1 1 217.356 3.870 20 0 BHADMO CC[C@H](c1ccccc1)[N@H+]1CCC[C@@H](C)C1 ZINC000622260766 370808847 /nfs/dbraw/zinc/80/88/47/370808847.db2.gz GYFLAYWBAXMINE-UKRRQHHQSA-N 1 1 217.356 3.870 20 0 BHADMO CC[C@H](c1ccccc1)[N@H+]1C[C@H](C)OC(C)(C)C1 ZINC000622260968 370808214 /nfs/dbraw/zinc/80/82/14/370808214.db2.gz XTPORUWDGMFMBL-DZGCQCFKSA-N 1 1 247.382 3.637 20 0 BHADMO CC[C@H](c1ccccc1)[N@H+]1C[C@@H](C)OC(C)(C)C1 ZINC000622260969 370808187 /nfs/dbraw/zinc/80/81/87/370808187.db2.gz XTPORUWDGMFMBL-UKRRQHHQSA-N 1 1 247.382 3.637 20 0 BHADMO CC[C@@H](c1ccccc1)[N@H+]1C[C@H](C)OC(C)(C)C1 ZINC000622260970 370808604 /nfs/dbraw/zinc/80/86/04/370808604.db2.gz XTPORUWDGMFMBL-ZFWWWQNUSA-N 1 1 247.382 3.637 20 0 BHADMO CC[N@@H+](CCC(F)(F)F)CC1CCCCC1 ZINC000623120640 351052133 /nfs/dbraw/zinc/05/21/33/351052133.db2.gz FDGIQSXTKGPUHX-UHFFFAOYSA-N 1 1 237.309 3.841 20 0 BHADMO CC[N@@H+](CCC(F)(F)F)Cc1cccc(C)c1 ZINC000623120656 351051868 /nfs/dbraw/zinc/05/18/68/351051868.db2.gz FZVKBEAAKZVWFF-UHFFFAOYSA-N 1 1 245.288 3.769 20 0 BHADMO CC[N@@H+](CCC(F)(F)F)Cc1ccccc1F ZINC000623120923 351053478 /nfs/dbraw/zinc/05/34/78/351053478.db2.gz NKTVVZXUOPSTOZ-UHFFFAOYSA-N 1 1 249.251 3.600 20 0 BHADMO CC[N@H+](CCC(F)(F)F)Cc1ccccc1F ZINC000623120923 351053474 /nfs/dbraw/zinc/05/34/74/351053474.db2.gz NKTVVZXUOPSTOZ-UHFFFAOYSA-N 1 1 249.251 3.600 20 0 BHADMO CC[N@@H+](CCC(F)(F)F)Cc1ccc(F)cc1 ZINC000623121337 351053493 /nfs/dbraw/zinc/05/34/93/351053493.db2.gz WKZVNZWZSQOXLF-UHFFFAOYSA-N 1 1 249.251 3.600 20 0 BHADMO CC[N@@H+](CCC(F)(F)F)Cc1ccc(C)cc1 ZINC000623121910 351053242 /nfs/dbraw/zinc/05/32/42/351053242.db2.gz SSUPCCMNWIFBJM-UHFFFAOYSA-N 1 1 245.288 3.769 20 0 BHADMO CC[N@@H+](Cc1ccccc1)[C@@H](C)c1ccncc1 ZINC000623194237 354832551 /nfs/dbraw/zinc/83/25/51/354832551.db2.gz ALRFTOBWCBPMLA-AWEZNQCLSA-N 1 1 240.350 3.665 20 0 BHADMO CC[N@@H+](Cc1ccccc1)[C@H](C)c1ccncc1 ZINC000623194238 354832902 /nfs/dbraw/zinc/83/29/02/354832902.db2.gz ALRFTOBWCBPMLA-CQSZACIVSA-N 1 1 240.350 3.665 20 0 BHADMO COCC[N@@H+](C)[C@H](C)c1ccc(C(C)(C)C)cc1 ZINC000623433956 359087551 /nfs/dbraw/zinc/08/75/51/359087551.db2.gz UZJKGIQVOYHXOF-CYBMUJFWSA-N 1 1 249.398 3.623 20 0 BHADMO COCC[N@@H+](C)[C@@H](C)c1ccc(C(C)(C)C)cc1 ZINC000623433957 359087330 /nfs/dbraw/zinc/08/73/30/359087330.db2.gz UZJKGIQVOYHXOF-ZDUSSCGKSA-N 1 1 249.398 3.623 20 0 BHADMO CCC(F)(F)C[NH2+][C@H](C)Cc1ccccc1C ZINC000623679469 369379999 /nfs/dbraw/zinc/37/99/99/369379999.db2.gz ZAXUBJNDRDEMRM-GFCCVEGCSA-N 1 1 241.325 3.561 20 0 BHADMO CCC(F)(F)C[NH2+][C@@H](C)Cc1ccccc1C ZINC000623679470 369380313 /nfs/dbraw/zinc/38/03/13/369380313.db2.gz ZAXUBJNDRDEMRM-LBPRGKRZSA-N 1 1 241.325 3.561 20 0 BHADMO CCC(F)(F)C[NH2+]C[C@H](C)c1ccc(F)cc1 ZINC000623679828 398290398 /nfs/dbraw/zinc/29/03/98/398290398.db2.gz LIXRXPYGFLEGJK-JTQLQIEISA-N 1 1 245.288 3.564 20 0 BHADMO CCC(F)(F)C[NH2+]C[C@@H](C)c1ccc(F)cc1 ZINC000623679829 369381858 /nfs/dbraw/zinc/38/18/58/369381858.db2.gz LIXRXPYGFLEGJK-SNVBAGLBSA-N 1 1 245.288 3.564 20 0 BHADMO C[C@H](c1ccccc1)[N@@H+](C)CCc1cccs1 ZINC000623874067 371137625 /nfs/dbraw/zinc/13/76/25/371137625.db2.gz CQIMEEPTROZGCV-CYBMUJFWSA-N 1 1 245.391 3.984 20 0 BHADMO C[C@@H](c1ccccc1)[N@@H+](C)CCc1cccs1 ZINC000623874068 371137602 /nfs/dbraw/zinc/13/76/02/371137602.db2.gz CQIMEEPTROZGCV-ZDUSSCGKSA-N 1 1 245.391 3.984 20 0 BHADMO Cc1ccc(C[N@@H+](C)CCc2cccs2)cc1 ZINC000623874094 371134869 /nfs/dbraw/zinc/13/48/69/371134869.db2.gz MRAYCONLWRAHPP-UHFFFAOYSA-N 1 1 245.391 3.731 20 0 BHADMO CCc1cccc(N[C@H]2CC[N@@H+](C)C(C)(C)C2)c1 ZINC000623929841 371158967 /nfs/dbraw/zinc/15/89/67/371158967.db2.gz WOBFSOSZJDTNHA-HNNXBMFYSA-N 1 1 246.398 3.534 20 0 BHADMO CCc1cccc(N[C@@H]2CC[N@@H+](C)C(C)(C)C2)c1 ZINC000623929842 371158945 /nfs/dbraw/zinc/15/89/45/371158945.db2.gz WOBFSOSZJDTNHA-OAHLLOKOSA-N 1 1 246.398 3.534 20 0 BHADMO CC(C)c1cccc([C@@H](C)[NH2+]Cc2cocn2)c1 ZINC000623937596 357406652 /nfs/dbraw/zinc/40/66/52/357406652.db2.gz MNLHUKJVNVNNBY-GFCCVEGCSA-N 1 1 244.338 3.649 20 0 BHADMO CC(C)c1cccc([C@H](C)[NH2+]Cc2cocn2)c1 ZINC000623937597 357406407 /nfs/dbraw/zinc/40/64/07/357406407.db2.gz MNLHUKJVNVNNBY-LBPRGKRZSA-N 1 1 244.338 3.649 20 0 BHADMO CC(C)[N@H+]1CCC[C@@H](c2ccc(F)c(F)c2)C1 ZINC000624062258 371287197 /nfs/dbraw/zinc/28/71/97/371287197.db2.gz XSDUHORKGVHXSM-GFCCVEGCSA-N 1 1 239.309 3.553 20 0 BHADMO CC(C)[N@H+]1CCC[C@H](c2ccc(F)c(F)c2)C1 ZINC000624062259 371287372 /nfs/dbraw/zinc/28/73/72/371287372.db2.gz XSDUHORKGVHXSM-LBPRGKRZSA-N 1 1 239.309 3.553 20 0 BHADMO CCC(F)(F)C[NH2+][C@H](C)CCc1ccccc1 ZINC000624147026 371341836 /nfs/dbraw/zinc/34/18/36/371341836.db2.gz QXCXFIAJFIICLH-GFCCVEGCSA-N 1 1 241.325 3.643 20 0 BHADMO CCC(F)(F)C[NH2+][C@@H](C)CCc1ccccc1 ZINC000624147027 371341348 /nfs/dbraw/zinc/34/13/48/371341348.db2.gz QXCXFIAJFIICLH-LBPRGKRZSA-N 1 1 241.325 3.643 20 0 BHADMO CCC(F)(F)C[NH2+][C@@H](c1cccs1)C1CC1 ZINC000624147495 347255452 /nfs/dbraw/zinc/25/54/52/347255452.db2.gz BVOKNGQXPNXYMS-LLVKDONJSA-N 1 1 245.338 3.834 20 0 BHADMO CCC(F)(F)C[NH2+][C@H](c1cccs1)C1CC1 ZINC000624147496 347255425 /nfs/dbraw/zinc/25/54/25/347255425.db2.gz BVOKNGQXPNXYMS-NSHDSACASA-N 1 1 245.338 3.834 20 0 BHADMO CCC(F)(F)C[NH2+][C@H](c1ccccc1)C1CC1 ZINC000624147674 371342690 /nfs/dbraw/zinc/34/26/90/371342690.db2.gz HVESKEQWWQBUHW-CYBMUJFWSA-N 1 1 239.309 3.773 20 0 BHADMO CCC(F)(F)C[NH2+][C@@H](c1ccccc1)C1CC1 ZINC000624147675 371343075 /nfs/dbraw/zinc/34/30/75/371343075.db2.gz HVESKEQWWQBUHW-ZDUSSCGKSA-N 1 1 239.309 3.773 20 0 BHADMO CCC(F)(F)C[NH2+]C1CC(c2ccccc2)C1 ZINC000624147691 371343331 /nfs/dbraw/zinc/34/33/31/371343331.db2.gz IGJDYQUPDXOUOU-UHFFFAOYSA-N 1 1 239.309 3.568 20 0 BHADMO CCC(F)(F)C[NH2+][C@@H](C)CCc1ccsc1 ZINC000624148496 371344942 /nfs/dbraw/zinc/34/49/42/371344942.db2.gz GLZRILUVWRUWNP-JTQLQIEISA-N 1 1 247.354 3.704 20 0 BHADMO CCC(F)(F)C[NH2+][C@H](C)CCc1ccsc1 ZINC000624148497 371344671 /nfs/dbraw/zinc/34/46/71/371344671.db2.gz GLZRILUVWRUWNP-SNVBAGLBSA-N 1 1 247.354 3.704 20 0 BHADMO CCC(F)(F)CNc1[nH+]ccc2ccccc21 ZINC000624560469 398215590 /nfs/dbraw/zinc/21/55/90/398215590.db2.gz FUYOJYWIGXAFRZ-UHFFFAOYSA-N 1 1 236.265 3.692 20 0 BHADMO Clc1c[nH+]ccc1N1CCCC2(CC2)CC1 ZINC000624719336 342821239 /nfs/dbraw/zinc/82/12/39/342821239.db2.gz GTDVYILFRQVZSU-UHFFFAOYSA-N 1 1 236.746 3.506 20 0 BHADMO CCC[C@@H](C)CCC[N@@H+](C)Cc1cc(C)on1 ZINC000625077987 342848649 /nfs/dbraw/zinc/84/86/49/342848649.db2.gz LLQRHFCFINKJII-GFCCVEGCSA-N 1 1 238.375 3.631 20 0 BHADMO CCC[C@@H](C)CCC[N@H+](C)Cc1cc(C)on1 ZINC000625077987 342848648 /nfs/dbraw/zinc/84/86/48/342848648.db2.gz LLQRHFCFINKJII-GFCCVEGCSA-N 1 1 238.375 3.631 20 0 BHADMO CCC[C@H](C)CCC[N@@H+](C)Cc1cc(C)on1 ZINC000625077988 342848697 /nfs/dbraw/zinc/84/86/97/342848697.db2.gz LLQRHFCFINKJII-LBPRGKRZSA-N 1 1 238.375 3.631 20 0 BHADMO CCC[C@H](C)CCC[N@H+](C)Cc1cc(C)on1 ZINC000625077988 342848696 /nfs/dbraw/zinc/84/86/96/342848696.db2.gz LLQRHFCFINKJII-LBPRGKRZSA-N 1 1 238.375 3.631 20 0 BHADMO CCC[C@@H](C)CCC[N@@H+](CC)C[C@@H]1CCOC1 ZINC000625086835 342849336 /nfs/dbraw/zinc/84/93/36/342849336.db2.gz BAQQZPAAUPUPMX-CABCVRRESA-N 1 1 241.419 3.561 20 0 BHADMO CCC[C@H](C)CCC[N@@H+](CC)C[C@@H]1CCOC1 ZINC000625086842 342849212 /nfs/dbraw/zinc/84/92/12/342849212.db2.gz BAQQZPAAUPUPMX-GJZGRUSLSA-N 1 1 241.419 3.561 20 0 BHADMO CCC[C@@H](C)CCC[N@@H+](CC)C[C@H]1CCOC1 ZINC000625086844 342849333 /nfs/dbraw/zinc/84/93/33/342849333.db2.gz BAQQZPAAUPUPMX-HUUCEWRRSA-N 1 1 241.419 3.561 20 0 BHADMO CCC[C@H](C)CCC[N@@H+](CC)C[C@H]1CCOC1 ZINC000625086846 342849288 /nfs/dbraw/zinc/84/92/88/342849288.db2.gz BAQQZPAAUPUPMX-LSDHHAIUSA-N 1 1 241.419 3.561 20 0 BHADMO CCC[C@@H](C)CCC[N@@H+](C)Cc1cscn1 ZINC000625102949 342857155 /nfs/dbraw/zinc/85/71/55/342857155.db2.gz LXMGLLZTOWBODE-GFCCVEGCSA-N 1 1 240.416 3.791 20 0 BHADMO CCC[C@@H](C)CCC[N@H+](C)Cc1cscn1 ZINC000625102949 342857154 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MDJOECCFDMBGCH-BXUZGUMPSA-N 1 1 248.370 3.563 20 0 BHADMO C[C@H]1CCCC[C@@H]1[N@@H+](C)Cc1cnc(C2CC2)o1 ZINC000628265641 346264660 /nfs/dbraw/zinc/26/46/60/346264660.db2.gz MDJOECCFDMBGCH-FZMZJTMJSA-N 1 1 248.370 3.563 20 0 BHADMO C[C@@H]1CCCC[C@@H]1[N@@H+](C)Cc1cnc(C2CC2)o1 ZINC000628265642 346264496 /nfs/dbraw/zinc/26/44/96/346264496.db2.gz MDJOECCFDMBGCH-RISCZKNCSA-N 1 1 248.370 3.563 20 0 BHADMO C[C@H]1CCCC[C@H]1[N@@H+](C)Cc1cnc(C2CC2)o1 ZINC000628265643 346264601 /nfs/dbraw/zinc/26/46/01/346264601.db2.gz MDJOECCFDMBGCH-SMDDNHRTSA-N 1 1 248.370 3.563 20 0 BHADMO CCC(CC)[N@@H+](CC)Cc1cnc(C2CC2)o1 ZINC000628283538 346293665 /nfs/dbraw/zinc/29/36/65/346293665.db2.gz ZWXXLGRHCLCKBB-UHFFFAOYSA-N 1 1 236.359 3.563 20 0 BHADMO CCCC[C@@H](C)[N@@H+](C)Cc1cccc2n[nH]cc21 ZINC000628287551 346920146 /nfs/dbraw/zinc/92/01/46/346920146.db2.gz CVSIXGYFFBNXFI-GFCCVEGCSA-N 1 1 245.370 3.573 20 0 BHADMO CCCC[C@H](C)[N@@H+](C)Cc1cccc2n[nH]cc21 ZINC000628287552 346920235 /nfs/dbraw/zinc/92/02/35/346920235.db2.gz CVSIXGYFFBNXFI-LBPRGKRZSA-N 1 1 245.370 3.573 20 0 BHADMO CCCC[C@@H](C)[N@@H+](C)Cc1cnc(C2CC2)o1 ZINC000628287768 346921874 /nfs/dbraw/zinc/92/18/74/346921874.db2.gz MWLJVRTXKNGDSI-LLVKDONJSA-N 1 1 236.359 3.563 20 0 BHADMO CCCC[C@H](C)[N@@H+](C)Cc1cnc(C2CC2)o1 ZINC000628287769 346921913 /nfs/dbraw/zinc/92/19/13/346921913.db2.gz MWLJVRTXKNGDSI-NSHDSACASA-N 1 1 236.359 3.563 20 0 BHADMO CC[C@@H]1CC[N@H+]1Cc1csc(C(F)(F)F)c1 ZINC000628293114 347117137 /nfs/dbraw/zinc/11/71/37/347117137.db2.gz MGKRURFBTBKNIM-SECBINFHSA-N 1 1 249.301 3.751 20 0 BHADMO CC[C@@H]1CC[N@@H+]1Cc1csc(C(F)(F)F)c1 ZINC000628293114 347117134 /nfs/dbraw/zinc/11/71/34/347117134.db2.gz MGKRURFBTBKNIM-SECBINFHSA-N 1 1 249.301 3.751 20 0 BHADMO CC[C@H]1CC[N@H+]1Cc1csc(C(F)(F)F)c1 ZINC000628293115 347117587 /nfs/dbraw/zinc/11/75/87/347117587.db2.gz MGKRURFBTBKNIM-VIFPVBQESA-N 1 1 249.301 3.751 20 0 BHADMO CC[C@H]1CC[N@@H+]1Cc1csc(C(F)(F)F)c1 ZINC000628293115 347117585 /nfs/dbraw/zinc/11/75/85/347117585.db2.gz MGKRURFBTBKNIM-VIFPVBQESA-N 1 1 249.301 3.751 20 0 BHADMO CC[C@@H]1CC[C@H](C)[N@@H+](Cc2cnc(C3CC3)o2)C1 ZINC000628302969 349258173 /nfs/dbraw/zinc/25/81/73/349258173.db2.gz YYTBAILMANKHQP-NWDGAFQWSA-N 1 1 248.370 3.563 20 0 BHADMO C[N@@H+](Cc1ccc2[nH]ccc2c1)C1CC(C)(C)C1 ZINC000628308799 350784164 /nfs/dbraw/zinc/78/41/64/350784164.db2.gz LPLRWLUKICVOLW-UHFFFAOYSA-N 1 1 242.366 3.788 20 0 BHADMO CC[N@@H+](Cc1cnc(C2CC2)o1)C1CC(C)(C)C1 ZINC000628312384 350813460 /nfs/dbraw/zinc/81/34/60/350813460.db2.gz ZLURWOJYWMJTSP-UHFFFAOYSA-N 1 1 248.370 3.563 20 0 BHADMO C[C@@]1(C[N@H+]2CC[C@@H]3CCCC[C@@H]32)CCCS1 ZINC000628321452 351183921 /nfs/dbraw/zinc/18/39/21/351183921.db2.gz INCJIZUIJQCJJG-IHRRRGAJSA-N 1 1 239.428 3.537 20 0 BHADMO C[C@]1(C[N@H+]2CC[C@@H]3CCCC[C@@H]32)CCCS1 ZINC000628321453 351183562 /nfs/dbraw/zinc/18/35/62/351183562.db2.gz INCJIZUIJQCJJG-MELADBBJSA-N 1 1 239.428 3.537 20 0 BHADMO c1cc2cc(C[N@H+]3CCC34CCCC4)ccc2[nH]1 ZINC000628323363 351224822 /nfs/dbraw/zinc/22/48/22/351224822.db2.gz PEKLIPZGYPVWGR-UHFFFAOYSA-N 1 1 240.350 3.686 20 0 BHADMO CCC[N@@H+](Cc1ccc2[nH]ccc2c1)C(C)C ZINC000628327139 351263545 /nfs/dbraw/zinc/26/35/45/351263545.db2.gz KATSXRGECCYMEX-UHFFFAOYSA-N 1 1 230.355 3.788 20 0 BHADMO c1cc2ccc(C[N@H+]3C[C@@H]4CCCC[C@@H]43)cc2[nH]1 ZINC000628328569 351266719 /nfs/dbraw/zinc/26/67/19/351266719.db2.gz QCBYIDQFTZDZRW-HOCLYGCPSA-N 1 1 240.350 3.542 20 0 BHADMO c1cc2cc(C[N@H+]3C[C@@H]4CCCC[C@@H]43)ccc2[nH]1 ZINC000628328758 351267282 /nfs/dbraw/zinc/26/72/82/351267282.db2.gz UZXBETSIAODPLX-HOCLYGCPSA-N 1 1 240.350 3.542 20 0 BHADMO Cc1ncc(C[N@H+]2CCC[C@H]2CC2CCCC2)o1 ZINC000628328898 351267643 /nfs/dbraw/zinc/26/76/43/351267643.db2.gz YQRFJFSKODOETN-AWEZNQCLSA-N 1 1 248.370 3.528 20 0 BHADMO Cc1ncc(C[N@H+]2CCC[C@@H]2CC2CCCC2)o1 ZINC000628328899 351267708 /nfs/dbraw/zinc/26/77/08/351267708.db2.gz YQRFJFSKODOETN-CQSZACIVSA-N 1 1 248.370 3.528 20 0 BHADMO Cc1ncc(C[N@H+]2CCCC3(CCCC3)CC2)o1 ZINC000628337959 351281123 /nfs/dbraw/zinc/28/11/23/351281123.db2.gz VYBPYLYMEJZEKI-UHFFFAOYSA-N 1 1 248.370 3.529 20 0 BHADMO CCC(CC)CCC[N@@H+](C)Cc1cnc(C)o1 ZINC000628352155 351314303 /nfs/dbraw/zinc/31/43/03/351314303.db2.gz YKYVZFDCQHQPTA-UHFFFAOYSA-N 1 1 238.375 3.631 20 0 BHADMO C[C@H](CCc1ccco1)n1c[nH+]c2c1CCCC2 ZINC000628371374 355891480 /nfs/dbraw/zinc/89/14/80/355891480.db2.gz BMDWWTVNZPKPOV-GFCCVEGCSA-N 1 1 244.338 3.549 20 0 BHADMO C[C@@H](CCc1ccco1)n1c[nH+]c2c1CCCC2 ZINC000628371375 355891546 /nfs/dbraw/zinc/89/15/46/355891546.db2.gz BMDWWTVNZPKPOV-LBPRGKRZSA-N 1 1 244.338 3.549 20 0 BHADMO C[C@H](CC1CCC1)n1c[nH+]c2c1CCCC2 ZINC000628371392 355891644 /nfs/dbraw/zinc/89/16/44/355891644.db2.gz CFPNHBQIFNJQNT-LLVKDONJSA-N 1 1 218.344 3.513 20 0 BHADMO C[C@@H](CC1CCC1)n1c[nH+]c2c1CCCC2 ZINC000628371393 355891588 /nfs/dbraw/zinc/89/15/88/355891588.db2.gz CFPNHBQIFNJQNT-NSHDSACASA-N 1 1 218.344 3.513 20 0 BHADMO C[C@H](CCC(F)(F)F)n1c[nH+]c2c1CCCC2 ZINC000628371429 355892362 /nfs/dbraw/zinc/89/23/62/355892362.db2.gz FKBJPNSXFINIKY-SECBINFHSA-N 1 1 246.276 3.665 20 0 BHADMO C[C@@H](CCC(F)(F)F)n1c[nH+]c2c1CCCC2 ZINC000628371430 355892439 /nfs/dbraw/zinc/89/24/39/355892439.db2.gz FKBJPNSXFINIKY-VIFPVBQESA-N 1 1 246.276 3.665 20 0 BHADMO CCCC[C@@H](C)n1c[nH+]c2c1CCCC2 ZINC000628371432 355892512 /nfs/dbraw/zinc/89/25/12/355892512.db2.gz FNWFORTUTIXQIP-LLVKDONJSA-N 1 1 206.333 3.513 20 0 BHADMO CCCC[C@H](C)n1c[nH+]c2c1CCCC2 ZINC000628371433 355892625 /nfs/dbraw/zinc/89/26/25/355892625.db2.gz FNWFORTUTIXQIP-NSHDSACASA-N 1 1 206.333 3.513 20 0 BHADMO C[C@H](Cc1cccs1)n1c[nH+]c2c1CCCC2 ZINC000628371459 355893985 /nfs/dbraw/zinc/89/39/85/355893985.db2.gz HUGAUVIWYVODJP-LLVKDONJSA-N 1 1 246.379 3.627 20 0 BHADMO C[C@@H](Cc1cccs1)n1c[nH+]c2c1CCCC2 ZINC000628371460 355894100 /nfs/dbraw/zinc/89/41/00/355894100.db2.gz HUGAUVIWYVODJP-NSHDSACASA-N 1 1 246.379 3.627 20 0 BHADMO CC(C)CC[C@@H](C)n1c[nH+]c2c1CCCC2 ZINC000628371489 355894090 /nfs/dbraw/zinc/89/40/90/355894090.db2.gz JCWZUFFTDLVMTO-GFCCVEGCSA-N 1 1 220.360 3.759 20 0 BHADMO CC(C)CC[C@H](C)n1c[nH+]c2c1CCCC2 ZINC000628371490 355893186 /nfs/dbraw/zinc/89/31/86/355893186.db2.gz JCWZUFFTDLVMTO-LBPRGKRZSA-N 1 1 220.360 3.759 20 0 BHADMO C[C@H](Cc1ccsc1)n1c[nH+]c2c1CCCC2 ZINC000628371552 355895153 /nfs/dbraw/zinc/89/51/53/355895153.db2.gz NBNCGQJVZOEAAX-LLVKDONJSA-N 1 1 246.379 3.627 20 0 BHADMO C[C@@H](Cc1ccsc1)n1c[nH+]c2c1CCCC2 ZINC000628371553 355896252 /nfs/dbraw/zinc/89/62/52/355896252.db2.gz NBNCGQJVZOEAAX-NSHDSACASA-N 1 1 246.379 3.627 20 0 BHADMO C[C@H](CCC1CC1)n1c[nH+]c2c1CCCC2 ZINC000628371586 355912581 /nfs/dbraw/zinc/91/25/81/355912581.db2.gz QATFLOAGJWCCHE-LLVKDONJSA-N 1 1 218.344 3.513 20 0 BHADMO C[C@@H](CCC1CC1)n1c[nH+]c2c1CCCC2 ZINC000628371587 355913144 /nfs/dbraw/zinc/91/31/44/355913144.db2.gz QATFLOAGJWCCHE-NSHDSACASA-N 1 1 218.344 3.513 20 0 BHADMO c1[nH+]c2c(n1C1CCC3(CC3)CC1)CCCC2 ZINC000628371816 356018867 /nfs/dbraw/zinc/01/88/67/356018867.db2.gz HSDROINHYCWRBV-UHFFFAOYSA-N 1 1 230.355 3.657 20 0 BHADMO FC1(F)CCC(n2c[nH+]c3c2CCCC3)CC1 ZINC000628371833 356018774 /nfs/dbraw/zinc/01/87/74/356018774.db2.gz JASBRLURKKKIKQ-UHFFFAOYSA-N 1 1 240.297 3.512 20 0 BHADMO C[C@H](C1CCCC1)n1c[nH+]c2c1CCCC2 ZINC000628372018 356037365 /nfs/dbraw/zinc/03/73/65/356037365.db2.gz UWAADKVBYXZEAL-LLVKDONJSA-N 1 1 218.344 3.513 20 0 BHADMO C[C@@H](C1CCCC1)n1c[nH+]c2c1CCCC2 ZINC000628372019 356036995 /nfs/dbraw/zinc/03/69/95/356036995.db2.gz UWAADKVBYXZEAL-NSHDSACASA-N 1 1 218.344 3.513 20 0 BHADMO c1[nH+]c2c(n1[C@@H]1CC[C@H]1C1CCC1)CCCC2 ZINC000628372036 356029474 /nfs/dbraw/zinc/02/94/74/356029474.db2.gz WNUXPUINBVBOES-GXTWGEPZSA-N 1 1 230.355 3.513 20 0 BHADMO c1[nH+]c2c(n1[C@H]1CC[C@H]1C1CCC1)CCCC2 ZINC000628372037 356029853 /nfs/dbraw/zinc/02/98/53/356029853.db2.gz WNUXPUINBVBOES-JSGCOSHPSA-N 1 1 230.355 3.513 20 0 BHADMO c1[nH+]c2c(n1[C@H]1CC[C@@H]1C1CCC1)CCCC2 ZINC000628372038 356029583 /nfs/dbraw/zinc/02/95/83/356029583.db2.gz WNUXPUINBVBOES-OCCSQVGLSA-N 1 1 230.355 3.513 20 0 BHADMO c1[nH+]c2c(n1[C@@H]1CC[C@@H]1C1CCC1)CCCC2 ZINC000628372039 356030138 /nfs/dbraw/zinc/03/01/38/356030138.db2.gz WNUXPUINBVBOES-TZMCWYRMSA-N 1 1 230.355 3.513 20 0 BHADMO C[C@@H]1C[N@H+](C[C@@H]2CC=CCC2)C[C@H](C)C1(F)F ZINC000628391330 357187119 /nfs/dbraw/zinc/18/71/19/357187119.db2.gz XPNUWSBGTLXUOZ-FRRDWIJNSA-N 1 1 243.341 3.566 20 0 BHADMO C[C@@H]1C[N@H+](C[C@H]2CC=CCC2)C[C@H](C)C1(F)F ZINC000628391333 357187095 /nfs/dbraw/zinc/18/70/95/357187095.db2.gz XPNUWSBGTLXUOZ-XQQFMLRXSA-N 1 1 243.341 3.566 20 0 BHADMO Cc1cc2cc(C[N@H+]3C[C@@H]4C[C@@H]4C3)oc2cc1C ZINC000628408437 357204775 /nfs/dbraw/zinc/20/47/75/357204775.db2.gz ACDOIRVJHKVKNI-OKILXGFUSA-N 1 1 241.334 3.501 20 0 BHADMO Clc1oc2ccccc2c1C[N@H+]1C[C@@H]2C[C@@H]2C1 ZINC000628410753 357217234 /nfs/dbraw/zinc/21/72/34/357217234.db2.gz REUHFUCLWFQMDF-AOOOYVTPSA-N 1 1 247.725 3.538 20 0 BHADMO CCC[C@@H](C)C[N@H+]1CCCC(F)(F)CC1 ZINC000628422082 357244545 /nfs/dbraw/zinc/24/45/45/357244545.db2.gz LTIKZVSAXHKXMR-LLVKDONJSA-N 1 1 219.319 3.544 20 0 BHADMO CCC[C@H](C)C[N@H+]1CCCC(F)(F)CC1 ZINC000628422083 357244109 /nfs/dbraw/zinc/24/41/09/357244109.db2.gz LTIKZVSAXHKXMR-NSHDSACASA-N 1 1 219.319 3.544 20 0 BHADMO Cc1ccsc1C[N@H+]1CCCC(F)(F)CC1 ZINC000628422286 357243197 /nfs/dbraw/zinc/24/31/97/357243197.db2.gz VWPRLXMTODICQU-UHFFFAOYSA-N 1 1 245.338 3.678 20 0 BHADMO FC1(F)CCC[N@@H+](Cc2ccc(Cl)o2)CC1 ZINC000628422342 357242961 /nfs/dbraw/zinc/24/29/61/357242961.db2.gz YIJKUTIIBUDREC-UHFFFAOYSA-N 1 1 249.688 3.554 20 0 BHADMO FC1(F)CCC[N@H+](Cc2ccc(Cl)o2)CC1 ZINC000628422342 357242958 /nfs/dbraw/zinc/24/29/58/357242958.db2.gz YIJKUTIIBUDREC-UHFFFAOYSA-N 1 1 249.688 3.554 20 0 BHADMO Cc1ccc(C[N@H+]2CCCC(F)(F)CC2)s1 ZINC000628422372 357243179 /nfs/dbraw/zinc/24/31/79/357243179.db2.gz ZZDKCXQPOWDRRN-UHFFFAOYSA-N 1 1 245.338 3.678 20 0 BHADMO Cc1sccc1C[N@H+]1CCCC(F)(F)CC1 ZINC000628422502 357245468 /nfs/dbraw/zinc/24/54/68/357245468.db2.gz PFZDWVVBSFXKQJ-UHFFFAOYSA-N 1 1 245.338 3.678 20 0 BHADMO CCCC[C@H](CC)CC[N@@H+](C)CC1(C)COC1 ZINC000628424052 357249699 /nfs/dbraw/zinc/24/96/99/357249699.db2.gz VYYUIBUGSKWLRR-AWEZNQCLSA-N 1 1 241.419 3.561 20 0 BHADMO CCCC[C@@H](CC)CC[N@@H+](C)CC1(C)COC1 ZINC000628424053 357249855 /nfs/dbraw/zinc/24/98/55/357249855.db2.gz VYYUIBUGSKWLRR-CQSZACIVSA-N 1 1 241.419 3.561 20 0 BHADMO CCC(F)(F)C[NH2+]CCc1cccc(Cl)c1 ZINC000628435245 357997623 /nfs/dbraw/zinc/99/76/23/357997623.db2.gz DFHVVGAXDFJQMT-UHFFFAOYSA-N 1 1 247.716 3.517 20 0 BHADMO CCC(F)(F)C[NH2+]CC[C@@H](C)c1ccccc1 ZINC000628435257 357997614 /nfs/dbraw/zinc/99/76/14/357997614.db2.gz DUOKHBZNUFRNAO-GFCCVEGCSA-N 1 1 241.325 3.815 20 0 BHADMO CCC(F)(F)C[NH2+]CC[C@H](C)c1ccccc1 ZINC000628435258 357997604 /nfs/dbraw/zinc/99/76/04/357997604.db2.gz DUOKHBZNUFRNAO-LBPRGKRZSA-N 1 1 241.325 3.815 20 0 BHADMO CCC(F)(F)C[NH2+]CCc1ccc(Cl)cc1 ZINC000628435617 357997758 /nfs/dbraw/zinc/99/77/58/357997758.db2.gz SLPBAFYQMJQEJM-UHFFFAOYSA-N 1 1 247.716 3.517 20 0 BHADMO C[C@]1(C[N@H+]2CCCC3(CC3)CC2)CCCS1 ZINC000628480345 359318023 /nfs/dbraw/zinc/31/80/23/359318023.db2.gz SFKPYZIJPCNGJT-CYBMUJFWSA-N 1 1 239.428 3.538 20 0 BHADMO C[C@@]1(C[N@H+]2CCCC3(CC3)CC2)CCCS1 ZINC000628480346 359318192 /nfs/dbraw/zinc/31/81/92/359318192.db2.gz SFKPYZIJPCNGJT-ZDUSSCGKSA-N 1 1 239.428 3.538 20 0 BHADMO CCC[C@@H](C)CCCO[C@H](C)Cc1[nH]cc[nH+]1 ZINC000629166423 360915618 /nfs/dbraw/zinc/91/56/18/360915618.db2.gz SZDWEKYBHNOUCE-CHWSQXEVSA-N 1 1 238.375 3.574 20 0 BHADMO CCC[C@@H](C)CCCO[C@@H](C)Cc1[nH]cc[nH+]1 ZINC000629166427 360915566 /nfs/dbraw/zinc/91/55/66/360915566.db2.gz SZDWEKYBHNOUCE-OLZOCXBDSA-N 1 1 238.375 3.574 20 0 BHADMO CCC[C@H](C)CCCO[C@H](C)Cc1[nH]cc[nH+]1 ZINC000629166428 360915551 /nfs/dbraw/zinc/91/55/51/360915551.db2.gz SZDWEKYBHNOUCE-QWHCGFSZSA-N 1 1 238.375 3.574 20 0 BHADMO CCC[C@H](C)CCCO[C@@H](C)Cc1[nH]cc[nH+]1 ZINC000629166430 360915269 /nfs/dbraw/zinc/91/52/69/360915269.db2.gz SZDWEKYBHNOUCE-STQMWFEESA-N 1 1 238.375 3.574 20 0 BHADMO Cc1ccc(Cn2cc[nH+]c2C(C)C)cc1F ZINC000629170761 360918862 /nfs/dbraw/zinc/91/88/62/360918862.db2.gz VLWOTEFPXFLJBN-UHFFFAOYSA-N 1 1 232.302 3.502 20 0 BHADMO CC(C)c1cccc(Cn2cc[nH+]c2C2CC2)c1 ZINC000629258796 360979787 /nfs/dbraw/zinc/97/97/87/360979787.db2.gz CGYPVFJFPMRKRE-UHFFFAOYSA-N 1 1 240.350 3.932 20 0 BHADMO CC(C)(CCn1cc[nH+]c1C1CC1)C1CC1 ZINC000629259486 360980296 /nfs/dbraw/zinc/98/02/96/360980296.db2.gz PCLZFSYCYIUIMF-UHFFFAOYSA-N 1 1 218.344 3.587 20 0 BHADMO Clc1sccc1Cn1cc[nH+]c1C1CC1 ZINC000629259728 360979519 /nfs/dbraw/zinc/97/95/19/360979519.db2.gz URYBLQFLEQEUHW-UHFFFAOYSA-N 1 1 238.743 3.524 20 0 BHADMO CSc1cccc(Cn2cc[nH+]c2C2CC2)c1 ZINC000629259856 360981710 /nfs/dbraw/zinc/98/17/10/360981710.db2.gz ZDPWMIUCZQUNQO-UHFFFAOYSA-N 1 1 244.363 3.531 20 0 BHADMO c1cn(CCSc2ccccc2)c(C2CC2)[nH+]1 ZINC000629260224 360982368 /nfs/dbraw/zinc/98/23/68/360982368.db2.gz KSZPLOYTWASWHP-UHFFFAOYSA-N 1 1 244.363 3.553 20 0 BHADMO CSc1ccccc1Cn1cc[nH+]c1C1CC1 ZINC000629260263 360982501 /nfs/dbraw/zinc/98/25/01/360982501.db2.gz NCCCFIFSIMEARM-UHFFFAOYSA-N 1 1 244.363 3.531 20 0 BHADMO CSc1ccc(Cn2cc[nH+]c2C2CC2)cc1 ZINC000629262540 490252687 /nfs/dbraw/zinc/25/26/87/490252687.db2.gz MNAKMRRPPSMPDS-UHFFFAOYSA-N 1 1 244.363 3.531 20 0 BHADMO CCC[C@@H](C)C[NH2+]c1ccc(NC)cc1 ZINC000629388430 361041224 /nfs/dbraw/zinc/04/12/24/361041224.db2.gz ARMDYBQWGHRPLX-LLVKDONJSA-N 1 1 206.333 3.576 20 0 BHADMO CCC[C@H](C)C[NH2+]c1ccc(NC)cc1 ZINC000629388431 361041121 /nfs/dbraw/zinc/04/11/21/361041121.db2.gz ARMDYBQWGHRPLX-NSHDSACASA-N 1 1 206.333 3.576 20 0 BHADMO CNc1ccc([NH2+]CC2CCCCC2)cc1 ZINC000629389026 361035562 /nfs/dbraw/zinc/03/55/62/361035562.db2.gz IBZNPSNAKJAKQN-UHFFFAOYSA-N 1 1 218.344 3.721 20 0 BHADMO CCC(CC)C[NH2+]c1ccc(NC)cc1 ZINC000629389583 361036696 /nfs/dbraw/zinc/03/66/96/361036696.db2.gz OJMIRTBOLGSKNH-UHFFFAOYSA-N 1 1 206.333 3.576 20 0 BHADMO CNc1ccc([NH2+]C[C@@H](C)C(C)(C)C)cc1 ZINC000629653302 361552831 /nfs/dbraw/zinc/55/28/31/361552831.db2.gz KIITZKJQIWXOND-LLVKDONJSA-N 1 1 220.360 3.822 20 0 BHADMO CNc1ccc([NH2+]C[C@H](C)C(C)(C)C)cc1 ZINC000629653594 361552642 /nfs/dbraw/zinc/55/26/42/361552642.db2.gz KIITZKJQIWXOND-NSHDSACASA-N 1 1 220.360 3.822 20 0 BHADMO CNc1ccc([NH2+]CCC(C)(C)C)cc1 ZINC000629654344 361557582 /nfs/dbraw/zinc/55/75/82/361557582.db2.gz HSNBJVKMFPJKTF-UHFFFAOYSA-N 1 1 206.333 3.576 20 0 BHADMO Cc1cc(N)[nH+]cc1-c1cccc(C(C)C)c1 ZINC000629692558 361620255 /nfs/dbraw/zinc/62/02/55/361620255.db2.gz PABMMYADIIIYCJ-UHFFFAOYSA-N 1 1 226.323 3.593 20 0 BHADMO Cc1[nH+]c(N)ccc1-c1cccc(C(C)C)c1 ZINC000629693039 361621058 /nfs/dbraw/zinc/62/10/58/361621058.db2.gz YPLLIAHCYKUBAG-UHFFFAOYSA-N 1 1 226.323 3.593 20 0 BHADMO CC(C)CC[N@@H+](C)[C@H]1CCc2ccccc21 ZINC000630033298 361907924 /nfs/dbraw/zinc/90/79/24/361907924.db2.gz UMARGKAEKTXQAN-HNNXBMFYSA-N 1 1 217.356 3.652 20 0 BHADMO CC(C)CC[N@@H+](C)[C@@H]1CCc2ccccc21 ZINC000630033299 361908065 /nfs/dbraw/zinc/90/80/65/361908065.db2.gz UMARGKAEKTXQAN-OAHLLOKOSA-N 1 1 217.356 3.652 20 0 BHADMO Cc1[nH+]cc(-c2cccc(C(C)C)c2)n1C ZINC000630049643 361912571 /nfs/dbraw/zinc/91/25/71/361912571.db2.gz HDNZWKAKJXDUMB-UHFFFAOYSA-N 1 1 214.312 3.519 20 0 BHADMO CSc1ccc(-c2c[nH+]c3n2CCCC3)cc1 ZINC000630050483 361913596 /nfs/dbraw/zinc/91/35/96/361913596.db2.gz QXNPJPREIJAKPA-UHFFFAOYSA-N 1 1 244.363 3.608 20 0 BHADMO Cc1[nH+]cc(-c2ccc(C3CCC3)cc2)n1C ZINC000630050550 361913553 /nfs/dbraw/zinc/91/35/53/361913553.db2.gz HKQOVFVDFKHKPF-UHFFFAOYSA-N 1 1 226.323 3.663 20 0 BHADMO Cc1ccc(-c2c[nH+]c3n2CCCC3)cc1C ZINC000630051741 361920169 /nfs/dbraw/zinc/92/01/69/361920169.db2.gz DAJYUZDMFWIXBJ-UHFFFAOYSA-N 1 1 226.323 3.503 20 0 BHADMO Cc1ccc(C)c(-c2c[nH+]c3n2CCCC3)c1 ZINC000630052517 361921301 /nfs/dbraw/zinc/92/13/01/361921301.db2.gz WCCBHVCPRCYLSR-UHFFFAOYSA-N 1 1 226.323 3.503 20 0 BHADMO Cc1[nH+]cc(-c2cccc(C3CCC3)c2)n1C ZINC000630052567 361921135 /nfs/dbraw/zinc/92/11/35/361921135.db2.gz MCMBTATVVZKODK-UHFFFAOYSA-N 1 1 226.323 3.663 20 0 BHADMO Cc1[nH+]cc(-c2ccc(OC(C)(C)C)cc2)n1C ZINC000630052981 361922087 /nfs/dbraw/zinc/92/20/87/361922087.db2.gz ZGRHVIJPJVSEHR-UHFFFAOYSA-N 1 1 244.338 3.573 20 0 BHADMO C[N@@H+](Cc1cc(Cl)cc(Cl)c1F)C1CC1 ZINC000630055875 362916386 /nfs/dbraw/zinc/91/63/86/362916386.db2.gz RNHRRAHJMQAGCH-UHFFFAOYSA-N 1 1 248.128 3.727 20 0 BHADMO C[N@H+](Cc1cc(Cl)cc(Cl)c1F)C1CC1 ZINC000630055875 362916381 /nfs/dbraw/zinc/91/63/81/362916381.db2.gz RNHRRAHJMQAGCH-UHFFFAOYSA-N 1 1 248.128 3.727 20 0 BHADMO Cc1scc(C[N@@H+](C)C[C@H]2CC2(C)C)c1C ZINC000630072629 363155823 /nfs/dbraw/zinc/15/58/23/363155823.db2.gz HKTLOWSMLGIXDX-CYBMUJFWSA-N 1 1 237.412 3.843 20 0 BHADMO Cc1scc(C[N@@H+](C)C[C@@H]2CC2(C)C)c1C ZINC000630072635 363155998 /nfs/dbraw/zinc/15/59/98/363155998.db2.gz HKTLOWSMLGIXDX-ZDUSSCGKSA-N 1 1 237.412 3.843 20 0 BHADMO Cc1scc(C[N@H+](C)C(C)(C)C)c1C ZINC000630072644 363155909 /nfs/dbraw/zinc/15/59/09/363155909.db2.gz TZGWKQNZLHDUGM-UHFFFAOYSA-N 1 1 211.374 3.595 20 0 BHADMO Cc1cc[nH+]c(N2Cc3ccc(Cl)cc3C2)c1 ZINC000630343408 364066011 /nfs/dbraw/zinc/06/60/11/364066011.db2.gz MRLBSBJGJYVGDX-UHFFFAOYSA-N 1 1 244.725 3.564 20 0 BHADMO Fc1ccc2c(c1)CC[N@H+](CCC1CCCC1)C2 ZINC000630343909 364068471 /nfs/dbraw/zinc/06/84/71/364068471.db2.gz XGIASCDIEWCIHX-UHFFFAOYSA-N 1 1 247.357 3.764 20 0 BHADMO Cc1cc(NC(C)(C)CC(C)(C)C)nc(C)[nH+]1 ZINC000630343913 364068709 /nfs/dbraw/zinc/06/87/09/364068709.db2.gz YEUMIIHYYBAPKC-UHFFFAOYSA-N 1 1 235.375 3.720 20 0 BHADMO Cc1cc(C)c(CSc2ccccn2)c(C)[nH+]1 ZINC000630999854 369493415 /nfs/dbraw/zinc/49/34/15/369493415.db2.gz FYBXROJDYXURAQ-UHFFFAOYSA-N 1 1 244.363 3.694 20 0 BHADMO Cc1cc(C)c(CSc2ccncc2)c(C)[nH+]1 ZINC000631010781 370877686 /nfs/dbraw/zinc/87/76/86/370877686.db2.gz KDGPMPRUEQWFBG-UHFFFAOYSA-N 1 1 244.363 3.694 20 0 BHADMO Cc1cn(Cc2cccc(C(C)C)c2)c(C)[nH+]1 ZINC000631012362 370890283 /nfs/dbraw/zinc/89/02/83/370890283.db2.gz KRPUASVERHYYRH-UHFFFAOYSA-N 1 1 228.339 3.672 20 0 BHADMO Cc1cn(CC/C=C\c2ccccc2)c(C)[nH+]1 ZINC000631014400 370889849 /nfs/dbraw/zinc/88/98/49/370889849.db2.gz RPJAWPDQGQAKQQ-POHAHGRESA-N 1 1 226.323 3.603 20 0 BHADMO Cc1cn(CC/C=C/c2ccccc2)c(C)[nH+]1 ZINC000631014405 370890178 /nfs/dbraw/zinc/89/01/78/370890178.db2.gz RPJAWPDQGQAKQQ-UXBLZVDNSA-N 1 1 226.323 3.603 20 0 BHADMO Cc1cn(Cc2c(C)cccc2Cl)c(C)[nH+]1 ZINC000631014481 370894201 /nfs/dbraw/zinc/89/42/01/370894201.db2.gz STSXQHXTIHOUBF-UHFFFAOYSA-N 1 1 234.730 3.510 20 0 BHADMO Cc1coc(SCc2c(C)cc(C)[nH+]c2C)n1 ZINC000631016510 370901392 /nfs/dbraw/zinc/90/13/92/370901392.db2.gz NAOBJNWPCUGQLA-UHFFFAOYSA-N 1 1 248.351 3.596 20 0 BHADMO C[C@H](CF)[NH2+]Cc1oc2ccccc2c1Cl ZINC000631136500 372205399 /nfs/dbraw/zinc/20/53/99/372205399.db2.gz NGKISCZHGQIXAF-MRVPVSSYSA-N 1 1 241.693 3.534 20 0 BHADMO C[C@@H](CF)[NH2+]Cc1oc2ccccc2c1Cl ZINC000631136501 372205107 /nfs/dbraw/zinc/20/51/07/372205107.db2.gz NGKISCZHGQIXAF-QMMMGPOBSA-N 1 1 241.693 3.534 20 0 BHADMO CCc1cccc(F)c1C[NH2+]Cc1ccc(C)o1 ZINC000631243016 372256988 /nfs/dbraw/zinc/25/69/88/372256988.db2.gz PQSCSJUKAIMHTC-UHFFFAOYSA-N 1 1 247.313 3.579 20 0 BHADMO Cc1ccc(C[NH2+]Cc2cscc2Cl)o1 ZINC000631243470 351326402 /nfs/dbraw/zinc/32/64/02/351326402.db2.gz JNQHPPCZJKEGGI-UHFFFAOYSA-N 1 1 241.743 3.593 20 0 BHADMO CCC[C@H]([NH2+]Cc1ccco1)c1cc(C)ccn1 ZINC000631562591 372426399 /nfs/dbraw/zinc/42/63/99/372426399.db2.gz YYYOABOCXLBWML-AWEZNQCLSA-N 1 1 244.338 3.614 20 0 BHADMO CCC[C@@H]([NH2+]Cc1ccco1)c1cc(C)ccn1 ZINC000631562593 372426136 /nfs/dbraw/zinc/42/61/36/372426136.db2.gz YYYOABOCXLBWML-CQSZACIVSA-N 1 1 244.338 3.614 20 0 BHADMO CCC[C@H]([NH2+]Cc1ccoc1)c1cc(C)ccn1 ZINC000631572866 361076597 /nfs/dbraw/zinc/07/65/97/361076597.db2.gz ULDKYUYQCZFSBN-AWEZNQCLSA-N 1 1 244.338 3.614 20 0 BHADMO CCC[C@@H]([NH2+]Cc1ccoc1)c1cc(C)ccn1 ZINC000631572867 361076166 /nfs/dbraw/zinc/07/61/66/361076166.db2.gz ULDKYUYQCZFSBN-CQSZACIVSA-N 1 1 244.338 3.614 20 0 BHADMO CC(C)c1nc([C@@H](C)[NH2+]CC(C)(C)F)cs1 ZINC000631663826 372489676 /nfs/dbraw/zinc/48/96/76/372489676.db2.gz PTBLYCGCJYXTRH-SECBINFHSA-N 1 1 244.379 3.665 20 0 BHADMO CC(C)c1nc([C@H](C)[NH2+]CC(C)(C)F)cs1 ZINC000631663827 372489633 /nfs/dbraw/zinc/48/96/33/372489633.db2.gz PTBLYCGCJYXTRH-VIFPVBQESA-N 1 1 244.379 3.665 20 0 BHADMO CCc1ccc([C@@H](C)[NH2+]Cc2ccc(C)o2)o1 ZINC000631727503 372523532 /nfs/dbraw/zinc/52/35/32/372523532.db2.gz CFKZPSUNDKMTLB-LLVKDONJSA-N 1 1 233.311 3.594 20 0 BHADMO CCc1ccc([C@H](C)[NH2+]Cc2ccc(C)o2)o1 ZINC000631727504 372523563 /nfs/dbraw/zinc/52/35/63/372523563.db2.gz CFKZPSUNDKMTLB-NSHDSACASA-N 1 1 233.311 3.594 20 0 BHADMO Cc1ccc(C[NH2+][C@H](C)c2cc(C)c(C)o2)o1 ZINC000631730561 372535136 /nfs/dbraw/zinc/53/51/36/372535136.db2.gz XMQXBGSYZXBPHD-LLVKDONJSA-N 1 1 233.311 3.649 20 0 BHADMO Cc1ccc(C[NH2+][C@@H](C)c2cc(C)c(C)o2)o1 ZINC000631730562 372535055 /nfs/dbraw/zinc/53/50/55/372535055.db2.gz XMQXBGSYZXBPHD-NSHDSACASA-N 1 1 233.311 3.649 20 0 BHADMO Cc1cc(C)c(CNc2cccc(F)c2)c(C)[nH+]1 ZINC000634560957 362049906 /nfs/dbraw/zinc/04/99/06/362049906.db2.gz FIJVIWQXSMSUKN-UHFFFAOYSA-N 1 1 244.313 3.758 20 0 BHADMO Cc1cc(C)c(CNc2ccc(F)cc2)c(C)[nH+]1 ZINC000634561109 362050469 /nfs/dbraw/zinc/05/04/69/362050469.db2.gz MKRRZFOOSVVMMP-UHFFFAOYSA-N 1 1 244.313 3.758 20 0 BHADMO Cc1cc(C)c(CNc2ccccc2F)c(C)[nH+]1 ZINC000634561170 362049788 /nfs/dbraw/zinc/04/97/88/362049788.db2.gz PBPKEKLTWKNWGD-UHFFFAOYSA-N 1 1 244.313 3.758 20 0 BHADMO Cc1cc(C)c(CNc2ccccc2C)c(C)[nH+]1 ZINC000634561381 374318039 /nfs/dbraw/zinc/31/80/39/374318039.db2.gz ZNIJTUODPYFEGQ-UHFFFAOYSA-N 1 1 240.350 3.927 20 0 BHADMO Cc1cccc(NCc2c(C)cc(C)[nH+]c2C)c1 ZINC000634561415 374318032 /nfs/dbraw/zinc/31/80/32/374318032.db2.gz BEFUQKQRVQNZHD-UHFFFAOYSA-N 1 1 240.350 3.927 20 0 BHADMO Cc1ccc(NCc2c(C)cc(C)[nH+]c2C)cc1 ZINC000634561551 374318518 /nfs/dbraw/zinc/31/85/18/374318518.db2.gz ITPGWQKRAZYLKP-UHFFFAOYSA-N 1 1 240.350 3.927 20 0 BHADMO Cc1cc(C)c(CNc2ccccc2)c(C)[nH+]1 ZINC000634561682 374318298 /nfs/dbraw/zinc/31/82/98/374318298.db2.gz NPMHFKPPEIWZHY-UHFFFAOYSA-N 1 1 226.323 3.619 20 0 BHADMO Fc1cccc(Cl)c1C[NH+]1C2CCC1CC2 ZINC000635900015 346105834 /nfs/dbraw/zinc/10/58/34/346105834.db2.gz UVRBHYOYVPOFHD-UHFFFAOYSA-N 1 1 239.721 3.606 20 0 BHADMO CC(C)C1(C[N@H+]2CCC[C@H]2c2ccc[nH]2)CC1 ZINC000637814221 351658691 /nfs/dbraw/zinc/65/86/91/351658691.db2.gz JKVIQDFHABHKLW-AWEZNQCLSA-N 1 1 232.371 3.588 20 0 BHADMO CC(C)C1(C[N@H+]2CCC[C@@H]2c2ccc[nH]2)CC1 ZINC000637814222 351659084 /nfs/dbraw/zinc/65/90/84/351659084.db2.gz JKVIQDFHABHKLW-CQSZACIVSA-N 1 1 232.371 3.588 20 0 BHADMO c1ccc([C@@H]2CC[N@@H+]2CC2CCSCC2)cc1 ZINC000637814358 351653963 /nfs/dbraw/zinc/65/39/63/351653963.db2.gz ZIIHIRBXHPXORY-HNNXBMFYSA-N 1 1 247.407 3.577 20 0 BHADMO c1ccc([C@H]2CC[N@@H+]2CC2CCSCC2)cc1 ZINC000637814359 351654212 /nfs/dbraw/zinc/65/42/12/351654212.db2.gz ZIIHIRBXHPXORY-OAHLLOKOSA-N 1 1 247.407 3.577 20 0 BHADMO CC(C)[N@@H+](CCC[C@H]1CCO1)C1CCCCC1 ZINC000637841276 351697654 /nfs/dbraw/zinc/69/76/54/351697654.db2.gz NZFZCILJDUHVAJ-HNNXBMFYSA-N 1 1 239.403 3.599 20 0 BHADMO CC(C)[N@@H+](CCC[C@@H]1CCO1)C1CCCCC1 ZINC000637841283 351697147 /nfs/dbraw/zinc/69/71/47/351697147.db2.gz NZFZCILJDUHVAJ-OAHLLOKOSA-N 1 1 239.403 3.599 20 0 BHADMO Cc1cc(C[N@H+](C)[C@H](C)c2ccccc2)sn1 ZINC000637871994 351734998 /nfs/dbraw/zinc/73/49/98/351734998.db2.gz XNVGKMWRJCLNLJ-GFCCVEGCSA-N 1 1 246.379 3.645 20 0 BHADMO Cc1cc(C[N@H+](C)[C@@H](C)c2ccccc2)sn1 ZINC000637871995 351734801 /nfs/dbraw/zinc/73/48/01/351734801.db2.gz XNVGKMWRJCLNLJ-LBPRGKRZSA-N 1 1 246.379 3.645 20 0 BHADMO C(C1CCSCC1)[N@@H+](C1CC1)C1CCCC1 ZINC000637900279 351772348 /nfs/dbraw/zinc/77/23/48/351772348.db2.gz UOOWWMLYJSGJMX-UHFFFAOYSA-N 1 1 239.428 3.537 20 0 BHADMO Cc1ccc([C@@H](C)[N@@H+](C)Cc2ccns2)cc1 ZINC000637901439 351771003 /nfs/dbraw/zinc/77/10/03/351771003.db2.gz LQMIWZBLOZWXQR-GFCCVEGCSA-N 1 1 246.379 3.645 20 0 BHADMO Cc1ccc([C@@H](C)[N@H+](C)Cc2ccns2)cc1 ZINC000637901439 351771000 /nfs/dbraw/zinc/77/10/00/351771000.db2.gz LQMIWZBLOZWXQR-GFCCVEGCSA-N 1 1 246.379 3.645 20 0 BHADMO Cc1ccc([C@H](C)[N@@H+](C)Cc2ccns2)cc1 ZINC000637901440 351771325 /nfs/dbraw/zinc/77/13/25/351771325.db2.gz LQMIWZBLOZWXQR-LBPRGKRZSA-N 1 1 246.379 3.645 20 0 BHADMO Cc1ccc([C@H](C)[N@H+](C)Cc2ccns2)cc1 ZINC000637901440 351771320 /nfs/dbraw/zinc/77/13/20/351771320.db2.gz LQMIWZBLOZWXQR-LBPRGKRZSA-N 1 1 246.379 3.645 20 0 BHADMO Cc1ccccc1[C@@H](C)[N@@H+](C)Cc1ccns1 ZINC000637901902 351771341 /nfs/dbraw/zinc/77/13/41/351771341.db2.gz IZENGMJIQXPCKA-GFCCVEGCSA-N 1 1 246.379 3.645 20 0 BHADMO Cc1ccccc1[C@H](C)[N@@H+](C)Cc1ccns1 ZINC000637901903 351771137 /nfs/dbraw/zinc/77/11/37/351771137.db2.gz IZENGMJIQXPCKA-LBPRGKRZSA-N 1 1 246.379 3.645 20 0 BHADMO Cc1ccc([C@@H](C)[N@@H+](C)CCC[C@@H]2CCO2)cc1 ZINC000637902445 351774676 /nfs/dbraw/zinc/77/46/76/351774676.db2.gz SGXZCWIZIJNIPB-GDBMZVCRSA-N 1 1 247.382 3.557 20 0 BHADMO Cc1ccc([C@H](C)[N@@H+](C)CCC[C@@H]2CCO2)cc1 ZINC000637902446 351774826 /nfs/dbraw/zinc/77/48/26/351774826.db2.gz SGXZCWIZIJNIPB-GOEBONIOSA-N 1 1 247.382 3.557 20 0 BHADMO Cc1ccc([C@H](C)[N@@H+](C)CCC[C@H]2CCO2)cc1 ZINC000637902448 351774821 /nfs/dbraw/zinc/77/48/21/351774821.db2.gz SGXZCWIZIJNIPB-HOCLYGCPSA-N 1 1 247.382 3.557 20 0 BHADMO Cc1ccc([C@@H](C)[N@@H+](C)CCC[C@H]2CCO2)cc1 ZINC000637902449 351774855 /nfs/dbraw/zinc/77/48/55/351774855.db2.gz SGXZCWIZIJNIPB-ZBFHGGJFSA-N 1 1 247.382 3.557 20 0 BHADMO CC[C@@H](c1ccccc1)[N@@H+](C)Cc1ccns1 ZINC000637902871 351775656 /nfs/dbraw/zinc/77/56/56/351775656.db2.gz VYGNJFUZPQEJEO-AWEZNQCLSA-N 1 1 246.379 3.726 20 0 BHADMO CC[C@H](c1ccccc1)[N@@H+](C)Cc1ccns1 ZINC000637902872 351775552 /nfs/dbraw/zinc/77/55/52/351775552.db2.gz VYGNJFUZPQEJEO-CQSZACIVSA-N 1 1 246.379 3.726 20 0 BHADMO CCC[C@H](C)[N@@H+](C)Cc1ccc(C(F)F)nc1 ZINC000637910898 351784746 /nfs/dbraw/zinc/78/47/46/351784746.db2.gz GTWDEZSMTZFCJC-JTQLQIEISA-N 1 1 242.313 3.640 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)Cc1ccc(C(F)F)nc1 ZINC000637910899 351784793 /nfs/dbraw/zinc/78/47/93/351784793.db2.gz GTWDEZSMTZFCJC-SNVBAGLBSA-N 1 1 242.313 3.640 20 0 BHADMO CC(C)C1(C[N@H+]2CCC[C@H]2c2ccccn2)CC1 ZINC000637914037 351788579 /nfs/dbraw/zinc/78/85/79/351788579.db2.gz WAFOTZGRVAFWPD-HNNXBMFYSA-N 1 1 244.382 3.655 20 0 BHADMO CC(C)C1(C[N@H+]2CCC[C@@H]2c2ccccn2)CC1 ZINC000637914038 351788593 /nfs/dbraw/zinc/78/85/93/351788593.db2.gz WAFOTZGRVAFWPD-OAHLLOKOSA-N 1 1 244.382 3.655 20 0 BHADMO CC[C@@](C)(C[N@@H+](C)[C@@H](C)c1cccs1)OC ZINC000637919779 351793590 /nfs/dbraw/zinc/79/35/90/351793590.db2.gz NDRSCKFOIMXNEP-AAEUAGOBSA-N 1 1 241.400 3.556 20 0 BHADMO CC[C@](C)(C[N@@H+](C)[C@H](C)c1cccs1)OC ZINC000637919797 351795244 /nfs/dbraw/zinc/79/52/44/351795244.db2.gz NDRSCKFOIMXNEP-DGCLKSJQSA-N 1 1 241.400 3.556 20 0 BHADMO CC[C@](C)(C[N@@H+](C)[C@@H](C)c1cccs1)OC ZINC000637919802 351794629 /nfs/dbraw/zinc/79/46/29/351794629.db2.gz NDRSCKFOIMXNEP-WCQYABFASA-N 1 1 241.400 3.556 20 0 BHADMO CC[C@@](C)(C[N@@H+](C)[C@H](C)c1cccs1)OC ZINC000637919805 351794600 /nfs/dbraw/zinc/79/46/00/351794600.db2.gz NDRSCKFOIMXNEP-YPMHNXCESA-N 1 1 241.400 3.556 20 0 BHADMO CCC[N@@H+](CC(C)C)[C@H](C)c1cnc(C)nc1C ZINC000637924760 351797543 /nfs/dbraw/zinc/79/75/43/351797543.db2.gz CRRDOSACGCKQDM-CYBMUJFWSA-N 1 1 249.402 3.522 20 0 BHADMO CCC[N@@H+](CC(C)C)[C@@H](C)c1cnc(C)nc1C ZINC000637924761 351797579 /nfs/dbraw/zinc/79/75/79/351797579.db2.gz CRRDOSACGCKQDM-ZDUSSCGKSA-N 1 1 249.402 3.522 20 0 BHADMO CC(C)[N@@H+](Cc1cccc2ncccc12)C1CC1 ZINC000637925239 351798729 /nfs/dbraw/zinc/79/87/29/351798729.db2.gz AMULOYXXJKRGCA-UHFFFAOYSA-N 1 1 240.350 3.608 20 0 BHADMO Cc1ncc([C@@H](C)[N@@H+](C)[C@@H](C)C(C)(C)C)c(C)n1 ZINC000637930430 351806764 /nfs/dbraw/zinc/80/67/64/351806764.db2.gz NMLINBVYACNZJX-NEPJUHHUSA-N 1 1 249.402 3.521 20 0 BHADMO Cc1ncc([C@H](C)[N@@H+](C)[C@H](C)C(C)(C)C)c(C)n1 ZINC000637930431 351807248 /nfs/dbraw/zinc/80/72/48/351807248.db2.gz NMLINBVYACNZJX-NWDGAFQWSA-N 1 1 249.402 3.521 20 0 BHADMO Cc1ncc([C@H](C)[N@@H+](C)[C@@H](C)C(C)(C)C)c(C)n1 ZINC000637930432 351806803 /nfs/dbraw/zinc/80/68/03/351806803.db2.gz NMLINBVYACNZJX-RYUDHWBXSA-N 1 1 249.402 3.521 20 0 BHADMO Cc1ncc([C@@H](C)[N@@H+](C)[C@H](C)C(C)(C)C)c(C)n1 ZINC000637930433 351806895 /nfs/dbraw/zinc/80/68/95/351806895.db2.gz NMLINBVYACNZJX-VXGBXAGGSA-N 1 1 249.402 3.521 20 0 BHADMO Cc1ncc([C@@H](C)[N@@H+](CC(C)C)C(C)C)c(C)n1 ZINC000637944189 351821260 /nfs/dbraw/zinc/82/12/60/351821260.db2.gz YSJUEDCWOZCBKK-CYBMUJFWSA-N 1 1 249.402 3.521 20 0 BHADMO Cc1ncc([C@H](C)[N@@H+](CC(C)C)C(C)C)c(C)n1 ZINC000637944191 351821299 /nfs/dbraw/zinc/82/12/99/351821299.db2.gz YSJUEDCWOZCBKK-ZDUSSCGKSA-N 1 1 249.402 3.521 20 0 BHADMO Cc1cc([C@H]2CCC[N@@H+]2CC2(C(C)C)CC2)on1 ZINC000637948780 351823502 /nfs/dbraw/zinc/82/35/02/351823502.db2.gz REVBFGXGSDBJGA-CYBMUJFWSA-N 1 1 248.370 3.556 20 0 BHADMO Cc1cc([C@@H]2CCC[N@@H+]2CC2(C(C)C)CC2)on1 ZINC000637948781 351823934 /nfs/dbraw/zinc/82/39/34/351823934.db2.gz REVBFGXGSDBJGA-ZDUSSCGKSA-N 1 1 248.370 3.556 20 0 BHADMO Cc1scc(C[N@@H+](C)Cc2ccoc2)c1C ZINC000637965631 351839625 /nfs/dbraw/zinc/83/96/25/351839625.db2.gz LMZHACGBCJGGSM-UHFFFAOYSA-N 1 1 235.352 3.590 20 0 BHADMO CC[N@H+]([C@H](C)c1cnc(C)nc1C)[C@H](C)C(C)C ZINC000637978183 351852194 /nfs/dbraw/zinc/85/21/94/351852194.db2.gz MROJKTVJCGTXPI-CHWSQXEVSA-N 1 1 249.402 3.521 20 0 BHADMO CC[N@@H+]([C@H](C)C(C)C)[C@@H](C)c1cnc(C)nc1C ZINC000637978184 351852361 /nfs/dbraw/zinc/85/23/61/351852361.db2.gz MROJKTVJCGTXPI-OLZOCXBDSA-N 1 1 249.402 3.521 20 0 BHADMO CC[N@H+]([C@H](C)c1cnc(C)nc1C)[C@@H](C)C(C)C ZINC000637978186 351852854 /nfs/dbraw/zinc/85/28/54/351852854.db2.gz MROJKTVJCGTXPI-QWHCGFSZSA-N 1 1 249.402 3.521 20 0 BHADMO CC[N@H+]([C@@H](C)c1cnc(C)nc1C)[C@@H](C)C(C)C ZINC000637978188 351852310 /nfs/dbraw/zinc/85/23/10/351852310.db2.gz MROJKTVJCGTXPI-STQMWFEESA-N 1 1 249.402 3.521 20 0 BHADMO CCC(C)(C)[N@@H+](C)Cc1ccc(C(F)F)nc1 ZINC000638062140 351934527 /nfs/dbraw/zinc/93/45/27/351934527.db2.gz KSKGRZKVSAYLQM-UHFFFAOYSA-N 1 1 242.313 3.640 20 0 BHADMO CC[N@@H+](Cc1cccc2ncccc12)C1CCC1 ZINC000638104526 351983659 /nfs/dbraw/zinc/98/36/59/351983659.db2.gz JBVKRWKQPXGYLT-UHFFFAOYSA-N 1 1 240.350 3.609 20 0 BHADMO CC[C@H](C)C[N@@H+](CC)[C@@H](C)c1cnc(C)nc1C ZINC000638153457 352017725 /nfs/dbraw/zinc/01/77/25/352017725.db2.gz JYEFQRLWCHVGGX-AAEUAGOBSA-N 1 1 249.402 3.522 20 0 BHADMO CC[C@@H](C)C[N@@H+](CC)[C@H](C)c1cnc(C)nc1C ZINC000638153463 352017272 /nfs/dbraw/zinc/01/72/72/352017272.db2.gz JYEFQRLWCHVGGX-DGCLKSJQSA-N 1 1 249.402 3.522 20 0 BHADMO CC[C@H](C)C[N@@H+](CC)[C@H](C)c1cnc(C)nc1C ZINC000638153464 352017562 /nfs/dbraw/zinc/01/75/62/352017562.db2.gz JYEFQRLWCHVGGX-WCQYABFASA-N 1 1 249.402 3.522 20 0 BHADMO CC[C@@H](C)C[N@@H+](CC)[C@@H](C)c1cnc(C)nc1C ZINC000638153465 352017776 /nfs/dbraw/zinc/01/77/76/352017776.db2.gz JYEFQRLWCHVGGX-YPMHNXCESA-N 1 1 249.402 3.522 20 0 BHADMO CCCCC[C@@H]1CCC[N@H+]1CCC[C@H]1CCO1 ZINC000638177684 352044900 /nfs/dbraw/zinc/04/49/00/352044900.db2.gz LWPLRBZRDQLKAC-CABCVRRESA-N 1 1 239.403 3.600 20 0 BHADMO CCCCC[C@H]1CCC[N@H+]1CCC[C@H]1CCO1 ZINC000638177685 352045439 /nfs/dbraw/zinc/04/54/39/352045439.db2.gz LWPLRBZRDQLKAC-GJZGRUSLSA-N 1 1 239.403 3.600 20 0 BHADMO CCCCC[C@@H]1CCC[N@H+]1CCC[C@@H]1CCO1 ZINC000638177686 352044814 /nfs/dbraw/zinc/04/48/14/352044814.db2.gz LWPLRBZRDQLKAC-HUUCEWRRSA-N 1 1 239.403 3.600 20 0 BHADMO CCCCC[C@H]1CCC[N@H+]1CCC[C@@H]1CCO1 ZINC000638177687 352045357 /nfs/dbraw/zinc/04/53/57/352045357.db2.gz LWPLRBZRDQLKAC-LSDHHAIUSA-N 1 1 239.403 3.600 20 0 BHADMO C[C@@H](Nc1cccc2cc[nH+]cc21)[C@H]1CC1(F)F ZINC000638883775 353050871 /nfs/dbraw/zinc/05/08/71/353050871.db2.gz AXRBDUFBSOYYHD-BXKDBHETSA-N 1 1 248.276 3.690 20 0 BHADMO C[C@H](Nc1cccc2cc[nH+]cc21)[C@@H]1CC1(F)F ZINC000638883776 353050993 /nfs/dbraw/zinc/05/09/93/353050993.db2.gz AXRBDUFBSOYYHD-CABZTGNLSA-N 1 1 248.276 3.690 20 0 BHADMO C[C@H](Nc1cccc2cc[nH+]cc21)[C@H]1CC1(F)F ZINC000638883777 353050710 /nfs/dbraw/zinc/05/07/10/353050710.db2.gz AXRBDUFBSOYYHD-JOYOIKCWSA-N 1 1 248.276 3.690 20 0 BHADMO C[C@@H](Nc1cccc2cc[nH+]cc21)[C@@H]1CC1(F)F ZINC000638883778 353050980 /nfs/dbraw/zinc/05/09/80/353050980.db2.gz AXRBDUFBSOYYHD-SKDRFNHKSA-N 1 1 248.276 3.690 20 0 BHADMO C[N@@H+](Cc1ccns1)C(C)(C)c1ccccc1 ZINC000639145977 353851546 /nfs/dbraw/zinc/85/15/46/353851546.db2.gz AFCHVJWIPJTAQH-UHFFFAOYSA-N 1 1 246.379 3.510 20 0 BHADMO CC(C)C1(C[N@H+]2CCC[C@H]2c2cccnc2)CC1 ZINC000639167488 354054027 /nfs/dbraw/zinc/05/40/27/354054027.db2.gz GIGGXRAHPRDFLE-HNNXBMFYSA-N 1 1 244.382 3.655 20 0 BHADMO CC(C)C1(C[N@H+]2CCC[C@@H]2c2cccnc2)CC1 ZINC000639167489 354053961 /nfs/dbraw/zinc/05/39/61/354053961.db2.gz GIGGXRAHPRDFLE-OAHLLOKOSA-N 1 1 244.382 3.655 20 0 BHADMO CC(C)C1(C[N@H+]2CCC[C@H]2c2ccncc2)CC1 ZINC000639167542 354054867 /nfs/dbraw/zinc/05/48/67/354054867.db2.gz HSFOKFBDEVZTJG-HNNXBMFYSA-N 1 1 244.382 3.655 20 0 BHADMO CC(C)C1(C[N@H+]2CCC[C@@H]2c2ccncc2)CC1 ZINC000639167543 354054850 /nfs/dbraw/zinc/05/48/50/354054850.db2.gz HSFOKFBDEVZTJG-OAHLLOKOSA-N 1 1 244.382 3.655 20 0 BHADMO CC[N@@H+](C[C@@H]1C[C@H]2C[C@H]2C1)[C@H](C)c1cccnc1 ZINC000639178746 354264389 /nfs/dbraw/zinc/26/43/89/354264389.db2.gz OFDJDXNWMHXGMD-LUYZLQTOSA-N 1 1 244.382 3.511 20 0 BHADMO CC[N@@H+](C[C@@H]1C[C@H]2C[C@H]2C1)[C@@H](C)c1cccnc1 ZINC000639178747 354263869 /nfs/dbraw/zinc/26/38/69/354263869.db2.gz OFDJDXNWMHXGMD-UGQVUOCMSA-N 1 1 244.382 3.511 20 0 BHADMO CCC(CC)[N@@H+](CC)[C@H](C)c1cnc(C)nc1C ZINC000639187021 354381158 /nfs/dbraw/zinc/38/11/58/354381158.db2.gz XEEPHUGTDFBCNV-GFCCVEGCSA-N 1 1 249.402 3.665 20 0 BHADMO CCC(CC)[N@@H+](CC)[C@@H](C)c1cnc(C)nc1C ZINC000639187022 354381345 /nfs/dbraw/zinc/38/13/45/354381345.db2.gz XEEPHUGTDFBCNV-LBPRGKRZSA-N 1 1 249.402 3.665 20 0 BHADMO CC[N@@H+](CC(C)(C)C)[C@H](C)c1cnc(C)nc1C ZINC000639195920 354597336 /nfs/dbraw/zinc/59/73/36/354597336.db2.gz HRHZYHNMAQWTKA-GFCCVEGCSA-N 1 1 249.402 3.522 20 0 BHADMO CC[N@@H+](CC(C)(C)C)[C@@H](C)c1cnc(C)nc1C ZINC000639195921 354597132 /nfs/dbraw/zinc/59/71/32/354597132.db2.gz HRHZYHNMAQWTKA-LBPRGKRZSA-N 1 1 249.402 3.522 20 0 BHADMO CCCC[C@H](C)[N@@H+](C)[C@@H](C)c1cnc(C)nc1C ZINC000639199356 354602846 /nfs/dbraw/zinc/60/28/46/354602846.db2.gz WOOOIADIOPPFPK-AAEUAGOBSA-N 1 1 249.402 3.665 20 0 BHADMO CCCC[C@@H](C)[N@@H+](C)[C@H](C)c1cnc(C)nc1C ZINC000639199357 354602899 /nfs/dbraw/zinc/60/28/99/354602899.db2.gz WOOOIADIOPPFPK-DGCLKSJQSA-N 1 1 249.402 3.665 20 0 BHADMO CCCC[C@H](C)[N@@H+](C)[C@H](C)c1cnc(C)nc1C ZINC000639199359 354602906 /nfs/dbraw/zinc/60/29/06/354602906.db2.gz WOOOIADIOPPFPK-WCQYABFASA-N 1 1 249.402 3.665 20 0 BHADMO CCCC[C@@H](C)[N@@H+](C)[C@@H](C)c1cnc(C)nc1C ZINC000639199361 354603022 /nfs/dbraw/zinc/60/30/22/354603022.db2.gz WOOOIADIOPPFPK-YPMHNXCESA-N 1 1 249.402 3.665 20 0 BHADMO c1cc(NCC2CCSCC2)[nH+]c(C2CC2)c1 ZINC000639205817 354672981 /nfs/dbraw/zinc/67/29/81/354672981.db2.gz CGNRELIHZWCVMW-UHFFFAOYSA-N 1 1 248.395 3.514 20 0 BHADMO CC(C)[N@@H+](Cc1ccns1)C1CC(C)(C)C1 ZINC000639243066 355229868 /nfs/dbraw/zinc/22/98/68/355229868.db2.gz UDGVQNKJHYIBHI-UHFFFAOYSA-N 1 1 238.400 3.542 20 0 BHADMO Cc1ncc([C@@H](C)[N@@H+](C)CCC(C)(C)C)c(C)n1 ZINC000639282918 386843612 /nfs/dbraw/zinc/84/36/12/386843612.db2.gz HBHINAGYBYSSCU-GFCCVEGCSA-N 1 1 249.402 3.522 20 0 BHADMO Cc1ncc([C@H](C)[N@@H+](C)CCC(C)(C)C)c(C)n1 ZINC000639282919 386843542 /nfs/dbraw/zinc/84/35/42/386843542.db2.gz HBHINAGYBYSSCU-LBPRGKRZSA-N 1 1 249.402 3.522 20 0 BHADMO CCC[N@@H+](Cc1ccc(C(F)F)nc1)C(C)C ZINC000639308169 355664060 /nfs/dbraw/zinc/66/40/60/355664060.db2.gz CWMUYEUVGXKQCV-UHFFFAOYSA-N 1 1 242.313 3.640 20 0 BHADMO Clc1ccc(C[NH+]2CC(c3ccccc3)C2)o1 ZINC000639361915 355816581 /nfs/dbraw/zinc/81/65/81/355816581.db2.gz YKAZOFKOWPPDJX-UHFFFAOYSA-N 1 1 247.725 3.532 20 0 BHADMO FCCC1CC[NH+](Cc2ccc(Cl)o2)CC1 ZINC000639381413 355921546 /nfs/dbraw/zinc/92/15/46/355921546.db2.gz OQPJQTIDUFGFII-UHFFFAOYSA-N 1 1 245.725 3.505 20 0 BHADMO CCC(F)(F)C[NH2+][C@H](CC(F)(F)F)C(C)C ZINC000639603328 356523920 /nfs/dbraw/zinc/52/39/20/356523920.db2.gz NTAIYLCQDSHPGX-MRVPVSSYSA-N 1 1 247.251 3.598 20 0 BHADMO CCC(F)(F)C[NH2+][C@@H](CC(F)(F)F)C(C)C ZINC000639603331 356523297 /nfs/dbraw/zinc/52/32/97/356523297.db2.gz NTAIYLCQDSHPGX-QMMMGPOBSA-N 1 1 247.251 3.598 20 0 BHADMO CCC(F)(F)C[N@@H+](C)C1CCC(F)(F)CC1 ZINC000639649319 356561214 /nfs/dbraw/zinc/56/12/14/356561214.db2.gz RLDYJMURPHHLNM-UHFFFAOYSA-N 1 1 241.272 3.541 20 0 BHADMO CCC(F)(F)C[N@H+](C)C1CCC(F)(F)CC1 ZINC000639649319 356561210 /nfs/dbraw/zinc/56/12/10/356561210.db2.gz RLDYJMURPHHLNM-UHFFFAOYSA-N 1 1 241.272 3.541 20 0 BHADMO CC(C)=CCC[N@H+]1CCC[C@H](c2cccnc2)C1 ZINC000639695775 356603153 /nfs/dbraw/zinc/60/31/53/356603153.db2.gz YFTWPJWGFVCEHH-INIZCTEOSA-N 1 1 244.382 3.617 20 0 BHADMO CC(C)=CCC[N@H+]1CCC[C@@H](c2cccnc2)C1 ZINC000639695776 356604033 /nfs/dbraw/zinc/60/40/33/356604033.db2.gz YFTWPJWGFVCEHH-MRXNPFEDSA-N 1 1 244.382 3.617 20 0 BHADMO Cc1cc(C)c(C[N@H+]2CCC23CCCC3)c(C)n1 ZINC000639719860 356617885 /nfs/dbraw/zinc/61/78/85/356617885.db2.gz QOMOAGUCVIEGMH-UHFFFAOYSA-N 1 1 244.382 3.525 20 0 BHADMO Cc1cccc([C@@H](C)[N@@H+](C)Cc2ccns2)c1 ZINC000639789592 356741949 /nfs/dbraw/zinc/74/19/49/356741949.db2.gz QOZCUUFXDVDUMY-GFCCVEGCSA-N 1 1 246.379 3.645 20 0 BHADMO Cc1cccc([C@@H](C)[N@H+](C)Cc2ccns2)c1 ZINC000639789592 356741946 /nfs/dbraw/zinc/74/19/46/356741946.db2.gz QOZCUUFXDVDUMY-GFCCVEGCSA-N 1 1 246.379 3.645 20 0 BHADMO Cc1cccc([C@H](C)[N@@H+](C)Cc2ccns2)c1 ZINC000639789593 356742163 /nfs/dbraw/zinc/74/21/63/356742163.db2.gz QOZCUUFXDVDUMY-LBPRGKRZSA-N 1 1 246.379 3.645 20 0 BHADMO Cc1cccc([C@H](C)[N@H+](C)Cc2ccns2)c1 ZINC000639789593 356742159 /nfs/dbraw/zinc/74/21/59/356742159.db2.gz QOZCUUFXDVDUMY-LBPRGKRZSA-N 1 1 246.379 3.645 20 0 BHADMO FC[C@H]([NH2+]CC1=CCCC1)c1ccc(F)cc1 ZINC000640154263 358438286 /nfs/dbraw/zinc/43/82/86/358438286.db2.gz FCVVJVKGSKVDRR-AWEZNQCLSA-N 1 1 237.293 3.536 20 0 BHADMO FC[C@@H]([NH2+]CC1=CCCC1)c1ccc(F)cc1 ZINC000640154277 358438097 /nfs/dbraw/zinc/43/80/97/358438097.db2.gz FCVVJVKGSKVDRR-CQSZACIVSA-N 1 1 237.293 3.536 20 0 BHADMO FC[C@H]([NH2+][C@H]1C=CCCC1)c1ccc(F)cc1 ZINC000640154395 358437945 /nfs/dbraw/zinc/43/79/45/358437945.db2.gz ZWYOKYFMIYDYLQ-KBPBESRZSA-N 1 1 237.293 3.535 20 0 BHADMO FC[C@H]([NH2+][C@@H]1C=CCCC1)c1ccc(F)cc1 ZINC000640154396 358438556 /nfs/dbraw/zinc/43/85/56/358438556.db2.gz ZWYOKYFMIYDYLQ-KGLIPLIRSA-N 1 1 237.293 3.535 20 0 BHADMO FC[C@@H]([NH2+][C@H]1C=CCCC1)c1ccc(F)cc1 ZINC000640154397 358438507 /nfs/dbraw/zinc/43/85/07/358438507.db2.gz ZWYOKYFMIYDYLQ-UONOGXRCSA-N 1 1 237.293 3.535 20 0 BHADMO FC[C@@H]([NH2+][C@@H]1C=CCCC1)c1ccc(F)cc1 ZINC000640154398 358437994 /nfs/dbraw/zinc/43/79/94/358437994.db2.gz ZWYOKYFMIYDYLQ-ZIAGYGMSSA-N 1 1 237.293 3.535 20 0 BHADMO Cc1nc(C[N@H+]2CC[C@@]2(C)C2CCCCC2)co1 ZINC000640217860 358875278 /nfs/dbraw/zinc/87/52/78/358875278.db2.gz BMUWUPIPLHTKRH-HNNXBMFYSA-N 1 1 248.370 3.528 20 0 BHADMO Cc1nc(C[N@H+]2CC[C@]2(C)C2CCCCC2)co1 ZINC000640217861 358875056 /nfs/dbraw/zinc/87/50/56/358875056.db2.gz BMUWUPIPLHTKRH-OAHLLOKOSA-N 1 1 248.370 3.528 20 0 BHADMO Cc1cnc(C[N@H+]2CC[C@@]2(C)C2CCCCC2)o1 ZINC000640219545 358887961 /nfs/dbraw/zinc/88/79/61/358887961.db2.gz MAQLOYHTYKRBOX-HNNXBMFYSA-N 1 1 248.370 3.528 20 0 BHADMO Cc1cnc(C[N@H+]2CC[C@]2(C)C2CCCCC2)o1 ZINC000640219546 358888239 /nfs/dbraw/zinc/88/82/39/358888239.db2.gz MAQLOYHTYKRBOX-OAHLLOKOSA-N 1 1 248.370 3.528 20 0 BHADMO Cc1cc(C[N@H+]2CC[C@@]2(C)C2CCCCC2)on1 ZINC000640220187 358892865 /nfs/dbraw/zinc/89/28/65/358892865.db2.gz QZEHSNMWJZICAD-HNNXBMFYSA-N 1 1 248.370 3.528 20 0 BHADMO Cc1cc(C[N@H+]2CC[C@]2(C)C2CCCCC2)on1 ZINC000640220188 358893170 /nfs/dbraw/zinc/89/31/70/358893170.db2.gz QZEHSNMWJZICAD-OAHLLOKOSA-N 1 1 248.370 3.528 20 0 BHADMO Cc1nocc1C[N@H+]1CC[C@@]1(C)C1CCCCC1 ZINC000640220277 358894152 /nfs/dbraw/zinc/89/41/52/358894152.db2.gz SBXVCAYDYJOFEU-HNNXBMFYSA-N 1 1 248.370 3.528 20 0 BHADMO Cc1nocc1C[N@H+]1CC[C@]1(C)C1CCCCC1 ZINC000640220278 358894077 /nfs/dbraw/zinc/89/40/77/358894077.db2.gz SBXVCAYDYJOFEU-OAHLLOKOSA-N 1 1 248.370 3.528 20 0 BHADMO Cc1cc(C[N@H+]2CC[C@@]2(C)C2CCCCC2)no1 ZINC000640220496 358895217 /nfs/dbraw/zinc/89/52/17/358895217.db2.gz UMWFEXRHJXGUHJ-HNNXBMFYSA-N 1 1 248.370 3.528 20 0 BHADMO Cc1cc(C[N@H+]2CC[C@]2(C)C2CCCCC2)no1 ZINC000640220497 358894430 /nfs/dbraw/zinc/89/44/30/358894430.db2.gz UMWFEXRHJXGUHJ-OAHLLOKOSA-N 1 1 248.370 3.528 20 0 BHADMO Cc1cnc([C@@H](C)[N@H+](C)C[C@H](C)C(C)(C)C)o1 ZINC000640350362 361075672 /nfs/dbraw/zinc/07/56/72/361075672.db2.gz OYRFISKLMZUOCI-CMPLNLGQSA-N 1 1 238.375 3.658 20 0 BHADMO Cc1cnc([C@H](C)[N@H+](C)C[C@H](C)C(C)(C)C)o1 ZINC000640350363 361075580 /nfs/dbraw/zinc/07/55/80/361075580.db2.gz OYRFISKLMZUOCI-JQWIXIFHSA-N 1 1 238.375 3.658 20 0 BHADMO Cc1cnc([C@H](C)[N@H+](C)C[C@@H](C)C(C)(C)C)o1 ZINC000640350364 361075107 /nfs/dbraw/zinc/07/51/07/361075107.db2.gz OYRFISKLMZUOCI-PWSUYJOCSA-N 1 1 238.375 3.658 20 0 BHADMO Cc1cnc([C@@H](C)[N@H+](C)C[C@@H](C)C(C)(C)C)o1 ZINC000640350438 361075401 /nfs/dbraw/zinc/07/54/01/361075401.db2.gz OYRFISKLMZUOCI-ZYHUDNBSSA-N 1 1 238.375 3.658 20 0 BHADMO CC(C)(C)c1cc[nH+]c(NC2CC(F)(F)C2)c1 ZINC000641536534 362486285 /nfs/dbraw/zinc/48/62/85/362486285.db2.gz OBHJYZHUHUIVNP-UHFFFAOYSA-N 1 1 240.297 3.589 20 0 BHADMO CCc1ccc[nH+]c1NCc1ccc(SC)o1 ZINC000641744275 362665855 /nfs/dbraw/zinc/66/58/55/362665855.db2.gz VLOMYMRZFHZHNI-UHFFFAOYSA-N 1 1 248.351 3.571 20 0 BHADMO C[C@H]([NH2+][C@@H]1CC[C@@H](c2ccccc2)C1)C(F)F ZINC000641791802 362733003 /nfs/dbraw/zinc/73/30/03/362733003.db2.gz NIHUZBGKXOVCFS-CYZMBNFOSA-N 1 1 239.309 3.566 20 0 BHADMO C[C@H]([NH2+][C@H]1CC[C@H](c2ccccc2)C1)C(F)F ZINC000641791803 362733246 /nfs/dbraw/zinc/73/32/46/362733246.db2.gz NIHUZBGKXOVCFS-DRZSPHRISA-N 1 1 239.309 3.566 20 0 BHADMO C[C@H]([NH2+][C@H]1CC[C@@H](c2ccccc2)C1)C(F)F ZINC000641791804 362733112 /nfs/dbraw/zinc/73/31/12/362733112.db2.gz NIHUZBGKXOVCFS-UHTWSYAYSA-N 1 1 239.309 3.566 20 0 BHADMO C[C@H]([NH2+][C@@H]1CC[C@H](c2ccccc2)C1)C(F)F ZINC000641791805 362733161 /nfs/dbraw/zinc/73/31/61/362733161.db2.gz NIHUZBGKXOVCFS-WCFLWFBJSA-N 1 1 239.309 3.566 20 0 BHADMO CC(C)CC[N@@H+](Cc1ccccc1)C1CC1 ZINC000641864620 362791690 /nfs/dbraw/zinc/79/16/90/362791690.db2.gz COFCONDMDGTUGF-UHFFFAOYSA-N 1 1 217.356 3.697 20 0 BHADMO CC(C)C[N@@H+](C)Cc1ccccc1C(F)(F)F ZINC000641864832 362791875 /nfs/dbraw/zinc/79/18/75/362791875.db2.gz KQEHZHARSNCTJT-UHFFFAOYSA-N 1 1 245.288 3.793 20 0 BHADMO Cc1ccc2c(C)cc(N3CCCCC3)[nH+]c2c1 ZINC000641936025 362806453 /nfs/dbraw/zinc/80/64/53/362806453.db2.gz KPNHKJHGDJPFFB-UHFFFAOYSA-N 1 1 240.350 3.842 20 0 BHADMO Cc1ccc2c(C)cc(NC3CCCC3)[nH+]c2c1 ZINC000641936284 362806021 /nfs/dbraw/zinc/80/60/21/362806021.db2.gz YNTJLQPGVXKWGK-UHFFFAOYSA-N 1 1 240.350 3.628 20 0 BHADMO C[C@@H]1CCCC[C@@H]1[N@@H+](C)Cc1ccccc1F ZINC000641976651 362815836 /nfs/dbraw/zinc/81/58/36/362815836.db2.gz SWYKBTOCRNONHA-DOMZBBRYSA-N 1 1 235.346 3.836 20 0 BHADMO C[C@@H]1CCCC[C@H]1[N@@H+](C)Cc1ccccc1F ZINC000641976652 362815407 /nfs/dbraw/zinc/81/54/07/362815407.db2.gz SWYKBTOCRNONHA-IUODEOHRSA-N 1 1 235.346 3.836 20 0 BHADMO C[C@H]1CCCC[C@H]1[N@@H+](C)Cc1ccccc1F ZINC000641976653 362815634 /nfs/dbraw/zinc/81/56/34/362815634.db2.gz SWYKBTOCRNONHA-SWLSCSKDSA-N 1 1 235.346 3.836 20 0 BHADMO C[C@H]1CCCC[C@@H]1[N@@H+](C)Cc1ccccc1F ZINC000641976654 362815936 /nfs/dbraw/zinc/81/59/36/362815936.db2.gz SWYKBTOCRNONHA-WFASDCNBSA-N 1 1 235.346 3.836 20 0 BHADMO CC(C)C[N@@H+](Cc1ccc(Cl)cc1)C1CC1 ZINC000641976818 362817166 /nfs/dbraw/zinc/81/71/66/362817166.db2.gz CWZPNJJNNCXJJC-UHFFFAOYSA-N 1 1 237.774 3.960 20 0 BHADMO Cc1cc(C)cc(OCC[N@H+](C(C)C)C2CC2)c1 ZINC000641976878 362817142 /nfs/dbraw/zinc/81/71/42/362817142.db2.gz RZLWKGGNSCUHAN-UHFFFAOYSA-N 1 1 247.382 3.555 20 0 BHADMO CC(C)C[N@@H+](Cc1ccccc1Cl)C1CC1 ZINC000641976893 362817433 /nfs/dbraw/zinc/81/74/33/362817433.db2.gz VVWLWHONIWUARO-UHFFFAOYSA-N 1 1 237.774 3.960 20 0 BHADMO Cc1ccccc1C[N@H+](CC(C)C)C1CC1 ZINC000641977013 362817404 /nfs/dbraw/zinc/81/74/04/362817404.db2.gz PXASZWRQGZGDOL-UHFFFAOYSA-N 1 1 217.356 3.615 20 0 BHADMO CCC[N@H+](Cc1ccc(C)cc1)CC(C)C ZINC000641979651 362817268 /nfs/dbraw/zinc/81/72/68/362817268.db2.gz XHKFVSLMYIKOCS-UHFFFAOYSA-N 1 1 219.372 3.863 20 0 BHADMO Cc1ccc([C@@H]2CCC[N@@H+]2CC(C)C)cc1 ZINC000641979860 362816957 /nfs/dbraw/zinc/81/69/57/362816957.db2.gz PZDJCIXUBFWDMG-HNNXBMFYSA-N 1 1 217.356 3.788 20 0 BHADMO Cc1ccc([C@H]2CCC[N@@H+]2CC(C)C)cc1 ZINC000641979864 362817450 /nfs/dbraw/zinc/81/74/50/362817450.db2.gz PZDJCIXUBFWDMG-OAHLLOKOSA-N 1 1 217.356 3.788 20 0 BHADMO CC(C)C[N@@H+](C)[C@H](C)c1ccc(Cl)cc1 ZINC000641980206 362817123 /nfs/dbraw/zinc/81/71/23/362817123.db2.gz FTYVAARAAJQJND-LLVKDONJSA-N 1 1 225.763 3.989 20 0 BHADMO CC(C)C[N@@H+](C)[C@@H](C)c1ccc(Cl)cc1 ZINC000641980207 362816475 /nfs/dbraw/zinc/81/64/75/362816475.db2.gz FTYVAARAAJQJND-NSHDSACASA-N 1 1 225.763 3.989 20 0 BHADMO CC(C)CC[N@@H+](CCOc1ccccc1)C1CC1 ZINC000642094064 362850782 /nfs/dbraw/zinc/85/07/82/362850782.db2.gz GEBHARXKECIOEH-UHFFFAOYSA-N 1 1 247.382 3.576 20 0 BHADMO CC(C)CC[N@@H+](Cc1cccc(F)c1)C1CC1 ZINC000642094096 362850898 /nfs/dbraw/zinc/85/08/98/362850898.db2.gz KBFDVHBLGWAHHH-UHFFFAOYSA-N 1 1 235.346 3.836 20 0 BHADMO Cc1cccc(C[N@H+](CC(C)C)C2CC2)c1 ZINC000642094169 362851096 /nfs/dbraw/zinc/85/10/96/362851096.db2.gz AESYCMQIGLOIPG-UHFFFAOYSA-N 1 1 217.356 3.615 20 0 BHADMO CC(C)C[N@@H+](Cc1cccc(Cl)c1)C1CC1 ZINC000642094187 362850815 /nfs/dbraw/zinc/85/08/15/362850815.db2.gz JQJAICMQSFVFJT-UHFFFAOYSA-N 1 1 237.774 3.960 20 0 BHADMO COc1ccc(C)cc1C[N@@H+](CC(C)C)C1CC1 ZINC000642094244 362851036 /nfs/dbraw/zinc/85/10/36/362851036.db2.gz HWPWIQOTVOLGLN-UHFFFAOYSA-N 1 1 247.382 3.624 20 0 BHADMO CC(C)C[N@@H+](CCCc1ccccc1)C1CC1 ZINC000642094250 362850858 /nfs/dbraw/zinc/85/08/58/362850858.db2.gz LBWULAQGWSFXJV-UHFFFAOYSA-N 1 1 231.383 3.740 20 0 BHADMO C[C@@H]([N@@H+](C)CC1CCCCC1)C(C)(C)C ZINC000642095069 362852359 /nfs/dbraw/zinc/85/23/59/362852359.db2.gz JXJXSQJBHQTYJO-GFCCVEGCSA-N 1 1 211.393 3.933 20 0 BHADMO C[C@H]([N@@H+](C)CC1CCCCC1)C(C)(C)C ZINC000642095081 362852293 /nfs/dbraw/zinc/85/22/93/362852293.db2.gz JXJXSQJBHQTYJO-LBPRGKRZSA-N 1 1 211.393 3.933 20 0 BHADMO C[C@@H]([N@@H+](C)Cc1ccccc1F)C(C)(C)C ZINC000642095236 362852171 /nfs/dbraw/zinc/85/21/71/362852171.db2.gz IJWOERFMYBMXID-LLVKDONJSA-N 1 1 223.335 3.692 20 0 BHADMO C[C@H]([N@@H+](C)Cc1ccccc1F)C(C)(C)C ZINC000642095237 362852048 /nfs/dbraw/zinc/85/20/48/362852048.db2.gz IJWOERFMYBMXID-NSHDSACASA-N 1 1 223.335 3.692 20 0 BHADMO C[C@@H]([N@@H+](C)Cc1ccccc1)C(C)(C)C ZINC000642095280 362852273 /nfs/dbraw/zinc/85/22/73/362852273.db2.gz VIXNKLSSVXEBKH-GFCCVEGCSA-N 1 1 205.345 3.553 20 0 BHADMO C[C@H]([N@@H+](C)Cc1ccccc1)C(C)(C)C ZINC000642095281 362852246 /nfs/dbraw/zinc/85/22/46/362852246.db2.gz VIXNKLSSVXEBKH-LBPRGKRZSA-N 1 1 205.345 3.553 20 0 BHADMO C[C@@H]([N@@H+](C)Cc1ccc(F)cc1)C(C)(C)C ZINC000642095286 362852422 /nfs/dbraw/zinc/85/24/22/362852422.db2.gz XPUGAOKSCFKZSS-LLVKDONJSA-N 1 1 223.335 3.692 20 0 BHADMO C[C@H]([N@@H+](C)Cc1ccc(F)cc1)C(C)(C)C ZINC000642095287 362852416 /nfs/dbraw/zinc/85/24/16/362852416.db2.gz XPUGAOKSCFKZSS-NSHDSACASA-N 1 1 223.335 3.692 20 0 BHADMO COc1cccc(C[N@@H+](C)[C@H](C)C(C)(C)C)c1 ZINC000642103062 362860727 /nfs/dbraw/zinc/86/07/27/362860727.db2.gz CRCJBWXYDUPLIR-GFCCVEGCSA-N 1 1 235.371 3.562 20 0 BHADMO COc1cccc(C[N@@H+](C)[C@@H](C)C(C)(C)C)c1 ZINC000642103063 362860747 /nfs/dbraw/zinc/86/07/47/362860747.db2.gz CRCJBWXYDUPLIR-LBPRGKRZSA-N 1 1 235.371 3.562 20 0 BHADMO CCCC[N@@H+](Cc1cccc(F)c1)C1CC1 ZINC000642189397 362902108 /nfs/dbraw/zinc/90/21/08/362902108.db2.gz IOSIKIQETPIAOF-UHFFFAOYSA-N 1 1 221.319 3.590 20 0 BHADMO CCCC[N@@H+](Cc1cc(C)ccc1OC)C1CC1 ZINC000642189398 362902292 /nfs/dbraw/zinc/90/22/92/362902292.db2.gz IOYMXUMRJJMEPD-UHFFFAOYSA-N 1 1 247.382 3.768 20 0 BHADMO CCCC[N@@H+](Cc1ccccc1C)C1CC1 ZINC000642189399 362902176 /nfs/dbraw/zinc/90/21/76/362902176.db2.gz IOZLNXHVITZARC-UHFFFAOYSA-N 1 1 217.356 3.760 20 0 BHADMO CCCC[N@@H+](CCCOc1ccccc1)C1CC1 ZINC000642189404 362902358 /nfs/dbraw/zinc/90/23/58/362902358.db2.gz JNNHALLDKKITCE-UHFFFAOYSA-N 1 1 247.382 3.720 20 0 BHADMO CCCC[N@@H+](Cc1ccc(C)cc1)C1CC1 ZINC000642189411 362902129 /nfs/dbraw/zinc/90/21/29/362902129.db2.gz LRWSBOYDXDKOEF-UHFFFAOYSA-N 1 1 217.356 3.760 20 0 BHADMO CCCC[N@@H+](CCOc1cccc(C)c1)C1CC1 ZINC000642189415 362901695 /nfs/dbraw/zinc/90/16/95/362901695.db2.gz NIXRBIIFGQPBKH-UHFFFAOYSA-N 1 1 247.382 3.638 20 0 BHADMO CCCC[N@@H+](Cc1ccc(F)c(F)c1)C1CC1 ZINC000642189455 362902010 /nfs/dbraw/zinc/90/20/10/362902010.db2.gz UJKWRINOAYFRBX-UHFFFAOYSA-N 1 1 239.309 3.729 20 0 BHADMO CCCC[N@@H+](CCCc1ccccc1)C1CC1 ZINC000642189548 362903078 /nfs/dbraw/zinc/90/30/78/362903078.db2.gz PUCZTUULBAJEDJ-UHFFFAOYSA-N 1 1 231.383 3.884 20 0 BHADMO CCCC[N@@H+](CC1CCCCC1)C1CC1 ZINC000642189564 362903172 /nfs/dbraw/zinc/90/31/72/362903172.db2.gz WSTMYOKZAUUEAE-UHFFFAOYSA-N 1 1 209.377 3.831 20 0 BHADMO C[C@@H]1CCC[C@H]([N@@H+](C)Cc2cccc(F)c2)C1 ZINC000642189909 362904087 /nfs/dbraw/zinc/90/40/87/362904087.db2.gz GYVVFJUUQIGKFH-DOMZBBRYSA-N 1 1 235.346 3.836 20 0 BHADMO C[C@@H]1CCC[C@@H]([N@@H+](C)Cc2cccc(F)c2)C1 ZINC000642189910 362904102 /nfs/dbraw/zinc/90/41/02/362904102.db2.gz GYVVFJUUQIGKFH-IUODEOHRSA-N 1 1 235.346 3.836 20 0 BHADMO C[C@H]1CCC[C@@H]([N@@H+](C)Cc2cccc(F)c2)C1 ZINC000642189911 362904165 /nfs/dbraw/zinc/90/41/65/362904165.db2.gz GYVVFJUUQIGKFH-SWLSCSKDSA-N 1 1 235.346 3.836 20 0 BHADMO C[C@H]1CCC[C@H]([N@@H+](C)Cc2cccc(F)c2)C1 ZINC000642189912 362903463 /nfs/dbraw/zinc/90/34/63/362903463.db2.gz GYVVFJUUQIGKFH-WFASDCNBSA-N 1 1 235.346 3.836 20 0 BHADMO Cc1cc(C)cc(OCC[N@H+](C)[C@@H](C)C(C)C)c1 ZINC000642252657 362995400 /nfs/dbraw/zinc/99/54/00/362995400.db2.gz HBAAXTRGOUQHNQ-HNNXBMFYSA-N 1 1 249.398 3.659 20 0 BHADMO Cc1cc(C)cc(OCC[N@H+](C)[C@H](C)C(C)C)c1 ZINC000642252658 362995175 /nfs/dbraw/zinc/99/51/75/362995175.db2.gz HBAAXTRGOUQHNQ-OAHLLOKOSA-N 1 1 249.398 3.659 20 0 BHADMO Cc1cc(C)cc(C[N@H+](C)[C@@H](C)C(C)C)c1 ZINC000642252752 362994895 /nfs/dbraw/zinc/99/48/95/362994895.db2.gz UTZVJIKXYUJRKG-AWEZNQCLSA-N 1 1 219.372 3.780 20 0 BHADMO Cc1cc(C)cc(C[N@H+](C)[C@H](C)C(C)C)c1 ZINC000642252753 362995256 /nfs/dbraw/zinc/99/52/56/362995256.db2.gz UTZVJIKXYUJRKG-CQSZACIVSA-N 1 1 219.372 3.780 20 0 BHADMO Cc1cccc(C)c1OCC[N@H+](C)[C@@H](C)C(C)C ZINC000642253176 362996602 /nfs/dbraw/zinc/99/66/02/362996602.db2.gz LXPDQYHYOOHBKZ-HNNXBMFYSA-N 1 1 249.398 3.659 20 0 BHADMO Cc1cccc(C)c1OCC[N@H+](C)[C@H](C)C(C)C ZINC000642253177 362996015 /nfs/dbraw/zinc/99/60/15/362996015.db2.gz LXPDQYHYOOHBKZ-OAHLLOKOSA-N 1 1 249.398 3.659 20 0 BHADMO CC(C)[C@@H](C)[N@@H+](C)Cc1ccccc1Cl ZINC000642253268 362996466 /nfs/dbraw/zinc/99/64/66/362996466.db2.gz UDTXRDCSRKONTN-LLVKDONJSA-N 1 1 225.763 3.816 20 0 BHADMO CC(C)[C@H](C)[N@@H+](C)Cc1ccccc1Cl ZINC000642253269 362996212 /nfs/dbraw/zinc/99/62/12/362996212.db2.gz UDTXRDCSRKONTN-NSHDSACASA-N 1 1 225.763 3.816 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)Cc1ccccc1Cl ZINC000642253479 362997372 /nfs/dbraw/zinc/99/73/72/362997372.db2.gz NMDGPTAENXZZAO-LLVKDONJSA-N 1 1 225.763 3.960 20 0 BHADMO CCC[C@H](C)[N@@H+](C)Cc1ccccc1Cl ZINC000642253480 362997565 /nfs/dbraw/zinc/99/75/65/362997565.db2.gz NMDGPTAENXZZAO-NSHDSACASA-N 1 1 225.763 3.960 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)Cc1ncc(C(C)(C)C)o1 ZINC000642330820 363362928 /nfs/dbraw/zinc/36/29/28/363362928.db2.gz SAKDAWMGMOKYHW-LLVKDONJSA-N 1 1 238.375 3.593 20 0 BHADMO CCC[C@H](C)[N@@H+](C)Cc1ncc(C(C)(C)C)o1 ZINC000642330821 363362818 /nfs/dbraw/zinc/36/28/18/363362818.db2.gz SAKDAWMGMOKYHW-NSHDSACASA-N 1 1 238.375 3.593 20 0 BHADMO CC[N@H+](Cc1ccccc1Cl)CC(C)C ZINC000642342926 363450140 /nfs/dbraw/zinc/45/01/40/363450140.db2.gz RLNIMWBHQUBNPU-UHFFFAOYSA-N 1 1 225.763 3.818 20 0 BHADMO CC(C)[C@H](C)[N@@H+](C)CCO[C@H]1CCCC[C@H]1C ZINC000642524804 368173818 /nfs/dbraw/zinc/17/38/18/368173818.db2.gz WDYDCEWOTWOEJN-ILXRZTDVSA-N 1 1 241.419 3.558 20 0 BHADMO CC(C)[C@H](C)[N@@H+](C)CCO[C@H]1CCCC[C@@H]1C ZINC000642524807 368173995 /nfs/dbraw/zinc/17/39/95/368173995.db2.gz WDYDCEWOTWOEJN-KKUMJFAQSA-N 1 1 241.419 3.558 20 0 BHADMO CC(C)[C@H](C)[N@@H+](C)CCO[C@@H]1CCCC[C@H]1C ZINC000642524808 368174122 /nfs/dbraw/zinc/17/41/22/368174122.db2.gz WDYDCEWOTWOEJN-QLFBSQMISA-N 1 1 241.419 3.558 20 0 BHADMO CC(C)[C@H](C)[N@@H+](C)CCO[C@@H]1CCCC[C@@H]1C ZINC000642524809 368174183 /nfs/dbraw/zinc/17/41/83/368174183.db2.gz WDYDCEWOTWOEJN-SOUVJXGZSA-N 1 1 241.419 3.558 20 0 BHADMO CCC[C@H](C)[N@@H+](C)CCO[C@H]1CCCC[C@H]1C ZINC000642525917 368175482 /nfs/dbraw/zinc/17/54/82/368175482.db2.gz YRDPCGRPNPNPKQ-ILXRZTDVSA-N 1 1 241.419 3.702 20 0 BHADMO CCC[C@H](C)[N@@H+](C)CCO[C@H]1CCCC[C@@H]1C ZINC000642525918 368175343 /nfs/dbraw/zinc/17/53/43/368175343.db2.gz YRDPCGRPNPNPKQ-KKUMJFAQSA-N 1 1 241.419 3.702 20 0 BHADMO CCC[C@H](C)[N@@H+](C)CCO[C@@H]1CCCC[C@H]1C ZINC000642525919 368174711 /nfs/dbraw/zinc/17/47/11/368174711.db2.gz YRDPCGRPNPNPKQ-QLFBSQMISA-N 1 1 241.419 3.702 20 0 BHADMO CC[N@H+](Cc1cc(C)ccc1C)CC(C)C ZINC000642526635 368174489 /nfs/dbraw/zinc/17/44/89/368174489.db2.gz AKIIVNQYYQZXPT-UHFFFAOYSA-N 1 1 219.372 3.781 20 0 BHADMO CC[N@@H+](C/C=C/c1ccccc1)CC(C)C ZINC000642526684 368174585 /nfs/dbraw/zinc/17/45/85/368174585.db2.gz ILELCENBSWKBAX-DHZHZOJOSA-N 1 1 217.356 3.678 20 0 BHADMO CC[N@@H+](C/C=C\c1ccccc1)CC(C)C ZINC000642526690 368174936 /nfs/dbraw/zinc/17/49/36/368174936.db2.gz ILELCENBSWKBAX-FLIBITNWSA-N 1 1 217.356 3.678 20 0 BHADMO CC[N@H+](Cc1ccc(SC)cc1)CC(C)C ZINC000642526777 368175567 /nfs/dbraw/zinc/17/55/67/368175567.db2.gz LWQVEVZLFPTVAE-UHFFFAOYSA-N 1 1 237.412 3.886 20 0 BHADMO CC[N@H+](Cc1ccc(F)cc1Cl)CC(C)C ZINC000642526934 368175238 /nfs/dbraw/zinc/17/52/38/368175238.db2.gz RMSVSGPSKZGLOY-UHFFFAOYSA-N 1 1 243.753 3.957 20 0 BHADMO CC[N@H+](Cc1cc(C)cc(C)c1)CC(C)C ZINC000642526965 368175016 /nfs/dbraw/zinc/17/50/16/368175016.db2.gz VTAJLMKLHLDFAP-UHFFFAOYSA-N 1 1 219.372 3.781 20 0 BHADMO CC(C)CC[N@H+]1CCC[C@@H]1c1ccsc1 ZINC000642529460 368177353 /nfs/dbraw/zinc/17/73/53/368177353.db2.gz QKSYDHKVZZEKNK-CYBMUJFWSA-N 1 1 223.385 3.931 20 0 BHADMO CC(C)CC[N@H+]1CCC[C@H]1c1ccsc1 ZINC000642529461 368176496 /nfs/dbraw/zinc/17/64/96/368176496.db2.gz QKSYDHKVZZEKNK-ZDUSSCGKSA-N 1 1 223.385 3.931 20 0 BHADMO CCCC[N@@H+](C)[C@@H](C)c1ccc(F)c(F)c1 ZINC000642619992 388623058 /nfs/dbraw/zinc/62/30/58/388623058.db2.gz DENQCBBPVPHIAQ-JTQLQIEISA-N 1 1 227.298 3.758 20 0 BHADMO CCCC[N@@H+](C)[C@H](C)c1ccc(F)c(F)c1 ZINC000642619993 388622828 /nfs/dbraw/zinc/62/28/28/388622828.db2.gz DENQCBBPVPHIAQ-SNVBAGLBSA-N 1 1 227.298 3.758 20 0 BHADMO c1ccc(C[N@H+](CC2CCCC2)C2CC2)cc1 ZINC000642620180 388622840 /nfs/dbraw/zinc/62/28/40/388622840.db2.gz QFGGBXZRUJETGT-UHFFFAOYSA-N 1 1 229.367 3.841 20 0 BHADMO c1csc(C[N@H+](CC2CCCC2)C2CC2)c1 ZINC000642620266 388623293 /nfs/dbraw/zinc/62/32/93/388623293.db2.gz OBRZSOGVPUMZSI-UHFFFAOYSA-N 1 1 235.396 3.903 20 0 BHADMO C[C@@H]1c2ccsc2CC[N@@H+]1CC1CCCC1 ZINC000642620286 388622874 /nfs/dbraw/zinc/62/28/74/388622874.db2.gz VERQYNLMUAVPCD-LLVKDONJSA-N 1 1 235.396 3.857 20 0 BHADMO C[C@H]1c2ccsc2CC[N@@H+]1CC1CCCC1 ZINC000642620287 388623388 /nfs/dbraw/zinc/62/33/88/388623388.db2.gz VERQYNLMUAVPCD-NSHDSACASA-N 1 1 235.396 3.857 20 0 BHADMO C[C@H](c1cccs1)[N@@H+](C)CC1CCCC1 ZINC000642620419 388623180 /nfs/dbraw/zinc/62/31/80/388623180.db2.gz FEHICIKIJCHUFD-LLVKDONJSA-N 1 1 223.385 3.931 20 0 BHADMO C[C@@H](c1cccs1)[N@@H+](C)CC1CCCC1 ZINC000642620420 388622587 /nfs/dbraw/zinc/62/25/87/388622587.db2.gz FEHICIKIJCHUFD-NSHDSACASA-N 1 1 223.385 3.931 20 0 BHADMO CCOc1ccc(C[N@@H+](C)CC2CCCC2)cc1 ZINC000642620687 388625579 /nfs/dbraw/zinc/62/55/79/388625579.db2.gz UIFJYFQIIWRDLJ-UHFFFAOYSA-N 1 1 247.382 3.707 20 0 BHADMO CC[N@H+](Cc1cccc(F)c1)CC1CCCC1 ZINC000642620716 388625851 /nfs/dbraw/zinc/62/58/51/388625851.db2.gz FFNMDOSKJYSHBL-UHFFFAOYSA-N 1 1 235.346 3.838 20 0 BHADMO C[N@H+](Cc1ccc(F)c(F)c1)CC1CCCC1 ZINC000642621342 388626508 /nfs/dbraw/zinc/62/65/08/388626508.db2.gz CWJQMYAVLXSMMD-UHFFFAOYSA-N 1 1 239.309 3.587 20 0 BHADMO C[N@H+](Cc1ccc(F)cc1F)CC1CCCC1 ZINC000642621382 388626840 /nfs/dbraw/zinc/62/68/40/388626840.db2.gz LJWMCJHPHCTIBB-UHFFFAOYSA-N 1 1 239.309 3.587 20 0 BHADMO CCCC[N@H+]1CC[C@H](C)[C@H]2CCCC[C@H]21 ZINC000642621567 388626573 /nfs/dbraw/zinc/62/65/73/388626573.db2.gz KVDZIJPTMZNUAL-BFHYXJOUSA-N 1 1 209.377 3.687 20 0 BHADMO CCCC[N@H+]1CC[C@H](C)[C@@H]2CCCC[C@@H]21 ZINC000642621568 388626660 /nfs/dbraw/zinc/62/66/60/388626660.db2.gz KVDZIJPTMZNUAL-IHRRRGAJSA-N 1 1 209.377 3.687 20 0 BHADMO CCCC[N@H+]1CC[C@H](C)[C@@H]2CCCC[C@H]21 ZINC000642621569 388626389 /nfs/dbraw/zinc/62/63/89/388626389.db2.gz KVDZIJPTMZNUAL-MELADBBJSA-N 1 1 209.377 3.687 20 0 BHADMO CCCC[N@H+]1CC[C@H](C)[C@H]2CCCC[C@@H]21 ZINC000642621570 388626308 /nfs/dbraw/zinc/62/63/08/388626308.db2.gz KVDZIJPTMZNUAL-MJBXVCDLSA-N 1 1 209.377 3.687 20 0 BHADMO CCC[N@@H+](Cc1ccccc1)[C@H](C)C1CC1 ZINC000642629640 388685167 /nfs/dbraw/zinc/68/51/67/388685167.db2.gz TVFZDBAKBMBANG-CYBMUJFWSA-N 1 1 217.356 3.697 20 0 BHADMO CC(C)C[N@@H+](Cc1ccccc1)[C@H](C)C1CC1 ZINC000642630048 388688223 /nfs/dbraw/zinc/68/82/23/388688223.db2.gz WJOVNOPCPZFSHL-CQSZACIVSA-N 1 1 231.383 3.943 20 0 BHADMO C(C1CCCC1)[N@@H+](C1CC1)C1CCCCC1 ZINC000642634128 388747718 /nfs/dbraw/zinc/74/77/18/388747718.db2.gz RPUGJAVOUMNXDN-UHFFFAOYSA-N 1 1 221.388 3.974 20 0 BHADMO CC(C)CC[N@@H+](C1CC1)C1CCCCC1 ZINC000642634210 388749224 /nfs/dbraw/zinc/74/92/24/388749224.db2.gz HUYCXMIFZGIICY-UHFFFAOYSA-N 1 1 209.377 3.830 20 0 BHADMO CC(C)CC[N@@H+](CC1CCCC1)C1CC1 ZINC000642634581 388755362 /nfs/dbraw/zinc/75/53/62/388755362.db2.gz GKTOUHGKFWDOQL-UHFFFAOYSA-N 1 1 209.377 3.687 20 0 BHADMO C[C@H]1CCC[C@@H]([N@@H+](C)CC2CCCC2)C1 ZINC000642636104 388779994 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398317787 /nfs/dbraw/zinc/31/77/87/398317787.db2.gz NHUOPZXDVOMTTA-AWEZNQCLSA-N 1 1 217.356 3.954 20 0 BHADMO Cc1ccc([C@H](C)[N@H+](C)CC(C)C)cc1 ZINC000642642313 388818456 /nfs/dbraw/zinc/81/84/56/388818456.db2.gz VCOXTYRPOUBDHP-ZDUSSCGKSA-N 1 1 205.345 3.644 20 0 BHADMO CC[N@@H+](CCOc1ccccc1C)C1CCCC1 ZINC000642642639 398317918 /nfs/dbraw/zinc/31/79/18/398317918.db2.gz VNCQLSWUPBFUSU-UHFFFAOYSA-N 1 1 247.382 3.638 20 0 BHADMO FC(F)(F)C[C@@H]1CCC[N@H+](C2CCCC2)C1 ZINC000643253789 385990261 /nfs/dbraw/zinc/99/02/61/385990261.db2.gz MUBDDXZIAOBPOA-JTQLQIEISA-N 1 1 235.293 3.593 20 0 BHADMO FC(F)(F)C[C@H]1CCC[N@H+](C2CCCC2)C1 ZINC000643253790 385990907 /nfs/dbraw/zinc/99/09/07/385990907.db2.gz MUBDDXZIAOBPOA-SNVBAGLBSA-N 1 1 235.293 3.593 20 0 BHADMO C[C@@H](c1ccncc1)[N@H+]1CC[C@H](C2CCCC2)C1 ZINC000643254528 385988896 /nfs/dbraw/zinc/98/88/96/385988896.db2.gz OCHWRIOMANONQX-BBRMVZONSA-N 1 1 244.382 3.655 20 0 BHADMO C[C@H](c1ccncc1)[N@H+]1CC[C@H](C2CCCC2)C1 ZINC000643254529 385987327 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239.309 3.555 20 0 BHADMO C[C@@H]1CCc2ccccc2[C@@H]1[NH2+]CC(C)(F)F ZINC000645488068 386491502 /nfs/dbraw/zinc/49/15/02/386491502.db2.gz UNEMLHOHYWZRCO-ZWNOBZJWSA-N 1 1 239.309 3.555 20 0 BHADMO CC[N@H+](Cc1cccs1)CC1=CCCC1 ZINC000645768696 387890971 /nfs/dbraw/zinc/89/09/71/387890971.db2.gz WYLGLEWRFPIIKF-UHFFFAOYSA-N 1 1 221.369 3.680 20 0 BHADMO C[N@@H+](CC1=CCCC1)Cc1ccc(F)c(F)c1 ZINC000645775769 387898228 /nfs/dbraw/zinc/89/82/28/387898228.db2.gz JVWHXRBTVJQOSA-UHFFFAOYSA-N 1 1 237.293 3.507 20 0 BHADMO CCCCC[N@@H+](CCC[C@H]1CCOC1)C(C)C ZINC000645775826 387899142 /nfs/dbraw/zinc/89/91/42/387899142.db2.gz UDJOXXUZQYRCJP-HNNXBMFYSA-N 1 1 241.419 3.704 20 0 BHADMO CCCCC[N@@H+](CCC[C@@H]1CCOC1)C(C)C ZINC000645775827 387899037 /nfs/dbraw/zinc/89/90/37/387899037.db2.gz UDJOXXUZQYRCJP-OAHLLOKOSA-N 1 1 241.419 3.704 20 0 BHADMO CCC(CC)C[N@@H+](CC)CCC[C@H]1CCOC1 ZINC000645775909 387899106 /nfs/dbraw/zinc/89/91/06/387899106.db2.gz DTIHNPGMLTTZIL-HNNXBMFYSA-N 1 1 241.419 3.561 20 0 BHADMO CCC(CC)C[N@@H+](CC)CCC[C@@H]1CCOC1 ZINC000645775910 387900014 /nfs/dbraw/zinc/90/00/14/387900014.db2.gz DTIHNPGMLTTZIL-OAHLLOKOSA-N 1 1 241.419 3.561 20 0 BHADMO C[C@H](c1cccs1)[N@@H+](C)CC1=CCCC1 ZINC000645777685 387902350 /nfs/dbraw/zinc/90/23/50/387902350.db2.gz HCQSPDNVADOMMB-LLVKDONJSA-N 1 1 221.369 3.851 20 0 BHADMO C[C@@H](c1cccs1)[N@@H+](C)CC1=CCCC1 ZINC000645777692 387902441 /nfs/dbraw/zinc/90/24/41/387902441.db2.gz HCQSPDNVADOMMB-NSHDSACASA-N 1 1 221.369 3.851 20 0 BHADMO CC(C)[N@H+](Cc1ccco1)CC1=CCCC1 ZINC000645782582 387906425 /nfs/dbraw/zinc/90/64/25/387906425.db2.gz ZSWURYKDGKCNLW-UHFFFAOYSA-N 1 1 219.328 3.600 20 0 BHADMO Cc1ccc(C[N@@H+](C)CC2=CCCC2)s1 ZINC000645791548 387915493 /nfs/dbraw/zinc/91/54/93/387915493.db2.gz NYWNTDCYLNUSDH-UHFFFAOYSA-N 1 1 221.369 3.599 20 0 BHADMO c1cc2c(s1)CCC[N@H+](CC1=CCCC1)C2 ZINC000645800803 387939281 /nfs/dbraw/zinc/93/92/81/387939281.db2.gz XOAHVBMXBKBGME-UHFFFAOYSA-N 1 1 233.380 3.607 20 0 BHADMO C1=C(C[N@@H+](C2CC2)C2CCCC2)CCC1 ZINC000645801050 387938908 /nfs/dbraw/zinc/93/89/08/387938908.db2.gz HYDQZMATKGRWNV-UHFFFAOYSA-N 1 1 205.345 3.504 20 0 BHADMO Cc1cnc(CC[N@@H+]2CCCCC[C@@H]2C)c(C)c1 ZINC000645803226 387943968 /nfs/dbraw/zinc/94/39/68/387943968.db2.gz IBMPXTDBZRMMHX-HNNXBMFYSA-N 1 1 246.398 3.505 20 0 BHADMO Cc1cnc(CC[N@@H+]2CCCCC[C@H]2C)c(C)c1 ZINC000645803227 387943276 /nfs/dbraw/zinc/94/32/76/387943276.db2.gz IBMPXTDBZRMMHX-OAHLLOKOSA-N 1 1 246.398 3.505 20 0 BHADMO C[C@@H]1c2ccccc2C[N@@H+]1CC1=CCCC1 ZINC000645811362 387964091 /nfs/dbraw/zinc/96/40/91/387964091.db2.gz OKJNTPUSFMABAX-GFCCVEGCSA-N 1 1 213.324 3.674 20 0 BHADMO C1=C(C[N@H+]2CC[C@H]2c2ccccc2)CCC1 ZINC000645812175 387973872 /nfs/dbraw/zinc/97/38/72/387973872.db2.gz RDORGJWZOKQSSZ-HNNXBMFYSA-N 1 1 213.324 3.544 20 0 BHADMO C1=C(C[N@H+]2CC[C@@H]2c2ccccc2)CCC1 ZINC000645812176 387974286 /nfs/dbraw/zinc/97/42/86/387974286.db2.gz RDORGJWZOKQSSZ-OAHLLOKOSA-N 1 1 213.324 3.544 20 0 BHADMO Fc1cccc([C@@H]2CC[N@H+]2CC2=CCCC2)c1 ZINC000645812181 387974981 /nfs/dbraw/zinc/97/49/81/387974981.db2.gz RUXZWDSKZXMCQH-HNNXBMFYSA-N 1 1 231.314 3.683 20 0 BHADMO Fc1cccc([C@H]2CC[N@H+]2CC2=CCCC2)c1 ZINC000645812182 387974741 /nfs/dbraw/zinc/97/47/41/387974741.db2.gz RUXZWDSKZXMCQH-OAHLLOKOSA-N 1 1 231.314 3.683 20 0 BHADMO CC[N@@H+](CC1=CCCC1)[C@H](C)c1cccc(O)c1 ZINC000645812266 387976138 /nfs/dbraw/zinc/97/61/38/387976138.db2.gz WMEVCISKKRDHSO-CYBMUJFWSA-N 1 1 245.366 3.885 20 0 BHADMO CC[N@@H+](CC1=CCCC1)[C@@H](C)c1cccc(O)c1 ZINC000645812267 387976335 /nfs/dbraw/zinc/97/63/35/387976335.db2.gz WMEVCISKKRDHSO-ZDUSSCGKSA-N 1 1 245.366 3.885 20 0 BHADMO FC(F)(F)CC[N@H+](CC1=CCCC1)CC1CC1 ZINC000645813624 397924623 /nfs/dbraw/zinc/92/46/23/397924623.db2.gz JBBMRMQYSQRVIL-UHFFFAOYSA-N 1 1 247.304 3.761 20 0 BHADMO Cc1cccc([C@@H]2CCC[N@H+]2CC2=CCCC2)n1 ZINC000645815962 387995971 /nfs/dbraw/zinc/99/59/71/387995971.db2.gz FPRHFIHZSBWVEG-INIZCTEOSA-N 1 1 242.366 3.637 20 0 BHADMO Cc1cccc([C@H]2CCC[N@H+]2CC2=CCCC2)n1 ZINC000645815963 387996104 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ZINC000645857694 387878092 /nfs/dbraw/zinc/87/80/92/387878092.db2.gz SZWPJLLYVXIJSK-CJNGLKHVSA-N 1 1 242.366 3.575 20 0 BHADMO C[C@@H]1C[C@H](c2cccnc2)[N@@H+](CC2=CCCC2)C1 ZINC000645857695 387877839 /nfs/dbraw/zinc/87/78/39/387877839.db2.gz SZWPJLLYVXIJSK-CZUORRHYSA-N 1 1 242.366 3.575 20 0 BHADMO C[C@H]1C[C@H](c2cccnc2)[N@@H+](CC2=CCCC2)C1 ZINC000645857696 387877545 /nfs/dbraw/zinc/87/75/45/387877545.db2.gz SZWPJLLYVXIJSK-XJKSGUPXSA-N 1 1 242.366 3.575 20 0 BHADMO Cc1nc([C@H]2CCC[N@H+]2CC2=CCCC2)cs1 ZINC000645861311 387882583 /nfs/dbraw/zinc/88/25/83/387882583.db2.gz YQJWXDPILQDYEW-CQSZACIVSA-N 1 1 248.395 3.699 20 0 BHADMO CC1(C)[C@H](C(F)(F)F)CC[N@H+]1CC1=CCCC1 ZINC000645886617 387982464 /nfs/dbraw/zinc/98/24/64/387982464.db2.gz YJSISTAUJXNLOU-LLVKDONJSA-N 1 1 247.304 3.760 20 0 BHADMO CC1(C)[C@@H](C(F)(F)F)CC[N@H+]1CC1=CCCC1 ZINC000645886618 387981735 /nfs/dbraw/zinc/98/17/35/387981735.db2.gz YJSISTAUJXNLOU-NSHDSACASA-N 1 1 247.304 3.760 20 0 BHADMO Cc1cnc(CC[N@H+](C)C2(C)CCCC2)c(C)c1 ZINC000645894279 388039003 /nfs/dbraw/zinc/03/90/03/388039003.db2.gz KTAFXGRSWWBDGV-UHFFFAOYSA-N 1 1 246.398 3.505 20 0 BHADMO C[N@@H+](CC1=CCCC1)C1CCC(F)(F)CC1 ZINC000645916339 388252884 /nfs/dbraw/zinc/25/28/84/388252884.db2.gz RYXPYFWUXOAZPS-UHFFFAOYSA-N 1 1 229.314 3.606 20 0 BHADMO c1coc([C@@H]2[N@@H+](CC3=CCCC3)CC23CCC3)c1 ZINC000645925653 388102171 /nfs/dbraw/zinc/10/21/71/388102171.db2.gz IUNIXFDGMYOFMY-HNNXBMFYSA-N 1 1 243.350 3.917 20 0 BHADMO c1coc([C@H]2[N@@H+](CC3=CCCC3)CC23CCC3)c1 ZINC000645925654 388102837 /nfs/dbraw/zinc/10/28/37/388102837.db2.gz IUNIXFDGMYOFMY-OAHLLOKOSA-N 1 1 243.350 3.917 20 0 BHADMO CC[N@@H+](CC1=CCCC1)Cc1occc1C ZINC000645928425 388166206 /nfs/dbraw/zinc/16/62/06/388166206.db2.gz CFXJQCVDORSKBS-UHFFFAOYSA-N 1 1 219.328 3.520 20 0 BHADMO FC(F)(F)C[C@H]1CCC[N@@H+](CC2=CCCC2)C1 ZINC000645928738 388167513 /nfs/dbraw/zinc/16/75/13/388167513.db2.gz FZNMWGHEHFXMFQ-GFCCVEGCSA-N 1 1 247.304 3.761 20 0 BHADMO FC(F)(F)C[C@@H]1CCC[N@@H+](CC2=CCCC2)C1 ZINC000645928739 388167328 /nfs/dbraw/zinc/16/73/28/388167328.db2.gz FZNMWGHEHFXMFQ-LBPRGKRZSA-N 1 1 247.304 3.761 20 0 BHADMO Cc1ccc(C[N@@H+](CCC(C)C)CC2CC2)cn1 ZINC000646019197 388124855 /nfs/dbraw/zinc/12/48/55/388124855.db2.gz UOUBJTGCZQCMKX-UHFFFAOYSA-N 1 1 246.398 3.648 20 0 BHADMO CC(C)=CC[N@H+](Cc1ccc(C)nc1)CC1CC1 ZINC000646019218 388125154 /nfs/dbraw/zinc/12/51/54/388125154.db2.gz VZVYOTWOXJYYHA-UHFFFAOYSA-N 1 1 244.382 3.568 20 0 BHADMO CC[C@@H](C)C[N@H+](Cc1ccc(C)nc1)CC1CC1 ZINC000646019439 388124914 /nfs/dbraw/zinc/12/49/14/388124914.db2.gz DIBWEZFNBWHMHK-CYBMUJFWSA-N 1 1 246.398 3.648 20 0 BHADMO CC[C@H](C)C[N@H+](Cc1ccc(C)nc1)CC1CC1 ZINC000646019440 388125083 /nfs/dbraw/zinc/12/50/83/388125083.db2.gz DIBWEZFNBWHMHK-ZDUSSCGKSA-N 1 1 246.398 3.648 20 0 BHADMO Cc1nc(C)c(C[N@@H+](C)CCC(C)(C)C)s1 ZINC000646027895 388126950 /nfs/dbraw/zinc/12/69/50/388126950.db2.gz MYQASZYLHXQCFP-UHFFFAOYSA-N 1 1 240.416 3.628 20 0 BHADMO C[N@@H+](CCC(C)(C)C)Cc1ccncc1Cl ZINC000646027948 388126610 /nfs/dbraw/zinc/12/66/10/388126610.db2.gz RLGCQWCVQMUVRJ-UHFFFAOYSA-N 1 1 240.778 3.603 20 0 BHADMO Cc1nc(C[N@@H+](C)CCC(C)(C)C)sc1C ZINC000646027974 388128658 /nfs/dbraw/zinc/12/86/58/388128658.db2.gz UGNIJIZANGNNKU-UHFFFAOYSA-N 1 1 240.416 3.628 20 0 BHADMO C[N@@H+](CCCC1CCOCC1)CCC(C)(C)C ZINC000646028535 388127982 /nfs/dbraw/zinc/12/79/82/388127982.db2.gz AJVQKQFVDDPZGQ-UHFFFAOYSA-N 1 1 241.419 3.561 20 0 BHADMO C[N@@H+](CCC(C)(C)C)Cc1ccc(Cl)cn1 ZINC000646028558 388128243 /nfs/dbraw/zinc/12/82/43/388128243.db2.gz DESBLOSBJVJVDT-UHFFFAOYSA-N 1 1 240.778 3.603 20 0 BHADMO C[N@@H+](CCC(C)(C)C)Cc1ncc(Cl)s1 ZINC000646028621 388128630 /nfs/dbraw/zinc/12/86/30/388128630.db2.gz KYBKNNHJIVBMIB-UHFFFAOYSA-N 1 1 246.807 3.665 20 0 BHADMO C[N@H+](CCC(C)(C)C)Cc1ncc(Cl)s1 ZINC000646028621 388128627 /nfs/dbraw/zinc/12/86/27/388128627.db2.gz KYBKNNHJIVBMIB-UHFFFAOYSA-N 1 1 246.807 3.665 20 0 BHADMO C[N@@H+](CCCCOC(C)(C)C)CCC(C)(C)C ZINC000646028751 388128402 /nfs/dbraw/zinc/12/84/02/388128402.db2.gz ZODGTKLXSCLNJB-UHFFFAOYSA-N 1 1 243.435 3.950 20 0 BHADMO Cc1ccc(C[N@@H+](C)CCC(C)(C)C)c(C)n1 ZINC000646028756 388127821 /nfs/dbraw/zinc/12/78/21/388127821.db2.gz ZYXTXUIQCGKLGT-UHFFFAOYSA-N 1 1 234.387 3.566 20 0 BHADMO CC(=O)c1cccc(C[N@@H+](C)CCC(C)(C)C)c1 ZINC000646028957 388127828 /nfs/dbraw/zinc/12/78/28/388127828.db2.gz QEKMDZSDCXHZDH-UHFFFAOYSA-N 1 1 247.382 3.757 20 0 BHADMO CCc1ccc(C[N@@H+](C)CCC(C)(C)C)nc1 ZINC000646028964 388127897 /nfs/dbraw/zinc/12/78/97/388127897.db2.gz RCEPJALUHNRXOD-UHFFFAOYSA-N 1 1 234.387 3.512 20 0 BHADMO Cc1cnc(CC[N@H+](C)CCC(C)(C)C)c(C)c1 ZINC000646028989 388128277 /nfs/dbraw/zinc/12/82/77/388128277.db2.gz TUWYWSZTIQHPMB-UHFFFAOYSA-N 1 1 248.414 3.609 20 0 BHADMO C[N@@H+](CCC(C)(C)C)C[C@@H]1CCC(F)(F)C1 ZINC000646029035 388127884 /nfs/dbraw/zinc/12/78/84/388127884.db2.gz WUXSUVYSMORMBC-LLVKDONJSA-N 1 1 233.346 3.790 20 0 BHADMO C[N@@H+](CCC(C)(C)C)C[C@H]1CCC(F)(F)C1 ZINC000646029036 388128800 /nfs/dbraw/zinc/12/88/00/388128800.db2.gz WUXSUVYSMORMBC-NSHDSACASA-N 1 1 233.346 3.790 20 0 BHADMO Cc1sccc1C[N@@H+](C)Cc1ccsc1 ZINC000646048912 388132790 /nfs/dbraw/zinc/13/27/90/388132790.db2.gz HCVGGOJMEPOZJX-UHFFFAOYSA-N 1 1 237.393 3.750 20 0 BHADMO Cc1sccc1C[N@H+](C)CCC(C)C ZINC000646053133 388133703 /nfs/dbraw/zinc/13/37/03/388133703.db2.gz QTGPYLIGTDUHLA-UHFFFAOYSA-N 1 1 211.374 3.534 20 0 BHADMO CC[N@@H+](Cc1ccoc1)Cc1ccsc1C ZINC000646071534 388137065 /nfs/dbraw/zinc/13/70/65/388137065.db2.gz NPOZUHJTFOEOIS-UHFFFAOYSA-N 1 1 235.352 3.672 20 0 BHADMO Cc1sccc1C[N@H+]1CC[C@@H](c2ccco2)C1 ZINC000646086493 388139371 /nfs/dbraw/zinc/13/93/71/388139371.db2.gz ILRBMZZSNBIWAU-CYBMUJFWSA-N 1 1 247.363 3.639 20 0 BHADMO Cc1sccc1C[N@H+]1CC[C@H](c2ccco2)C1 ZINC000646086494 388139319 /nfs/dbraw/zinc/13/93/19/388139319.db2.gz ILRBMZZSNBIWAU-ZDUSSCGKSA-N 1 1 247.363 3.639 20 0 BHADMO C[N@@H+](Cc1cc(-c2ccccc2)no1)C(C)(C)C ZINC000646087257 388139953 /nfs/dbraw/zinc/13/99/53/388139953.db2.gz AEYMDOREGGLMIQ-UHFFFAOYSA-N 1 1 244.338 3.572 20 0 BHADMO C[N@@H+](Cc1cccc(OC(F)F)c1)C(C)(C)C ZINC000646087629 388139527 /nfs/dbraw/zinc/13/95/27/388139527.db2.gz KLGPRWKNTUXVDO-UHFFFAOYSA-N 1 1 243.297 3.518 20 0 BHADMO C[N@@H+](CCSc1ccccc1)C(C)(C)C ZINC000646087671 388139454 /nfs/dbraw/zinc/13/94/54/388139454.db2.gz UALFXBSVYHIIKV-UHFFFAOYSA-N 1 1 223.385 3.509 20 0 BHADMO C[N@@H+](Cc1nc2ccccc2s1)C(C)(C)C ZINC000646087786 388139972 /nfs/dbraw/zinc/13/99/72/388139972.db2.gz VVWRXKWXCHGCDB-UHFFFAOYSA-N 1 1 234.368 3.527 20 0 BHADMO COc1ccc(C[N@@H+](C)C(C)(C)C)c(Cl)c1 ZINC000646088457 388140015 /nfs/dbraw/zinc/14/00/15/388140015.db2.gz MCQDJELFMDUCQI-UHFFFAOYSA-N 1 1 241.762 3.579 20 0 BHADMO CCC[N@H+]1CC2(CC=CC2)[C@@H]1c1ccccc1 ZINC000646116799 388145886 /nfs/dbraw/zinc/14/58/86/388145886.db2.gz GBRPLPIDSHLREK-HNNXBMFYSA-N 1 1 227.351 3.790 20 0 BHADMO CCC[N@H+]1CC2(CC=CC2)[C@H]1c1ccccc1 ZINC000646116800 388145909 /nfs/dbraw/zinc/14/59/09/388145909.db2.gz GBRPLPIDSHLREK-OAHLLOKOSA-N 1 1 227.351 3.790 20 0 BHADMO CC(C)[N@H+]1CC2(CC=CC2)[C@@H]1c1ccccc1 ZINC000646117384 388145474 /nfs/dbraw/zinc/14/54/74/388145474.db2.gz YCEQKDNPWXWSEH-HNNXBMFYSA-N 1 1 227.351 3.788 20 0 BHADMO CC(C)[N@H+]1CC2(CC=CC2)[C@H]1c1ccccc1 ZINC000646117385 388145915 /nfs/dbraw/zinc/14/59/15/388145915.db2.gz YCEQKDNPWXWSEH-OAHLLOKOSA-N 1 1 227.351 3.788 20 0 BHADMO C1=CCC2(C[N@H+](CC3CC3)[C@H]2c2ccccc2)C1 ZINC000646117582 388145888 /nfs/dbraw/zinc/14/58/88/388145888.db2.gz GXMJTJLWHFYNGE-INIZCTEOSA-N 1 1 239.362 3.790 20 0 BHADMO C1=CCC2(C[N@H+](CC3CC3)[C@@H]2c2ccccc2)C1 ZINC000646117583 388145662 /nfs/dbraw/zinc/14/56/62/388145662.db2.gz GXMJTJLWHFYNGE-MRXNPFEDSA-N 1 1 239.362 3.790 20 0 BHADMO FCCC[N@H+]1CC2(CC=CC2)[C@@H]1c1ccccc1 ZINC000646117617 388145769 /nfs/dbraw/zinc/14/57/69/388145769.db2.gz JIOPFVYRZCDFQG-HNNXBMFYSA-N 1 1 245.341 3.739 20 0 BHADMO FCCC[N@H+]1CC2(CC=CC2)[C@H]1c1ccccc1 ZINC000646117618 388145883 /nfs/dbraw/zinc/14/58/83/388145883.db2.gz JIOPFVYRZCDFQG-OAHLLOKOSA-N 1 1 245.341 3.739 20 0 BHADMO Cc1cccc(C[N@H+]2CCCC[C@H]2C2CCC2)n1 ZINC000646139103 388153948 /nfs/dbraw/zinc/15/39/48/388153948.db2.gz IRAZNOFTGDECJV-INIZCTEOSA-N 1 1 244.382 3.545 20 0 BHADMO Cc1cccc(C[N@H+]2CCCC[C@@H]2C2CCC2)n1 ZINC000646139106 388153848 /nfs/dbraw/zinc/15/38/48/388153848.db2.gz IRAZNOFTGDECJV-MRXNPFEDSA-N 1 1 244.382 3.545 20 0 BHADMO Cc1ccncc1C[N@H+]1CCCC[C@H]1C1CCC1 ZINC000646139128 388154515 /nfs/dbraw/zinc/15/45/15/388154515.db2.gz JLDXZRDDDFRHAB-INIZCTEOSA-N 1 1 244.382 3.545 20 0 BHADMO Cc1ccncc1C[N@H+]1CCCC[C@@H]1C1CCC1 ZINC000646139130 388154811 /nfs/dbraw/zinc/15/48/11/388154811.db2.gz JLDXZRDDDFRHAB-MRXNPFEDSA-N 1 1 244.382 3.545 20 0 BHADMO Cc1ccc(C[N@H+]2CCCC[C@H]2C2CCC2)nc1 ZINC000646139217 388154916 /nfs/dbraw/zinc/15/49/16/388154916.db2.gz JSEMBGATFGRBRQ-INIZCTEOSA-N 1 1 244.382 3.545 20 0 BHADMO Cc1ccc(C[N@H+]2CCCC[C@@H]2C2CCC2)nc1 ZINC000646139218 388154837 /nfs/dbraw/zinc/15/48/37/388154837.db2.gz JSEMBGATFGRBRQ-MRXNPFEDSA-N 1 1 244.382 3.545 20 0 BHADMO Cc1cccnc1C[N@H+]1CCCC[C@H]1C1CCC1 ZINC000646139379 388154770 /nfs/dbraw/zinc/15/47/70/388154770.db2.gz QQIPKPGAEDZPMA-INIZCTEOSA-N 1 1 244.382 3.545 20 0 BHADMO Cc1cccnc1C[N@H+]1CCCC[C@@H]1C1CCC1 ZINC000646139380 388154468 /nfs/dbraw/zinc/15/44/68/388154468.db2.gz QQIPKPGAEDZPMA-MRXNPFEDSA-N 1 1 244.382 3.545 20 0 BHADMO FC(F)(F)CC[N@H+]1CCCC[C@@H]1C1CCC1 ZINC000646139393 388154904 /nfs/dbraw/zinc/15/49/04/388154904.db2.gz RDKXFIPGYDNZMY-LLVKDONJSA-N 1 1 235.293 3.593 20 0 BHADMO FC(F)(F)CC[N@H+]1CCCC[C@H]1C1CCC1 ZINC000646139394 388154519 /nfs/dbraw/zinc/15/45/19/388154519.db2.gz RDKXFIPGYDNZMY-NSHDSACASA-N 1 1 235.293 3.593 20 0 BHADMO Cc1cncc(C[N@H+]2CCCC[C@H]2C2CCC2)c1 ZINC000646139839 388154398 /nfs/dbraw/zinc/15/43/98/388154398.db2.gz DIYWBMSJWQCPFQ-INIZCTEOSA-N 1 1 244.382 3.545 20 0 BHADMO Cc1cncc(C[N@H+]2CCCC[C@@H]2C2CCC2)c1 ZINC000646139840 388154402 /nfs/dbraw/zinc/15/44/02/388154402.db2.gz DIYWBMSJWQCPFQ-MRXNPFEDSA-N 1 1 244.382 3.545 20 0 BHADMO Cc1ccnc(C[N@H+]2CCCC[C@H]2C2CCC2)c1 ZINC000646139847 388154428 /nfs/dbraw/zinc/15/44/28/388154428.db2.gz DSMKMNMYWQKXSO-INIZCTEOSA-N 1 1 244.382 3.545 20 0 BHADMO Cc1ccnc(C[N@H+]2CCCC[C@@H]2C2CCC2)c1 ZINC000646139848 388154797 /nfs/dbraw/zinc/15/47/97/388154797.db2.gz DSMKMNMYWQKXSO-MRXNPFEDSA-N 1 1 244.382 3.545 20 0 BHADMO Cc1ncccc1C[N@H+]1CCCC[C@H]1C1CCC1 ZINC000646139885 388154498 /nfs/dbraw/zinc/15/44/98/388154498.db2.gz GDEOWQARTGNRHB-INIZCTEOSA-N 1 1 244.382 3.545 20 0 BHADMO Cc1ncccc1C[N@H+]1CCCC[C@@H]1C1CCC1 ZINC000646139886 388154604 /nfs/dbraw/zinc/15/46/04/388154604.db2.gz GDEOWQARTGNRHB-MRXNPFEDSA-N 1 1 244.382 3.545 20 0 BHADMO CCn1ccc(C[N@@H+](C)Cc2ccsc2C)c1 ZINC000646173370 388159664 /nfs/dbraw/zinc/15/96/64/388159664.db2.gz WUMZTUDXARTXOS-UHFFFAOYSA-N 1 1 248.395 3.510 20 0 BHADMO CC1(C)C[N@@H+](CC2CCCC2)[C@H]1c1ccncc1 ZINC000646216479 388166730 /nfs/dbraw/zinc/16/67/30/388166730.db2.gz VKRCKWIHQKUVMX-HNNXBMFYSA-N 1 1 244.382 3.655 20 0 BHADMO CC1(C)C[N@@H+](CC2CCCC2)[C@@H]1c1ccncc1 ZINC000646216480 388166818 /nfs/dbraw/zinc/16/68/18/388166818.db2.gz VKRCKWIHQKUVMX-OAHLLOKOSA-N 1 1 244.382 3.655 20 0 BHADMO C[C@@H]1C[N@@H+](Cc2c(Cl)oc3ccccc32)[C@@H]1C ZINC000646252542 388171109 /nfs/dbraw/zinc/17/11/09/388171109.db2.gz MIDSEVYGCFAVOM-NXEZZACHSA-N 1 1 249.741 3.926 20 0 BHADMO C[C@H]1C[N@@H+](Cc2c(Cl)oc3ccccc32)[C@H]1C ZINC000646252543 388170841 /nfs/dbraw/zinc/17/08/41/388170841.db2.gz MIDSEVYGCFAVOM-UWVGGRQHSA-N 1 1 249.741 3.926 20 0 BHADMO C[C@@H]1[C@@H](C)C[N@H+]1Cc1c(Cl)oc2ccccc21 ZINC000646252544 388171014 /nfs/dbraw/zinc/17/10/14/388171014.db2.gz MIDSEVYGCFAVOM-VHSXEESVSA-N 1 1 249.741 3.926 20 0 BHADMO C[C@@H]1C[N@@H+](Cc2c(Cl)oc3ccccc32)[C@H]1C ZINC000646252545 388170718 /nfs/dbraw/zinc/17/07/18/388170718.db2.gz MIDSEVYGCFAVOM-ZJUUUORDSA-N 1 1 249.741 3.926 20 0 BHADMO CC(C)COc1cccc(C[N@H+]2C[C@H](C)[C@@H]2C)c1 ZINC000646252631 388170929 /nfs/dbraw/zinc/17/09/29/388170929.db2.gz MAGLBXBMDGGBLC-KBPBESRZSA-N 1 1 247.382 3.562 20 0 BHADMO CC(C)COc1cccc(C[N@H+]2C[C@@H](C)[C@@H]2C)c1 ZINC000646252632 388170728 /nfs/dbraw/zinc/17/07/28/388170728.db2.gz MAGLBXBMDGGBLC-KGLIPLIRSA-N 1 1 247.382 3.562 20 0 BHADMO CC(C)COc1cccc(C[N@H+]2C[C@H](C)[C@H]2C)c1 ZINC000646252633 388171061 /nfs/dbraw/zinc/17/10/61/388171061.db2.gz MAGLBXBMDGGBLC-UONOGXRCSA-N 1 1 247.382 3.562 20 0 BHADMO CC(C)COc1cccc(C[N@H+]2C[C@@H](C)[C@H]2C)c1 ZINC000646252634 388170918 /nfs/dbraw/zinc/17/09/18/388170918.db2.gz MAGLBXBMDGGBLC-ZIAGYGMSSA-N 1 1 247.382 3.562 20 0 BHADMO CCCC[N@@H+](Cc1cn[nH]c1)[C@@H]1CCC[C@H](C)C1 ZINC000646273119 388174266 /nfs/dbraw/zinc/17/42/66/388174266.db2.gz IAYFJRQJTLQDBA-DZGCQCFKSA-N 1 1 249.402 3.591 20 0 BHADMO CCCC[N@@H+](Cc1cn[nH]c1)[C@H]1CCC[C@@H](C)C1 ZINC000646273120 388174677 /nfs/dbraw/zinc/17/46/77/388174677.db2.gz IAYFJRQJTLQDBA-HIFRSBDPSA-N 1 1 249.402 3.591 20 0 BHADMO CCCC[N@@H+](Cc1cn[nH]c1)[C@@H]1CCC[C@@H](C)C1 ZINC000646273121 388174319 /nfs/dbraw/zinc/17/43/19/388174319.db2.gz IAYFJRQJTLQDBA-UKRRQHHQSA-N 1 1 249.402 3.591 20 0 BHADMO CCCC[N@@H+](Cc1cn[nH]c1)[C@H]1CCC[C@H](C)C1 ZINC000646273122 388174588 /nfs/dbraw/zinc/17/45/88/388174588.db2.gz IAYFJRQJTLQDBA-ZFWWWQNUSA-N 1 1 249.402 3.591 20 0 BHADMO CCCC[C@@H](C)[N@@H+](CCCC)Cc1cn[nH]c1 ZINC000646274371 388174577 /nfs/dbraw/zinc/17/45/77/388174577.db2.gz QKYIHSQMGHABOM-CYBMUJFWSA-N 1 1 237.391 3.591 20 0 BHADMO CCCC[C@H](C)[N@@H+](CCCC)Cc1cn[nH]c1 ZINC000646274372 388174597 /nfs/dbraw/zinc/17/45/97/388174597.db2.gz QKYIHSQMGHABOM-ZDUSSCGKSA-N 1 1 237.391 3.591 20 0 BHADMO Cc1cc(C)c(C[N@H+]2CCC[C@H]2CF)cc1C ZINC000646277105 388175294 /nfs/dbraw/zinc/17/52/94/388175294.db2.gz VSZDFRJJXMVPIQ-HNNXBMFYSA-N 1 1 235.346 3.546 20 0 BHADMO Cc1cc(C)c(C[N@H+]2CCC[C@@H]2CF)cc1C ZINC000646277106 388175337 /nfs/dbraw/zinc/17/53/37/388175337.db2.gz VSZDFRJJXMVPIQ-OAHLLOKOSA-N 1 1 235.346 3.546 20 0 BHADMO Fc1ccccc1C1([NH2+]Cc2ccco2)CCC1 ZINC000647237348 384849392 /nfs/dbraw/zinc/84/93/92/384849392.db2.gz TYHJWQJPSPDLEW-UHFFFAOYSA-N 1 1 245.297 3.588 20 0 BHADMO CCc1ccc[nH+]c1NC1CCC(F)(F)CC1 ZINC000647298960 385028653 /nfs/dbraw/zinc/02/86/53/385028653.db2.gz GVSQHRJQECWLCY-UHFFFAOYSA-N 1 1 240.297 3.634 20 0 BHADMO C[C@@H](C[N@@H+](C)Cc1ccncc1)C1CCCCC1 ZINC000647912378 385674721 /nfs/dbraw/zinc/67/47/21/385674721.db2.gz GFNAXPIHYWWQAG-AWEZNQCLSA-N 1 1 246.398 3.730 20 0 BHADMO C[C@H](C[N@@H+](C)Cc1ccncc1)C1CCCCC1 ZINC000647912379 385676291 /nfs/dbraw/zinc/67/62/91/385676291.db2.gz GFNAXPIHYWWQAG-CQSZACIVSA-N 1 1 246.398 3.730 20 0 BHADMO CC[C@@H]1CCCC[N@H+]1Cc1c(C)nsc1C ZINC000647956875 386698046 /nfs/dbraw/zinc/69/80/46/386698046.db2.gz NBTZXALSDRYHHJ-GFCCVEGCSA-N 1 1 238.400 3.524 20 0 BHADMO CC[C@H]1CCCC[N@H+]1Cc1c(C)nsc1C ZINC000647956876 386697606 /nfs/dbraw/zinc/69/76/06/386697606.db2.gz NBTZXALSDRYHHJ-LBPRGKRZSA-N 1 1 238.400 3.524 20 0 BHADMO Cc1nc(C[N@H+]2CCC[C@H]2C2CCCCC2)co1 ZINC000647959717 386720454 /nfs/dbraw/zinc/72/04/54/386720454.db2.gz HTOLFAFYGAZCHT-HNNXBMFYSA-N 1 1 248.370 3.528 20 0 BHADMO Cc1nc(C[N@H+]2CCC[C@@H]2C2CCCCC2)co1 ZINC000647959718 386720485 /nfs/dbraw/zinc/72/04/85/386720485.db2.gz HTOLFAFYGAZCHT-OAHLLOKOSA-N 1 1 248.370 3.528 20 0 BHADMO Cc1nc(C[N@@H+](CC2CCCCC2)C2CC2)co1 ZINC000647959881 386720754 /nfs/dbraw/zinc/72/07/54/386720754.db2.gz SCQIXWIVDJHGDB-UHFFFAOYSA-N 1 1 248.370 3.528 20 0 BHADMO Cc1nc(C[N@@H+](CC2CC2)C2CCCCC2)co1 ZINC000647962045 386733960 /nfs/dbraw/zinc/73/39/60/386733960.db2.gz KJOVCVUWECRDCW-UHFFFAOYSA-N 1 1 248.370 3.528 20 0 BHADMO C[C@@H](C[N@H+]1CC[C@@H](c2cccnc2)C1)C(C)(C)C ZINC000648052737 386593938 /nfs/dbraw/zinc/59/39/38/386593938.db2.gz DWBFNYKXAHHBIF-DZGCQCFKSA-N 1 1 246.398 3.553 20 0 BHADMO C[C@H](C[N@H+]1CC[C@H](c2cccnc2)C1)C(C)(C)C ZINC000648052738 386594036 /nfs/dbraw/zinc/59/40/36/386594036.db2.gz DWBFNYKXAHHBIF-HIFRSBDPSA-N 1 1 246.398 3.553 20 0 BHADMO C[C@H](C[N@H+]1CC[C@@H](c2cccnc2)C1)C(C)(C)C ZINC000648052739 386594259 /nfs/dbraw/zinc/59/42/59/386594259.db2.gz DWBFNYKXAHHBIF-UKRRQHHQSA-N 1 1 246.398 3.553 20 0 BHADMO C[C@@H](C[N@H+]1CC[C@H](c2cccnc2)C1)C(C)(C)C ZINC000648052740 386594315 /nfs/dbraw/zinc/59/43/15/386594315.db2.gz DWBFNYKXAHHBIF-ZFWWWQNUSA-N 1 1 246.398 3.553 20 0 BHADMO Cc1ccc(CCC[N@H+](C)CCC(C)(C)C)cn1 ZINC000648059746 386685652 /nfs/dbraw/zinc/68/56/52/386685652.db2.gz HDNRCWFHYMWYAP-UHFFFAOYSA-N 1 1 248.414 3.691 20 0 BHADMO C[N@@H+](CCC(C)(C)C)Cc1cc2cccnc2o1 ZINC000648059772 386686418 /nfs/dbraw/zinc/68/64/18/386686418.db2.gz ISUDHYRLAPHGNM-UHFFFAOYSA-N 1 1 246.354 3.696 20 0 BHADMO C[N@@H+](Cc1cc2ccc(F)cc2[nH]1)C(C)(C)C ZINC000648070176 386776674 /nfs/dbraw/zinc/77/66/74/386776674.db2.gz FETRYUZGXCDLFV-UHFFFAOYSA-N 1 1 234.318 3.537 20 0 BHADMO C[N@@H+](Cc1ccc2occc2c1)C(C)(C)C ZINC000648070188 386776323 /nfs/dbraw/zinc/77/63/23/386776323.db2.gz GRMSVXCRCRDEOZ-UHFFFAOYSA-N 1 1 217.312 3.663 20 0 BHADMO C[N@@H+](Cc1coc2ccccc12)C(C)(C)C ZINC000648070214 386776522 /nfs/dbraw/zinc/77/65/22/386776522.db2.gz JKZPIQBVIFVDQE-UHFFFAOYSA-N 1 1 217.312 3.663 20 0 BHADMO C[N@@H+](Cc1cscc1Cl)C(C)(C)C ZINC000648070275 386779647 /nfs/dbraw/zinc/77/96/47/386779647.db2.gz NCLCVGLEQJHVBT-UHFFFAOYSA-N 1 1 217.765 3.632 20 0 BHADMO Oc1ccc(C[N@H+]2CCCC[C@H]2C2CCC2)cc1 ZINC000648077738 387506594 /nfs/dbraw/zinc/50/65/94/387506594.db2.gz FUHSOMUMAUIPNF-INIZCTEOSA-N 1 1 245.366 3.547 20 0 BHADMO Oc1ccc(C[N@H+]2CCCC[C@@H]2C2CCC2)cc1 ZINC000648077739 387506369 /nfs/dbraw/zinc/50/63/69/387506369.db2.gz FUHSOMUMAUIPNF-MRXNPFEDSA-N 1 1 245.366 3.547 20 0 BHADMO Oc1cccc(C[N@H+]2CCCC[C@H]2C2CCC2)c1 ZINC000648077993 387504734 /nfs/dbraw/zinc/50/47/34/387504734.db2.gz VFLHHNVUDHOIIU-INIZCTEOSA-N 1 1 245.366 3.547 20 0 BHADMO Oc1cccc(C[N@H+]2CCCC[C@@H]2C2CCC2)c1 ZINC000648077994 387508344 /nfs/dbraw/zinc/50/83/44/387508344.db2.gz VFLHHNVUDHOIIU-MRXNPFEDSA-N 1 1 245.366 3.547 20 0 BHADMO Cc1cnccc1C[N@H+]1CCCC[C@H]1C1CCC1 ZINC000648078009 387507526 /nfs/dbraw/zinc/50/75/26/387507526.db2.gz WBWLNEHAUYOYJJ-INIZCTEOSA-N 1 1 244.382 3.545 20 0 BHADMO Cc1cnccc1C[N@H+]1CCCC[C@@H]1C1CCC1 ZINC000648078010 387508674 /nfs/dbraw/zinc/50/86/74/387508674.db2.gz WBWLNEHAUYOYJJ-MRXNPFEDSA-N 1 1 244.382 3.545 20 0 BHADMO Cc1ccc(C[N@H+]2CCCC[C@H]2C2CCC2)cn1 ZINC000648078073 387506444 /nfs/dbraw/zinc/50/64/44/387506444.db2.gz ZDMLOLHQMUNVQB-INIZCTEOSA-N 1 1 244.382 3.545 20 0 BHADMO Cc1ccc(C[N@H+]2CCCC[C@@H]2C2CCC2)cn1 ZINC000648078074 387506563 /nfs/dbraw/zinc/50/65/63/387506563.db2.gz ZDMLOLHQMUNVQB-MRXNPFEDSA-N 1 1 244.382 3.545 20 0 BHADMO Cc1cnccc1C[N@H+](C(C)C)C1CCCCC1 ZINC000648348322 385302414 /nfs/dbraw/zinc/30/24/14/385302414.db2.gz GCGGQONEWSFVDC-UHFFFAOYSA-N 1 1 246.398 3.933 20 0 BHADMO Cc1cc(C[N@@H+](C)Cc2ccsc2)cs1 ZINC000648350891 385306411 /nfs/dbraw/zinc/30/64/11/385306411.db2.gz BBXKTLZFPRAUGC-UHFFFAOYSA-N 1 1 237.393 3.750 20 0 BHADMO Fc1cnccc1C[N@@H+](C1CC1)C1CCCCC1 ZINC000648358513 385324724 /nfs/dbraw/zinc/32/47/24/385324724.db2.gz PZKILGILUVKPNO-UHFFFAOYSA-N 1 1 248.345 3.518 20 0 BHADMO Cc1cnccc1C[N@@H+](C1CC1)C1CCCCC1 ZINC000648358538 385323794 /nfs/dbraw/zinc/32/37/94/385323794.db2.gz VRSQLEBIQVGWPG-UHFFFAOYSA-N 1 1 244.382 3.687 20 0 BHADMO Cc1cnccc1C[N@H+](C(C)C)C1CCCC1 ZINC000648359293 385326498 /nfs/dbraw/zinc/32/64/98/385326498.db2.gz UKVLQDGDKHFBHI-UHFFFAOYSA-N 1 1 232.371 3.543 20 0 BHADMO CC[N@@H+](Cc1ccoc1)Cc1csc(C)c1 ZINC000648366561 397804270 /nfs/dbraw/zinc/80/42/70/397804270.db2.gz SELGUHLROWPUQB-UHFFFAOYSA-N 1 1 235.352 3.672 20 0 BHADMO Cc1cc(C[N@H+]2CC[C@@H](c3ccco3)C2)cs1 ZINC000648371751 385462813 /nfs/dbraw/zinc/46/28/13/385462813.db2.gz MQGQQVGMGDRWFW-CYBMUJFWSA-N 1 1 247.363 3.639 20 0 BHADMO Cc1cc(C[N@H+]2CC[C@H](c3ccco3)C2)cs1 ZINC000648371752 385462512 /nfs/dbraw/zinc/46/25/12/385462512.db2.gz MQGQQVGMGDRWFW-ZDUSSCGKSA-N 1 1 247.363 3.639 20 0 BHADMO CCn1ccc(C[N@@H+](C)Cc2csc(C)c2)c1 ZINC000648553543 387243805 /nfs/dbraw/zinc/24/38/05/387243805.db2.gz IQCROQIFUFQGRA-UHFFFAOYSA-N 1 1 248.395 3.510 20 0 BHADMO C[C@@H](Cc1ccsc1)[N@H+]1CCC[C@](C)(F)C1 ZINC000648606329 387381399 /nfs/dbraw/zinc/38/13/99/387381399.db2.gz YPDARTFKKDCRPX-AAEUAGOBSA-N 1 1 241.375 3.503 20 0 BHADMO C[C@H](Cc1ccsc1)[N@H+]1CCC[C@@](C)(F)C1 ZINC000648606330 387380952 /nfs/dbraw/zinc/38/09/52/387380952.db2.gz YPDARTFKKDCRPX-DGCLKSJQSA-N 1 1 241.375 3.503 20 0 BHADMO C[C@@H](Cc1ccsc1)[N@H+]1CCC[C@@](C)(F)C1 ZINC000648606331 387380401 /nfs/dbraw/zinc/38/04/01/387380401.db2.gz YPDARTFKKDCRPX-WCQYABFASA-N 1 1 241.375 3.503 20 0 BHADMO C[C@H](Cc1ccsc1)[N@H+]1CCC[C@](C)(F)C1 ZINC000648606332 387381230 /nfs/dbraw/zinc/38/12/30/387381230.db2.gz YPDARTFKKDCRPX-YPMHNXCESA-N 1 1 241.375 3.503 20 0 BHADMO c1ccc(C2CC2)c(C[N@H+]2CC[C@H]2C2CC2)c1 ZINC000648698765 397928133 /nfs/dbraw/zinc/92/81/33/397928133.db2.gz ISPSHTBOMUSHBW-INIZCTEOSA-N 1 1 227.351 3.548 20 0 BHADMO c1ccc(C2CC2)c(C[N@H+]2CC[C@@H]2C2CC2)c1 ZINC000648698766 397927692 /nfs/dbraw/zinc/92/76/92/397927692.db2.gz ISPSHTBOMUSHBW-MRXNPFEDSA-N 1 1 227.351 3.548 20 0 BHADMO FC(F)c1ccc(C[N@H+]2CC[C@@H]2C2CC2)cc1 ZINC000648699749 388062220 /nfs/dbraw/zinc/06/22/20/388062220.db2.gz LRTIAVAEPJPGBM-CYBMUJFWSA-N 1 1 237.293 3.609 20 0 BHADMO FC(F)c1ccc(C[N@H+]2CC[C@H]2C2CC2)cc1 ZINC000648699750 388062142 /nfs/dbraw/zinc/06/21/42/388062142.db2.gz LRTIAVAEPJPGBM-ZDUSSCGKSA-N 1 1 237.293 3.609 20 0 BHADMO C[N@H+](Cc1ccsc1)C[C@H]1CCC(F)(F)C1 ZINC000649231574 388463675 /nfs/dbraw/zinc/46/36/75/388463675.db2.gz FACVPPDBEXDTAO-JTQLQIEISA-N 1 1 245.338 3.615 20 0 BHADMO C[N@H+](Cc1ccsc1)C[C@@H]1CCC(F)(F)C1 ZINC000649231575 388463292 /nfs/dbraw/zinc/46/32/92/388463292.db2.gz FACVPPDBEXDTAO-SNVBAGLBSA-N 1 1 245.338 3.615 20 0 BHADMO C[C@H](C1CC1)[N@@H+](C)CCC1=CCCCC1 ZINC000649235941 388465199 /nfs/dbraw/zinc/46/51/99/388465199.db2.gz FDOWSSGFTOZYGL-GFCCVEGCSA-N 1 1 207.361 3.607 20 0 BHADMO C[C@@H](C1CC1)[N@@H+](C)CCC1=CCCCC1 ZINC000649235942 388465041 /nfs/dbraw/zinc/46/50/41/388465041.db2.gz FDOWSSGFTOZYGL-LBPRGKRZSA-N 1 1 207.361 3.607 20 0 BHADMO C[C@@H]([N@@H+](C)C[C@@H]1CCC(F)(F)C1)C(C)(C)C ZINC000649243940 388468049 /nfs/dbraw/zinc/46/80/49/388468049.db2.gz JZNZVTGHVNFZAW-GHMZBOCLSA-N 1 1 233.346 3.788 20 0 BHADMO C[C@@H]([N@@H+](C)C[C@H]1CCC(F)(F)C1)C(C)(C)C ZINC000649243947 388468029 /nfs/dbraw/zinc/46/80/29/388468029.db2.gz JZNZVTGHVNFZAW-MNOVXSKESA-N 1 1 233.346 3.788 20 0 BHADMO C[C@H]([N@@H+](C)C[C@H]1CCC(F)(F)C1)C(C)(C)C ZINC000649243948 388468123 /nfs/dbraw/zinc/46/81/23/388468123.db2.gz JZNZVTGHVNFZAW-QWRGUYRKSA-N 1 1 233.346 3.788 20 0 BHADMO C[C@H]([N@@H+](C)C[C@@H]1CCC(F)(F)C1)C(C)(C)C ZINC000649243949 388467877 /nfs/dbraw/zinc/46/78/77/388467877.db2.gz JZNZVTGHVNFZAW-WDEREUQCSA-N 1 1 233.346 3.788 20 0 BHADMO O=C1CCC(C[N@@H+](C2CC2)C2CCCCC2)CC1 ZINC000649247169 388468348 /nfs/dbraw/zinc/46/83/48/388468348.db2.gz JUTGQOOVRJCIRY-UHFFFAOYSA-N 1 1 249.398 3.543 20 0 BHADMO CCC(=O)CCC[N@@H+](C1CC1)C1CCCCC1 ZINC000649247172 388467528 /nfs/dbraw/zinc/46/75/28/388467528.db2.gz MBYXIXLFPMTISD-UHFFFAOYSA-N 1 1 237.387 3.543 20 0 BHADMO CC[N@H+](Cc1ccoc1)C[C@@H]1CCC(F)(F)C1 ZINC000649280582 388513624 /nfs/dbraw/zinc/51/36/24/388513624.db2.gz YCAADSHRKAOYFF-LLVKDONJSA-N 1 1 243.297 3.537 20 0 BHADMO CC[N@H+](Cc1ccoc1)C[C@H]1CCC(F)(F)C1 ZINC000649280583 388512996 /nfs/dbraw/zinc/51/29/96/388512996.db2.gz YCAADSHRKAOYFF-NSHDSACASA-N 1 1 243.297 3.537 20 0 BHADMO CC(C)[N@@H+](CC1CC1)C[C@@H]1CCC(F)(F)C1 ZINC000649361584 398174697 /nfs/dbraw/zinc/17/46/97/398174697.db2.gz BUZOVTWFGMCBIB-GFCCVEGCSA-N 1 1 231.330 3.542 20 0 BHADMO CC(C)[N@@H+](CC1CC1)C[C@H]1CCC(F)(F)C1 ZINC000649361585 398175334 /nfs/dbraw/zinc/17/53/34/398175334.db2.gz BUZOVTWFGMCBIB-LBPRGKRZSA-N 1 1 231.330 3.542 20 0 BHADMO FC(F)[C@@H]1CCC[N@H+]1CCC1=CCCCC1 ZINC000649401635 398199361 /nfs/dbraw/zinc/19/93/61/398199361.db2.gz PSNKAOCOPQSBQC-LBPRGKRZSA-N 1 1 229.314 3.606 20 0 BHADMO FC(F)[C@@H]1CCC[N@@H+]1CCC1=CCCCC1 ZINC000649401635 398199357 /nfs/dbraw/zinc/19/93/57/398199357.db2.gz PSNKAOCOPQSBQC-LBPRGKRZSA-N 1 1 229.314 3.606 20 0 BHADMO CC[C@H](OCC[N@@H+](C)C1CCC1)c1ccccc1 ZINC000649541738 397935142 /nfs/dbraw/zinc/93/51/42/397935142.db2.gz GXWVHBGBRVMHQC-INIZCTEOSA-N 1 1 247.382 3.639 20 0 BHADMO CC[C@@H](OCC[N@@H+](C)C1CCC1)c1ccccc1 ZINC000649541739 397935149 /nfs/dbraw/zinc/93/51/49/397935149.db2.gz GXWVHBGBRVMHQC-MRXNPFEDSA-N 1 1 247.382 3.639 20 0 BHADMO Cc1ccc(C[N@H+]2CCC23CCCC3)cc1 ZINC000649655457 642684710 /nfs/dbraw/zinc/68/47/10/642684710.db2.gz BWSVSUFADXPKNJ-UHFFFAOYSA-N 1 1 215.340 3.514 20 0 BHADMO COc1ccc(C)cc1C[N@H+]1CCC12CCCC2 ZINC000649655474 642683013 /nfs/dbraw/zinc/68/30/13/642683013.db2.gz CJUTVACYKJBQLN-UHFFFAOYSA-N 1 1 245.366 3.522 20 0 BHADMO C(=C/c1ccccc1)\C[N@H+]1CCC12CCCC2 ZINC000649655535 642683938 /nfs/dbraw/zinc/68/39/38/642683938.db2.gz FNMMEXSYNMQAHT-RMKNXTFCSA-N 1 1 227.351 3.718 20 0 BHADMO C(=C\c1ccccc1)\C[N@H+]1CCC12CCCC2 ZINC000649655536 642683135 /nfs/dbraw/zinc/68/31/35/642683135.db2.gz FNMMEXSYNMQAHT-TWGQIWQCSA-N 1 1 227.351 3.718 20 0 BHADMO Cc1ccccc1C[N@H+]1CCC12CCCC2 ZINC000649655576 642684931 /nfs/dbraw/zinc/68/49/31/642684931.db2.gz HCCBPSWPQFPOSE-UHFFFAOYSA-N 1 1 215.340 3.514 20 0 BHADMO Cc1cccc(C[N@H+]2CCC23CCCC3)c1 ZINC000649655624 490199105 /nfs/dbraw/zinc/19/91/05/490199105.db2.gz JBQRYGSCYSGXRI-UHFFFAOYSA-N 1 1 215.340 3.514 20 0 BHADMO Clc1ccc(C[N@H+]2CCC23CCCC3)s1 ZINC000649655744 490198757 /nfs/dbraw/zinc/19/87/57/490198757.db2.gz NIQRKAYLVWWQIM-UHFFFAOYSA-N 1 1 241.787 3.920 20 0 BHADMO CCOc1ccc(C[N@H+]2CCC23CCCC3)cc1 ZINC000649656513 398027008 /nfs/dbraw/zinc/02/70/08/398027008.db2.gz QFPVHTVLAJWTBW-UHFFFAOYSA-N 1 1 245.366 3.604 20 0 BHADMO CC(C)(C)OCCCC[N@H+]1CCC12CCCC2 ZINC000649657632 398025529 /nfs/dbraw/zinc/02/55/29/398025529.db2.gz HTNKFNVVBUJCPF-UHFFFAOYSA-N 1 1 239.403 3.600 20 0 BHADMO c1cc(CCC[N@H+]2CCC23CCCC3)cs1 ZINC000649657815 398025948 /nfs/dbraw/zinc/02/59/48/398025948.db2.gz NXNSGDNTPNSMPD-UHFFFAOYSA-N 1 1 235.396 3.699 20 0 BHADMO c1sc(C2CC2)nc1C[N@H+]1CCC12CCCC2 ZINC000649657848 398026102 /nfs/dbraw/zinc/02/61/02/398026102.db2.gz OTQWVUQWQSZDQA-UHFFFAOYSA-N 1 1 248.395 3.539 20 0 BHADMO c1sc(C2CC2)nc1C[N@@H+]1CCC12CCCC2 ZINC000649657848 398026099 /nfs/dbraw/zinc/02/60/99/398026099.db2.gz OTQWVUQWQSZDQA-UHFFFAOYSA-N 1 1 248.395 3.539 20 0 BHADMO Clc1ccsc1C[N@H+]1CCC12CCCC2 ZINC000649657943 398025734 /nfs/dbraw/zinc/02/57/34/398025734.db2.gz RVVWEJJONGHFMN-UHFFFAOYSA-N 1 1 241.787 3.920 20 0 BHADMO FC(F)(F)CCCC[N@H+]1CCC12CCCC2 ZINC000649658045 398025374 /nfs/dbraw/zinc/02/53/74/398025374.db2.gz WADUXIAFMPMNMV-UHFFFAOYSA-N 1 1 235.293 3.738 20 0 BHADMO FC1(F)CCC(C[N@H+]2CCC23CCCC3)CC1 ZINC000649658276 398027338 /nfs/dbraw/zinc/02/73/38/398027338.db2.gz FTVLCQRLKJMPCE-UHFFFAOYSA-N 1 1 243.341 3.830 20 0 BHADMO c1ccc([C@@H]2C[C@H]2C[N@H+]2CCC23CCCC3)cc1 ZINC000649658537 398028575 /nfs/dbraw/zinc/02/85/75/398028575.db2.gz OTMYQCXYQUAEIZ-HOTGVXAUSA-N 1 1 241.378 3.809 20 0 BHADMO CCC[N@@H+](C)[C@H](C)CSc1ccccc1 ZINC000649664476 398030183 /nfs/dbraw/zinc/03/01/83/398030183.db2.gz IMBCYDBGRZJIDS-GFCCVEGCSA-N 1 1 223.385 3.509 20 0 BHADMO CCC[N@@H+](C)[C@@H](C)CSc1ccccc1 ZINC000649664477 398030100 /nfs/dbraw/zinc/03/01/00/398030100.db2.gz IMBCYDBGRZJIDS-LBPRGKRZSA-N 1 1 223.385 3.509 20 0 BHADMO C[C@H](CSc1ccccc1)[N@@H+](C)CC1CC1 ZINC000649665128 398029887 /nfs/dbraw/zinc/02/98/87/398029887.db2.gz BVKDTRNFDZPKDL-GFCCVEGCSA-N 1 1 235.396 3.509 20 0 BHADMO C[C@@H](CSc1ccccc1)[N@@H+](C)CC1CC1 ZINC000649665129 398029693 /nfs/dbraw/zinc/02/96/93/398029693.db2.gz BVKDTRNFDZPKDL-LBPRGKRZSA-N 1 1 235.396 3.509 20 0 BHADMO CC(C)O[C@@H]1CCC[N@H+]([C@H](C)c2ccccc2)C1 ZINC000649697803 398046763 /nfs/dbraw/zinc/04/67/63/398046763.db2.gz OZWKGOLRLDFPJO-GDBMZVCRSA-N 1 1 247.382 3.637 20 0 BHADMO CC(C)O[C@@H]1CCC[N@H+]([C@@H](C)c2ccccc2)C1 ZINC000649697804 398046795 /nfs/dbraw/zinc/04/67/95/398046795.db2.gz OZWKGOLRLDFPJO-GOEBONIOSA-N 1 1 247.382 3.637 20 0 BHADMO CC(C)O[C@H]1CCC[N@H+]([C@@H](C)c2ccccc2)C1 ZINC000649697805 398046551 /nfs/dbraw/zinc/04/65/51/398046551.db2.gz OZWKGOLRLDFPJO-HOCLYGCPSA-N 1 1 247.382 3.637 20 0 BHADMO CC(C)O[C@H]1CCC[N@H+]([C@H](C)c2ccccc2)C1 ZINC000649697806 398046882 /nfs/dbraw/zinc/04/68/82/398046882.db2.gz OZWKGOLRLDFPJO-ZBFHGGJFSA-N 1 1 247.382 3.637 20 0 BHADMO C[C@@H]1C[C@H](c2ccccc2)[C@H](C)[N@H+]1CC(F)F ZINC000649748503 398082990 /nfs/dbraw/zinc/08/29/90/398082990.db2.gz OLRWJILAFWVACQ-MDZLAQPJSA-N 1 1 239.309 3.518 20 0 BHADMO C[C@@H]1C[C@H](c2ccccc2)[C@H](C)[N@@H+]1CC(F)F ZINC000649748503 398082986 /nfs/dbraw/zinc/08/29/86/398082986.db2.gz OLRWJILAFWVACQ-MDZLAQPJSA-N 1 1 239.309 3.518 20 0 BHADMO C[C@@H]1C[C@@H](c2ccccc2)[C@@H](C)[N@H+]1CC(F)F ZINC000649748504 398083156 /nfs/dbraw/zinc/08/31/56/398083156.db2.gz OLRWJILAFWVACQ-NQBHXWOUSA-N 1 1 239.309 3.518 20 0 BHADMO C[C@@H]1C[C@@H](c2ccccc2)[C@@H](C)[N@@H+]1CC(F)F ZINC000649748504 398083154 /nfs/dbraw/zinc/08/31/54/398083154.db2.gz OLRWJILAFWVACQ-NQBHXWOUSA-N 1 1 239.309 3.518 20 0 BHADMO C[C@@H]1C[C@@H](c2ccccc2)[C@H](C)[N@H+]1CC(F)F ZINC000649748505 398083067 /nfs/dbraw/zinc/08/30/67/398083067.db2.gz OLRWJILAFWVACQ-NTZNESFSSA-N 1 1 239.309 3.518 20 0 BHADMO C[C@@H]1C[C@@H](c2ccccc2)[C@H](C)[N@@H+]1CC(F)F ZINC000649748505 398083064 /nfs/dbraw/zinc/08/30/64/398083064.db2.gz OLRWJILAFWVACQ-NTZNESFSSA-N 1 1 239.309 3.518 20 0 BHADMO C[C@@H]1C[C@H](c2ccccc2)[C@@H](C)[N@H+]1CC(F)F ZINC000649748506 398083113 /nfs/dbraw/zinc/08/31/13/398083113.db2.gz OLRWJILAFWVACQ-WZRBSPASSA-N 1 1 239.309 3.518 20 0 BHADMO C[C@@H]1C[C@H](c2ccccc2)[C@@H](C)[N@@H+]1CC(F)F ZINC000649748506 398083111 /nfs/dbraw/zinc/08/31/11/398083111.db2.gz OLRWJILAFWVACQ-WZRBSPASSA-N 1 1 239.309 3.518 20 0 BHADMO Cc1c2cccc(C)c2oc1C[N@@H+](C)CCCF ZINC000649819773 398121667 /nfs/dbraw/zinc/12/16/67/398121667.db2.gz FSMSYYVMDVHQSD-UHFFFAOYSA-N 1 1 249.329 3.841 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@H]2C=CCCCCC2)nc1 ZINC000649903978 398174676 /nfs/dbraw/zinc/17/46/76/398174676.db2.gz FAVKLTDIDZFWOO-INIZCTEOSA-N 1 1 244.382 3.711 20 0 BHADMO Cc1ccc(C[N@H+](C)[C@@H]2C=CCCCCC2)nc1 ZINC000649903979 398175054 /nfs/dbraw/zinc/17/50/54/398175054.db2.gz FAVKLTDIDZFWOO-MRXNPFEDSA-N 1 1 244.382 3.711 20 0 BHADMO Cc1ccc(C[N@@H+](C)CCCC(C)(C)C)nc1 ZINC000649904012 398174577 /nfs/dbraw/zinc/17/45/77/398174577.db2.gz HZQPXLYJRNANJJ-UHFFFAOYSA-N 1 1 234.387 3.648 20 0 BHADMO Cc1ccc(C[N@@H+](C)CCC2=CCCCC2)nc1 ZINC000649904212 398177193 /nfs/dbraw/zinc/17/71/93/398177193.db2.gz PHDOMVJSXYAHLB-UHFFFAOYSA-N 1 1 244.382 3.712 20 0 BHADMO FC1(F)C[C@@]12CC[N@@H+](CCCC1CCCC1)C2 ZINC000649904678 398176931 /nfs/dbraw/zinc/17/69/31/398176931.db2.gz KOPYFZAAMYNTSR-CYBMUJFWSA-N 1 1 243.341 3.688 20 0 BHADMO FC1(F)C[C@]12CC[N@@H+](CCCC1CCCC1)C2 ZINC000649904679 398176827 /nfs/dbraw/zinc/17/68/27/398176827.db2.gz KOPYFZAAMYNTSR-ZDUSSCGKSA-N 1 1 243.341 3.688 20 0 BHADMO CCC(C)(C)CC[N@H+]1CC[C@@]2(CC2(F)F)C1 ZINC000649905132 398178667 /nfs/dbraw/zinc/17/86/67/398178667.db2.gz UFBNLBYTFINACJ-GFCCVEGCSA-N 1 1 231.330 3.544 20 0 BHADMO CCC(C)(C)CC[N@H+]1CC[C@]2(CC2(F)F)C1 ZINC000649905133 398178633 /nfs/dbraw/zinc/17/86/33/398178633.db2.gz UFBNLBYTFINACJ-LBPRGKRZSA-N 1 1 231.330 3.544 20 0 BHADMO C[C@@H]1CCC[C@H](C[N@H+]2CC[C@]3(CC3(F)F)C2)C1 ZINC000649906758 398181543 /nfs/dbraw/zinc/18/15/43/398181543.db2.gz BXHFSTMIKQTXMM-AGIUHOORSA-N 1 1 243.341 3.544 20 0 BHADMO C[C@@H]1CCC[C@H](C[N@H+]2CC[C@@]3(CC3(F)F)C2)C1 ZINC000649906759 398181789 /nfs/dbraw/zinc/18/17/89/398181789.db2.gz BXHFSTMIKQTXMM-FRRDWIJNSA-N 1 1 243.341 3.544 20 0 BHADMO C[C@@H]1CCC[C@@H](C[N@H+]2CC[C@@]3(CC3(F)F)C2)C1 ZINC000649906760 398181745 /nfs/dbraw/zinc/18/17/45/398181745.db2.gz BXHFSTMIKQTXMM-JHJVBQTASA-N 1 1 243.341 3.544 20 0 BHADMO C[C@@H]1CCC[C@@H](C[N@H+]2CC[C@]3(CC3(F)F)C2)C1 ZINC000649906761 398182023 /nfs/dbraw/zinc/18/20/23/398182023.db2.gz BXHFSTMIKQTXMM-UPJWGTAASA-N 1 1 243.341 3.544 20 0 BHADMO 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CC(C)(C)CCC[N@H+]1CC[C@@]2(CC2(F)F)C1 ZINC000649908278 398183940 /nfs/dbraw/zinc/18/39/40/398183940.db2.gz LCTPTHCEMQKKKB-GFCCVEGCSA-N 1 1 231.330 3.544 20 0 BHADMO CC(C)(C)CCC[N@H+]1CC[C@]2(CC2(F)F)C1 ZINC000649908279 398184049 /nfs/dbraw/zinc/18/40/49/398184049.db2.gz LCTPTHCEMQKKKB-LBPRGKRZSA-N 1 1 231.330 3.544 20 0 BHADMO FC1(F)C[C@@]12CC[N@H+]([C@@H]1C=CCCCCC1)C2 ZINC000649908298 398183971 /nfs/dbraw/zinc/18/39/71/398183971.db2.gz LJKPETGOQYQWTR-CHWSQXEVSA-N 1 1 241.325 3.606 20 0 BHADMO FC1(F)C[C@]12CC[N@H+]([C@@H]1C=CCCCCC1)C2 ZINC000649908299 398184068 /nfs/dbraw/zinc/18/40/68/398184068.db2.gz LJKPETGOQYQWTR-OLZOCXBDSA-N 1 1 241.325 3.606 20 0 BHADMO FC1(F)C[C@@]12CC[N@H+]([C@H]1C=CCCCCC1)C2 ZINC000649908300 398183992 /nfs/dbraw/zinc/18/39/92/398183992.db2.gz LJKPETGOQYQWTR-QWHCGFSZSA-N 1 1 241.325 3.606 20 0 BHADMO FC1(F)C[C@]12CC[N@H+]([C@H]1C=CCCCCC1)C2 ZINC000649908301 398183869 /nfs/dbraw/zinc/18/38/69/398183869.db2.gz LJKPETGOQYQWTR-STQMWFEESA-N 1 1 241.325 3.606 20 0 BHADMO CC1CCC(C[N@H+]2CC[C@]3(CC3(F)F)C2)CC1 ZINC000649908633 398183968 /nfs/dbraw/zinc/18/39/68/398183968.db2.gz SZFDTCNNLDRVOO-BPCQOVAHSA-N 1 1 243.341 3.544 20 0 BHADMO CC1CCC(C[N@H+]2CC[C@@]3(CC3(F)F)C2)CC1 ZINC000649908634 398183765 /nfs/dbraw/zinc/18/37/65/398183765.db2.gz SZFDTCNNLDRVOO-WXRRBKDZSA-N 1 1 243.341 3.544 20 0 BHADMO c1coc([C@@H]2[N@@H+](C3CCCC3)CC23CCC3)c1 ZINC000650192633 397977138 /nfs/dbraw/zinc/97/71/38/397977138.db2.gz BITDRPIHQMIKPK-AWEZNQCLSA-N 1 1 231.339 3.749 20 0 BHADMO c1coc([C@H]2[N@@H+](C3CCCC3)CC23CCC3)c1 ZINC000650192634 397977155 /nfs/dbraw/zinc/97/71/55/397977155.db2.gz BITDRPIHQMIKPK-CQSZACIVSA-N 1 1 231.339 3.749 20 0 BHADMO C[C@@H](c1ccncc1)[N@H+]1CC[C@@H](CC(C)(C)C)C1 ZINC000650334260 398118947 /nfs/dbraw/zinc/11/89/47/398118947.db2.gz ONEQMDTZACRCEZ-KBPBESRZSA-N 1 1 246.398 3.901 20 0 BHADMO C[C@H](c1ccncc1)[N@H+]1CC[C@@H](CC(C)(C)C)C1 ZINC000650334261 398118930 /nfs/dbraw/zinc/11/89/30/398118930.db2.gz ONEQMDTZACRCEZ-KGLIPLIRSA-N 1 1 246.398 3.901 20 0 BHADMO C[C@@H](c1ccncc1)[N@H+]1CC[C@H](CC(C)(C)C)C1 ZINC000650334262 398118866 /nfs/dbraw/zinc/11/88/66/398118866.db2.gz ONEQMDTZACRCEZ-UONOGXRCSA-N 1 1 246.398 3.901 20 0 BHADMO C[C@H](c1ccncc1)[N@H+]1CC[C@H](CC(C)(C)C)C1 ZINC000650334263 398118938 /nfs/dbraw/zinc/11/89/38/398118938.db2.gz ONEQMDTZACRCEZ-ZIAGYGMSSA-N 1 1 246.398 3.901 20 0 BHADMO Cc1ccnc(C[N@H+]2CC[C@@H](CC(C)(C)C)C2)c1 ZINC000650334668 398117250 /nfs/dbraw/zinc/11/72/50/398117250.db2.gz LZYCNKPSOGGDGB-AWEZNQCLSA-N 1 1 246.398 3.648 20 0 BHADMO Cc1ccnc(C[N@H+]2CC[C@H](CC(C)(C)C)C2)c1 ZINC000650334669 398117435 /nfs/dbraw/zinc/11/74/35/398117435.db2.gz LZYCNKPSOGGDGB-CQSZACIVSA-N 1 1 246.398 3.648 20 0 BHADMO Cc1ccnc(C[N@H+](C(C)C)C2CC(C)(C)C2)c1 ZINC000650346048 487796812 /nfs/dbraw/zinc/79/68/12/487796812.db2.gz YNSVVCYGWZFSTF-UHFFFAOYSA-N 1 1 246.398 3.789 20 0 BHADMO CC[C@@H]1CCCC[C@H]1C[NH2+][C@H](C)c1cn[nH]c1C ZINC000651389696 410974245 /nfs/dbraw/zinc/97/42/45/410974245.db2.gz VLJVBQJKTKXORV-BNOWGMLFSA-N 1 1 249.402 3.585 20 0 BHADMO CC[C@@H]1CCCC[C@@H]1C[NH2+][C@@H](C)c1cn[nH]c1C ZINC000651389697 410975356 /nfs/dbraw/zinc/97/53/56/410975356.db2.gz VLJVBQJKTKXORV-IACUBPJLSA-N 1 1 249.402 3.585 20 0 BHADMO CC[C@@H]1CCCC[C@@H]1C[NH2+][C@H](C)c1cn[nH]c1C ZINC000651389698 410974969 /nfs/dbraw/zinc/97/49/69/410974969.db2.gz VLJVBQJKTKXORV-MRVWCRGKSA-N 1 1 249.402 3.585 20 0 BHADMO CC[C@@H]1CCCC[C@H]1C[NH2+][C@@H](C)c1cn[nH]c1C ZINC000651389699 410974366 /nfs/dbraw/zinc/97/43/66/410974366.db2.gz VLJVBQJKTKXORV-YUTCNCBUSA-N 1 1 249.402 3.585 20 0 BHADMO CC(C)=CCC[C@@H](C)[NH2+][C@@H](C)c1cn[nH]c1C ZINC000651408127 487729347 /nfs/dbraw/zinc/72/93/47/487729347.db2.gz JWWXVEYWIJLDDV-NEPJUHHUSA-N 1 1 235.375 3.504 20 0 BHADMO CC(C)=CCC[C@H](C)[NH2+][C@H](C)c1cn[nH]c1C ZINC000651408128 487729427 /nfs/dbraw/zinc/72/94/27/487729427.db2.gz JWWXVEYWIJLDDV-NWDGAFQWSA-N 1 1 235.375 3.504 20 0 BHADMO CC(C)=CCC[C@H](C)[NH2+][C@@H](C)c1cn[nH]c1C ZINC000651408129 487729453 /nfs/dbraw/zinc/72/94/53/487729453.db2.gz JWWXVEYWIJLDDV-RYUDHWBXSA-N 1 1 235.375 3.504 20 0 BHADMO CC(C)=CCC[C@@H](C)[NH2+][C@H](C)c1cn[nH]c1C ZINC000651408130 487729416 /nfs/dbraw/zinc/72/94/16/487729416.db2.gz JWWXVEYWIJLDDV-VXGBXAGGSA-N 1 1 235.375 3.504 20 0 BHADMO CCC[C@H]([NH2+][C@@H](C)c1cn[nH]c1C)C(C)(C)C ZINC000651415244 410997359 /nfs/dbraw/zinc/99/73/59/410997359.db2.gz XCTJPMZYVZJQFT-GWCFXTLKSA-N 1 1 237.391 3.584 20 0 BHADMO CCC[C@@H]([NH2+][C@@H](C)c1cn[nH]c1C)C(C)(C)C ZINC000651415245 410997346 /nfs/dbraw/zinc/99/73/46/410997346.db2.gz XCTJPMZYVZJQFT-GXFFZTMASA-N 1 1 237.391 3.584 20 0 BHADMO CCC[C@H]([NH2+][C@H](C)c1cn[nH]c1C)C(C)(C)C ZINC000651415246 410997191 /nfs/dbraw/zinc/99/71/91/410997191.db2.gz XCTJPMZYVZJQFT-MFKMUULPSA-N 1 1 237.391 3.584 20 0 BHADMO CCC[C@@H]([NH2+][C@H](C)c1cn[nH]c1C)C(C)(C)C ZINC000651415247 410997255 /nfs/dbraw/zinc/99/72/55/410997255.db2.gz XCTJPMZYVZJQFT-ZWNOBZJWSA-N 1 1 237.391 3.584 20 0 BHADMO Cc1[nH]ncc1[C@H](C)[NH2+]C[C@H]1CCCC(C)(C)C1 ZINC000651476416 411057873 /nfs/dbraw/zinc/05/78/73/411057873.db2.gz IERGDKVLFAUHBW-AAEUAGOBSA-N 1 1 249.402 3.585 20 0 BHADMO Cc1[nH]ncc1[C@@H](C)[NH2+]C[C@@H]1CCCC(C)(C)C1 ZINC000651476417 411057305 /nfs/dbraw/zinc/05/73/05/411057305.db2.gz IERGDKVLFAUHBW-DGCLKSJQSA-N 1 1 249.402 3.585 20 0 BHADMO Cc1[nH]ncc1[C@H](C)[NH2+]C[C@@H]1CCCC(C)(C)C1 ZINC000651476418 411057657 /nfs/dbraw/zinc/05/76/57/411057657.db2.gz IERGDKVLFAUHBW-WCQYABFASA-N 1 1 249.402 3.585 20 0 BHADMO Cc1[nH]ncc1[C@@H](C)[NH2+]C[C@H]1CCCC(C)(C)C1 ZINC000651476419 411057237 /nfs/dbraw/zinc/05/72/37/411057237.db2.gz IERGDKVLFAUHBW-YPMHNXCESA-N 1 1 249.402 3.585 20 0 BHADMO Cc1[nH]ncc1[C@H](C)[NH2+][C@@H](C)[C@H]1CCC[C@H](C)C1 ZINC000651479500 487751755 /nfs/dbraw/zinc/75/17/55/487751755.db2.gz CLUIRLLXMQJAFF-MNXVOIDGSA-N 1 1 249.402 3.584 20 0 BHADMO Cc1[nH]ncc1[C@H](C)[NH2+][C@@H](C)[C@@H]1CCC[C@@H](C)C1 ZINC000651479501 487751686 /nfs/dbraw/zinc/75/16/86/487751686.db2.gz CLUIRLLXMQJAFF-OWTLIXCDSA-N 1 1 249.402 3.584 20 0 BHADMO Cc1[nH]ncc1[C@H](C)[NH2+][C@@H](C)[C@H]1CCC[C@@H](C)C1 ZINC000651479502 487751884 /nfs/dbraw/zinc/75/18/84/487751884.db2.gz CLUIRLLXMQJAFF-UHXUPSOCSA-N 1 1 249.402 3.584 20 0 BHADMO Cc1[nH]ncc1[C@H](C)[NH2+][C@@H](C)[C@@H]1CCC[C@H](C)C1 ZINC000651479503 487751718 /nfs/dbraw/zinc/75/17/18/487751718.db2.gz CLUIRLLXMQJAFF-ZJQBRPOHSA-N 1 1 249.402 3.584 20 0 BHADMO Cc1[nH]ncc1[C@@H](C)[NH2+]CC(C)(C)C1=CCCC1 ZINC000651483439 411064647 /nfs/dbraw/zinc/06/46/47/411064647.db2.gz IRMVNGMQRCQBAI-LLVKDONJSA-N 1 1 247.386 3.505 20 0 BHADMO Cc1[nH]ncc1[C@H](C)[NH2+]CC(C)(C)C1=CCCC1 ZINC000651483440 411065900 /nfs/dbraw/zinc/06/59/00/411065900.db2.gz IRMVNGMQRCQBAI-NSHDSACASA-N 1 1 247.386 3.505 20 0 BHADMO CC[C@@H]1CCCC[N@H+]1Cc1cc2cnccc2o1 ZINC000651605560 411129102 /nfs/dbraw/zinc/12/91/02/411129102.db2.gz LKGCAZIWAYKPRL-CYBMUJFWSA-N 1 1 244.338 3.592 20 0 BHADMO CC[C@H]1CCCC[N@H+]1Cc1cc2cnccc2o1 ZINC000651605561 411129130 /nfs/dbraw/zinc/12/91/30/411129130.db2.gz LKGCAZIWAYKPRL-ZDUSSCGKSA-N 1 1 244.338 3.592 20 0 BHADMO C[N@@H+](Cc1cc2cnccc2o1)C1CCCCC1 ZINC000651605875 411129153 /nfs/dbraw/zinc/12/91/53/411129153.db2.gz XKWAWDMRMMGAAU-UHFFFAOYSA-N 1 1 244.338 3.592 20 0 BHADMO CCCC[N@@H+](Cc1cc2cnccc2o1)C1CC1 ZINC000651613465 411130578 /nfs/dbraw/zinc/13/05/78/411130578.db2.gz BPMOFGZPIYFVNR-UHFFFAOYSA-N 1 1 244.338 3.592 20 0 BHADMO CC[N@@H+](Cc1cc2cnccc2o1)C1CCCC1 ZINC000651614695 411130538 /nfs/dbraw/zinc/13/05/38/411130538.db2.gz RMUYGXTVVPIJQW-UHFFFAOYSA-N 1 1 244.338 3.592 20 0 BHADMO CCC[N@H+](Cc1cc2cnccc2o1)CC(C)C ZINC000651616188 411130639 /nfs/dbraw/zinc/13/06/39/411130639.db2.gz SEJQLYLGEXMUIF-UHFFFAOYSA-N 1 1 246.354 3.696 20 0 BHADMO C[C@@H]([N@@H+](C)Cc1cc2cnccc2o1)C(C)(C)C ZINC000651616483 487800698 /nfs/dbraw/zinc/80/06/98/487800698.db2.gz CLOMWJUIRCYEPL-LLVKDONJSA-N 1 1 246.354 3.694 20 0 BHADMO C[C@H]([N@@H+](C)Cc1cc2cnccc2o1)C(C)(C)C ZINC000651616484 487800706 /nfs/dbraw/zinc/80/07/06/487800706.db2.gz CLOMWJUIRCYEPL-NSHDSACASA-N 1 1 246.354 3.694 20 0 BHADMO CC(C)C[N@@H+](Cc1cc2cnccc2o1)C(C)C ZINC000651618952 487800463 /nfs/dbraw/zinc/80/04/63/487800463.db2.gz AWZMMAZRYVYFRX-UHFFFAOYSA-N 1 1 246.354 3.694 20 0 BHADMO CC[N@@H+](Cc1cc2cnccc2o1)[C@H](C)C(C)C ZINC000651625388 411131416 /nfs/dbraw/zinc/13/14/16/411131416.db2.gz BLZRVARHYKVJNW-GFCCVEGCSA-N 1 1 246.354 3.694 20 0 BHADMO CC[N@@H+](Cc1cc2cnccc2o1)[C@@H](C)C(C)C ZINC000651625389 411131401 /nfs/dbraw/zinc/13/14/01/411131401.db2.gz BLZRVARHYKVJNW-LBPRGKRZSA-N 1 1 246.354 3.694 20 0 BHADMO CC(C)[N@@H+](Cc1cc2cnccc2o1)C1CCC1 ZINC000651644069 487809810 /nfs/dbraw/zinc/80/98/10/487809810.db2.gz BBISEGXZGQJOKA-UHFFFAOYSA-N 1 1 244.338 3.591 20 0 BHADMO CC[C@@H](C)C[N@@H+](CC)Cc1cc2cnccc2o1 ZINC000651648636 487811387 /nfs/dbraw/zinc/81/13/87/487811387.db2.gz DQYLIRKQQNVMSE-GFCCVEGCSA-N 1 1 246.354 3.696 20 0 BHADMO CC[C@H](C)C[N@@H+](CC)Cc1cc2cnccc2o1 ZINC000651648637 487811466 /nfs/dbraw/zinc/81/14/66/487811466.db2.gz DQYLIRKQQNVMSE-LBPRGKRZSA-N 1 1 246.354 3.696 20 0 BHADMO Cc1occc1C[NH2+]Cc1ccc(C)cc1Cl ZINC000651685427 411135845 /nfs/dbraw/zinc/13/58/45/411135845.db2.gz SSCWOLCJNGZROX-UHFFFAOYSA-N 1 1 249.741 3.840 20 0 BHADMO C[N@@H+](Cc1cc2cnccc2o1)C1(C)CCCC1 ZINC000651788313 411144130 /nfs/dbraw/zinc/14/41/30/411144130.db2.gz ARYLVUMFHQWLMP-UHFFFAOYSA-N 1 1 244.338 3.592 20 0 BHADMO CC[C@H]1CC[C@H](C)[N@H+]1Cc1cc2cnccc2o1 ZINC000651811193 411144859 /nfs/dbraw/zinc/14/48/59/411144859.db2.gz LPTQYYSKFLCGQT-AAEUAGOBSA-N 1 1 244.338 3.591 20 0 BHADMO CC[C@@H]1CC[C@@H](C)[N@H+]1Cc1cc2cnccc2o1 ZINC000651811194 411144845 /nfs/dbraw/zinc/14/48/45/411144845.db2.gz LPTQYYSKFLCGQT-DGCLKSJQSA-N 1 1 244.338 3.591 20 0 BHADMO CC[C@@H]1CC[C@H](C)[N@H+]1Cc1cc2cnccc2o1 ZINC000651811195 411144949 /nfs/dbraw/zinc/14/49/49/411144949.db2.gz LPTQYYSKFLCGQT-WCQYABFASA-N 1 1 244.338 3.591 20 0 BHADMO CC[C@H]1CC[C@@H](C)[N@H+]1Cc1cc2cnccc2o1 ZINC000651811196 411144953 /nfs/dbraw/zinc/14/49/53/411144953.db2.gz LPTQYYSKFLCGQT-YPMHNXCESA-N 1 1 244.338 3.591 20 0 BHADMO CCC(CC)[N@@H+](CC)Cc1cc2cnccc2o1 ZINC000651812870 642771503 /nfs/dbraw/zinc/77/15/03/642771503.db2.gz NWNHRIHPPPGTFT-UHFFFAOYSA-N 1 1 246.354 3.838 20 0 BHADMO CCCC[C@@H](C)[N@@H+](C)Cc1cc2cnccc2o1 ZINC000651814998 487835323 /nfs/dbraw/zinc/83/53/23/487835323.db2.gz SNAAVJXQJGVTFF-GFCCVEGCSA-N 1 1 246.354 3.838 20 0 BHADMO CCCC[C@H](C)[N@@H+](C)Cc1cc2cnccc2o1 ZINC000651814999 487834950 /nfs/dbraw/zinc/83/49/50/487834950.db2.gz SNAAVJXQJGVTFF-LBPRGKRZSA-N 1 1 246.354 3.838 20 0 BHADMO CC[N@@H+](Cc1cc2cnccc2o1)CC(C)(C)C ZINC000651815321 487835147 /nfs/dbraw/zinc/83/51/47/487835147.db2.gz IWXXXYAWNPGYSX-UHFFFAOYSA-N 1 1 246.354 3.696 20 0 BHADMO C[N@@H+](CCC(C)(C)C)Cc1cc2cnccc2o1 ZINC000651844544 487843369 /nfs/dbraw/zinc/84/33/69/487843369.db2.gz NNKWCTKNZCGEDR-UHFFFAOYSA-N 1 1 246.354 3.696 20 0 BHADMO Cc1sccc1C[N@H+]1CCC12CCCC2 ZINC000651872922 411148505 /nfs/dbraw/zinc/14/85/05/411148505.db2.gz JCUOLCGKDIBXSL-UHFFFAOYSA-N 1 1 221.369 3.575 20 0 BHADMO Cc1cc(C[N@H+]2CCC23CCCC3)cc(C)c1O ZINC000651872988 411148225 /nfs/dbraw/zinc/14/82/25/411148225.db2.gz LYDNIZSNFDOUNG-UHFFFAOYSA-N 1 1 245.366 3.528 20 0 BHADMO COc1cc(C)ccc1C[N@H+]1CCC12CCCC2 ZINC000651873072 411148383 /nfs/dbraw/zinc/14/83/83/411148383.db2.gz PUSKTHDHCODPSG-UHFFFAOYSA-N 1 1 245.366 3.522 20 0 BHADMO COc1cc(C[N@H+]2CCC23CCCC3)ccc1C ZINC000651873131 411148217 /nfs/dbraw/zinc/14/82/17/411148217.db2.gz SVEPWMUWTRQOTG-UHFFFAOYSA-N 1 1 245.366 3.522 20 0 BHADMO Cc1cc(C[N@H+]2CCC23CCCC3)cs1 ZINC000651873235 411148419 /nfs/dbraw/zinc/14/84/19/411148419.db2.gz YOUWZOMVEMVDOJ-UHFFFAOYSA-N 1 1 221.369 3.575 20 0 BHADMO Clc1cscc1C[N@H+]1CCC12CCCC2 ZINC000651873437 411148439 /nfs/dbraw/zinc/14/84/39/411148439.db2.gz HJEQSYXPWGILAK-UHFFFAOYSA-N 1 1 241.787 3.920 20 0 BHADMO Clc1sccc1C[N@H+]1CCC12CCCC2 ZINC000651873527 411148395 /nfs/dbraw/zinc/14/83/95/411148395.db2.gz KVTWIIWUTPBFPA-UHFFFAOYSA-N 1 1 241.787 3.920 20 0 BHADMO c1cc2cccc(C[N@H+]3CCC34CCCC4)c2[nH]1 ZINC000651873534 411148524 /nfs/dbraw/zinc/14/85/24/411148524.db2.gz LEONSGLTPXIINU-UHFFFAOYSA-N 1 1 240.350 3.686 20 0 BHADMO c1cc2c(cccc2C[N@H+]2CCC23CCCC3)[nH]1 ZINC000651873567 411148246 /nfs/dbraw/zinc/14/82/46/411148246.db2.gz MTUGPVHLFRRLRU-UHFFFAOYSA-N 1 1 240.350 3.686 20 0 BHADMO c1c2ccccc2[nH]c1C[N@H+]1CCC12CCCC2 ZINC000651873580 411148304 /nfs/dbraw/zinc/14/83/04/411148304.db2.gz MWAXNUORSHJFSX-UHFFFAOYSA-N 1 1 240.350 3.686 20 0 BHADMO c1ccc([C@@H]2C[C@@H]2C[N@H+]2CCC23CCCC3)cc1 ZINC000651873627 411148534 /nfs/dbraw/zinc/14/85/34/411148534.db2.gz OTMYQCXYQUAEIZ-CVEARBPZSA-N 1 1 241.378 3.809 20 0 BHADMO c1ccc([C@H]2C[C@@H]2C[N@H+]2CCC23CCCC3)cc1 ZINC000651873628 411148282 /nfs/dbraw/zinc/14/82/82/411148282.db2.gz OTMYQCXYQUAEIZ-HZPDHXFCSA-N 1 1 241.378 3.809 20 0 BHADMO c1ccc([C@H]2C[C@H]2C[N@H+]2CCC23CCCC3)cc1 ZINC000651873629 411148442 /nfs/dbraw/zinc/14/84/42/411148442.db2.gz OTMYQCXYQUAEIZ-JKSUJKDBSA-N 1 1 241.378 3.809 20 0 BHADMO c1nc(C2CC2)sc1C[N@H+]1CCC12CCCC2 ZINC000651873652 411148575 /nfs/dbraw/zinc/14/85/75/411148575.db2.gz QCMOOMQBHNTEGC-UHFFFAOYSA-N 1 1 248.395 3.539 20 0 BHADMO C[C@H](Cc1ccsc1)[N@H+]1CCC12CCCC2 ZINC000651873663 411148295 /nfs/dbraw/zinc/14/82/95/411148295.db2.gz QKSCTSUQWZMYSW-GFCCVEGCSA-N 1 1 235.396 3.698 20 0 BHADMO C[C@@H](Cc1ccsc1)[N@H+]1CCC12CCCC2 ZINC000651873664 411148486 /nfs/dbraw/zinc/14/84/86/411148486.db2.gz QKSCTSUQWZMYSW-LBPRGKRZSA-N 1 1 235.396 3.698 20 0 BHADMO c1nc(C2CC2)c(C[N@H+]2CCC23CCCC3)s1 ZINC000651873828 411148495 /nfs/dbraw/zinc/14/84/95/411148495.db2.gz XQQFRHGVPBEIJT-UHFFFAOYSA-N 1 1 248.395 3.539 20 0 BHADMO CCOc1cccc(C[N@H+]2CCC23CCCC3)c1 ZINC000651873898 411147928 /nfs/dbraw/zinc/14/79/28/411147928.db2.gz BMVUOJNRMNASQU-UHFFFAOYSA-N 1 1 245.366 3.604 20 0 BHADMO COc1ccc(C[N@H+]2CCC23CCCC3)cc1C ZINC000651874013 411148013 /nfs/dbraw/zinc/14/80/13/411148013.db2.gz GZXAVYFSHAJATN-UHFFFAOYSA-N 1 1 245.366 3.522 20 0 BHADMO Cc1ccc(C[N@H+]2CCC23CCCC3)s1 ZINC000651874126 411148074 /nfs/dbraw/zinc/14/80/74/411148074.db2.gz LQLWFMCZOXCWRF-UHFFFAOYSA-N 1 1 221.369 3.575 20 0 BHADMO Cc1ccsc1C[N@H+]1CCC12CCCC2 ZINC000651874327 411148379 /nfs/dbraw/zinc/14/83/79/411148379.db2.gz VCFNVSLRAAMBHJ-UHFFFAOYSA-N 1 1 221.369 3.575 20 0 BHADMO C[C@@H]1CCCC[C@H]1C[N@H+]1CC[C@]2(CC2(F)F)C1 ZINC000652063873 411103248 /nfs/dbraw/zinc/10/32/48/411103248.db2.gz XCVNXPMDUINBOJ-AGIUHOORSA-N 1 1 243.341 3.544 20 0 BHADMO C[C@@H]1CCCC[C@H]1C[N@H+]1CC[C@@]2(CC2(F)F)C1 ZINC000652063874 411103118 /nfs/dbraw/zinc/10/31/18/411103118.db2.gz XCVNXPMDUINBOJ-FRRDWIJNSA-N 1 1 243.341 3.544 20 0 BHADMO C[C@@H]1CCCC[C@@H]1C[N@H+]1CC[C@@]2(CC2(F)F)C1 ZINC000652063875 411104397 /nfs/dbraw/zinc/10/43/97/411104397.db2.gz XCVNXPMDUINBOJ-JHJVBQTASA-N 1 1 243.341 3.544 20 0 BHADMO C[C@@H]1CCCC[C@@H]1C[N@H+]1CC[C@]2(CC2(F)F)C1 ZINC000652063876 411103749 /nfs/dbraw/zinc/10/37/49/411103749.db2.gz XCVNXPMDUINBOJ-UPJWGTAASA-N 1 1 243.341 3.544 20 0 BHADMO CC(C)C(C[N@H+]1CC[C@@]2(CC2(F)F)C1)C(C)C ZINC000652064237 411103874 /nfs/dbraw/zinc/10/38/74/411103874.db2.gz JCALLEQRVXHKPT-CYBMUJFWSA-N 1 1 245.357 3.646 20 0 BHADMO CC(C)C(C[N@H+]1CC[C@]2(CC2(F)F)C1)C(C)C ZINC000652064238 411103193 /nfs/dbraw/zinc/10/31/93/411103193.db2.gz JCALLEQRVXHKPT-ZDUSSCGKSA-N 1 1 245.357 3.646 20 0 BHADMO C[N@@H+](CCC(C)(C)C1CC1)Cc1ccco1 ZINC000653480729 487879825 /nfs/dbraw/zinc/87/98/25/487879825.db2.gz OAHWZVUPFCKAOV-UHFFFAOYSA-N 1 1 221.344 3.538 20 0 BHADMO CCCC[N@@H+](Cc1c(C)nsc1C)C1CC1 ZINC000653494699 411389377 /nfs/dbraw/zinc/38/93/77/411389377.db2.gz KUNYDQLORJPPIW-UHFFFAOYSA-N 1 1 238.400 3.524 20 0 BHADMO COc1ccc(C(C)C)cc1C[N@@H+](C)CC1CC1 ZINC000653498937 411413747 /nfs/dbraw/zinc/41/37/47/411413747.db2.gz SXGFKMKSWLIFRU-UHFFFAOYSA-N 1 1 247.382 3.660 20 0 BHADMO C[N@@H+](CCC(C)(C)C1CC1)Cc1ccoc1 ZINC000653504323 411415232 /nfs/dbraw/zinc/41/52/32/411415232.db2.gz PZXBRGUWNFSWQV-UHFFFAOYSA-N 1 1 221.344 3.538 20 0 BHADMO CCC[N@@H+](C)Cc1cc(C(C)C)ccc1OC ZINC000653524501 411417937 /nfs/dbraw/zinc/41/79/37/411417937.db2.gz PHVNXXXUDALCKO-UHFFFAOYSA-N 1 1 235.371 3.660 20 0 BHADMO COc1ccc(C(C)C)cc1C[N@@H+](C)C1CCC1 ZINC000653559677 487966469 /nfs/dbraw/zinc/96/64/69/487966469.db2.gz NYGGIKWBSBRJTK-UHFFFAOYSA-N 1 1 247.382 3.803 20 0 BHADMO CC[N@@H+](CCC(C)(C)C1CC1)Cc1ccccn1 ZINC000653568555 411423299 /nfs/dbraw/zinc/42/32/99/411423299.db2.gz BKNRDWBCRNDESZ-UHFFFAOYSA-N 1 1 246.398 3.730 20 0 BHADMO CC(C)(CC[N@H+]1CCC[C@H]1c1ccc[nH]1)C1CC1 ZINC000653573819 487969554 /nfs/dbraw/zinc/96/95/54/487969554.db2.gz QPCNMKVVVADBNH-HNNXBMFYSA-N 1 1 246.398 3.978 20 0 BHADMO CC(C)(CC[N@H+]1CCC[C@@H]1c1ccc[nH]1)C1CC1 ZINC000653573820 487969047 /nfs/dbraw/zinc/96/90/47/487969047.db2.gz QPCNMKVVVADBNH-OAHLLOKOSA-N 1 1 246.398 3.978 20 0 BHADMO Cc1cccc(C[N@@H+](C)CCC(C)(C)C2CC2)n1 ZINC000653581631 487969354 /nfs/dbraw/zinc/96/93/54/487969354.db2.gz APLBGQRDUKWYCA-UHFFFAOYSA-N 1 1 246.398 3.648 20 0 BHADMO 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20 0 BHADMO CC[N@@H+](CCC(C)(C)C1CC1)Cc1ccncc1 ZINC000653595020 411430752 /nfs/dbraw/zinc/43/07/52/411430752.db2.gz QZANHIWNUZHKTI-UHFFFAOYSA-N 1 1 246.398 3.730 20 0 BHADMO COc1ccc(C(C)C)cc1C[N@@H+]1CC=CCC1 ZINC000653610156 411439760 /nfs/dbraw/zinc/43/97/60/411439760.db2.gz ZNSABASXSJAEDZ-UHFFFAOYSA-N 1 1 245.366 3.581 20 0 BHADMO Cc1ccncc1C[N@@H+](C)CCC(C)(C)C1CC1 ZINC000653653639 411156122 /nfs/dbraw/zinc/15/61/22/411156122.db2.gz AOPLWVWRLWQYBU-UHFFFAOYSA-N 1 1 246.398 3.648 20 0 BHADMO c1cnc2c(c1)C[N@H+](CCC1CCCCCC1)C2 ZINC000653657464 411157420 /nfs/dbraw/zinc/15/74/20/411157420.db2.gz YKYRLBHHHNBZQL-UHFFFAOYSA-N 1 1 244.382 3.758 20 0 BHADMO c1cnc2c(c1)C[N@@H+](CCC1CCCCCC1)C2 ZINC000653657464 411157417 /nfs/dbraw/zinc/15/74/17/411157417.db2.gz YKYRLBHHHNBZQL-UHFFFAOYSA-N 1 1 244.382 3.758 20 0 BHADMO C[C@@H]1C[N@@H+](CCC(C)(C)C2CC2)CCC1(F)F ZINC000653679329 411173511 /nfs/dbraw/zinc/17/35/11/411173511.db2.gz YATPNIAYZDYDOF-LLVKDONJSA-N 1 1 245.357 3.790 20 0 BHADMO C[C@H]1C[N@@H+](CCC(C)(C)C2CC2)CCC1(F)F ZINC000653679330 411173253 /nfs/dbraw/zinc/17/32/53/411173253.db2.gz YATPNIAYZDYDOF-NSHDSACASA-N 1 1 245.357 3.790 20 0 BHADMO CC(C)(C)CCC[N@H+]1CC[C@H](c2ccncc2)C1 ZINC000653681304 411175702 /nfs/dbraw/zinc/17/57/02/411175702.db2.gz LVCSKGZDEXFCPB-HNNXBMFYSA-N 1 1 246.398 3.697 20 0 BHADMO CC(C)(C)CCC[N@H+]1CC[C@@H](c2ccncc2)C1 ZINC000653681305 411175661 /nfs/dbraw/zinc/17/56/61/411175661.db2.gz LVCSKGZDEXFCPB-OAHLLOKOSA-N 1 1 246.398 3.697 20 0 BHADMO Cc1ccc(C[N@@H+](C)CCC(C)(C)C2CC2)nc1 ZINC000653732041 411274296 /nfs/dbraw/zinc/27/42/96/411274296.db2.gz SSOWARMAENPCJM-UHFFFAOYSA-N 1 1 246.398 3.648 20 0 BHADMO Cc1nsc(C)c1C[N@H+]1[C@H](C)CCC1(C)C ZINC000653755260 411329852 /nfs/dbraw/zinc/32/98/52/411329852.db2.gz QFPKEIWYUUOJLS-SECBINFHSA-N 1 1 238.400 3.523 20 0 BHADMO Cc1nsc(C)c1C[N@H+]1[C@@H](C)CCC1(C)C ZINC000653755261 411330007 /nfs/dbraw/zinc/33/00/07/411330007.db2.gz QFPKEIWYUUOJLS-VIFPVBQESA-N 1 1 238.400 3.523 20 0 BHADMO Cc1nsc(C)c1C[N@@H+](C)CCC(C)(C)C ZINC000653775944 411165832 /nfs/dbraw/zinc/16/58/32/411165832.db2.gz LDBJDYMQEVECAQ-UHFFFAOYSA-N 1 1 240.416 3.628 20 0 BHADMO CC(C)(CC[N@H+]1CC[C@@]2(CC2(F)F)C1)C1CC1 ZINC000653780094 411169421 /nfs/dbraw/zinc/16/94/21/411169421.db2.gz VCAQESJSGBMCLS-CYBMUJFWSA-N 1 1 243.341 3.544 20 0 BHADMO CC(C)(CC[N@H+]1CC[C@]2(CC2(F)F)C1)C1CC1 ZINC000653780095 411169299 /nfs/dbraw/zinc/16/92/99/411169299.db2.gz VCAQESJSGBMCLS-ZDUSSCGKSA-N 1 1 243.341 3.544 20 0 BHADMO CCC[N@@H+](C[C@@H]1CCC(F)(F)C1)C(C)C ZINC000653798899 411183697 /nfs/dbraw/zinc/18/36/97/411183697.db2.gz UJYLMCJQLSKRPW-LLVKDONJSA-N 1 1 219.319 3.542 20 0 BHADMO CCC[N@@H+](C[C@H]1CCC(F)(F)C1)C(C)C ZINC000653798900 411183643 /nfs/dbraw/zinc/18/36/43/411183643.db2.gz UJYLMCJQLSKRPW-NSHDSACASA-N 1 1 219.319 3.542 20 0 BHADMO CC(C)C[C@H](C)[NH+]1Cc2cc(F)c(F)cc2C1 ZINC000653830795 411195821 /nfs/dbraw/zinc/19/58/21/411195821.db2.gz KJLSPYXKABSXKS-JTQLQIEISA-N 1 1 239.309 3.715 20 0 BHADMO CC(C)C[C@@H](C)[NH+]1Cc2cc(F)c(F)cc2C1 ZINC000653830796 411195765 /nfs/dbraw/zinc/19/57/65/411195765.db2.gz KJLSPYXKABSXKS-SNVBAGLBSA-N 1 1 239.309 3.715 20 0 BHADMO c1cc(C[N@@H+]2CCC[C@H]2CC2CCCC2)ccn1 ZINC000653892171 411210942 /nfs/dbraw/zinc/21/09/42/411210942.db2.gz BQVPTQIHTIQYEX-INIZCTEOSA-N 1 1 244.382 3.626 20 0 BHADMO c1cc(C[N@@H+]2CCC[C@@H]2CC2CCCC2)ccn1 ZINC000653892172 411210893 /nfs/dbraw/zinc/21/08/93/411210893.db2.gz BQVPTQIHTIQYEX-MRXNPFEDSA-N 1 1 244.382 3.626 20 0 BHADMO c1cncc(C[N@@H+]2CCC[C@H]2CC2CCCC2)c1 ZINC000653892336 411210798 /nfs/dbraw/zinc/21/07/98/411210798.db2.gz GWCXZRHLILXESJ-INIZCTEOSA-N 1 1 244.382 3.626 20 0 BHADMO c1cncc(C[N@@H+]2CCC[C@@H]2CC2CCCC2)c1 ZINC000653892337 411210805 /nfs/dbraw/zinc/21/08/05/411210805.db2.gz GWCXZRHLILXESJ-MRXNPFEDSA-N 1 1 244.382 3.626 20 0 BHADMO Cc1cc(C[N@H+]2CCC[C@H]2CC2CCCC2)no1 ZINC000653892673 641714844 /nfs/dbraw/zinc/71/48/44/641714844.db2.gz MPMPZKRKYUMYQQ-HNNXBMFYSA-N 1 1 248.370 3.528 20 0 BHADMO Cc1cc(C[N@H+]2CCC[C@@H]2CC2CCCC2)no1 ZINC000653892674 541470074 /nfs/dbraw/zinc/47/00/74/541470074.db2.gz MPMPZKRKYUMYQQ-OAHLLOKOSA-N 1 1 248.370 3.528 20 0 BHADMO c1ccc(C[N@@H+]2CCC[C@H]2CC2CCCC2)nc1 ZINC000653893336 411212045 /nfs/dbraw/zinc/21/20/45/411212045.db2.gz YWUVTMSDOHPSOA-INIZCTEOSA-N 1 1 244.382 3.626 20 0 BHADMO c1ccc(C[N@@H+]2CCC[C@@H]2CC2CCCC2)nc1 ZINC000653893337 411212078 /nfs/dbraw/zinc/21/20/78/411212078.db2.gz YWUVTMSDOHPSOA-MRXNPFEDSA-N 1 1 244.382 3.626 20 0 BHADMO CCC[N@@H+](Cc1ccc2cnccc2c1)C(C)C ZINC000656268538 411222517 /nfs/dbraw/zinc/22/25/17/411222517.db2.gz CKOMGAUESLDWMC-UHFFFAOYSA-N 1 1 242.366 3.855 20 0 BHADMO CCC[N@@H+](Cc1cccc2cnccc21)C(C)C ZINC000656269172 488073874 /nfs/dbraw/zinc/07/38/74/488073874.db2.gz LMPANOIAFGFKAH-UHFFFAOYSA-N 1 1 242.366 3.855 20 0 BHADMO CCC[N@@H+](C[C@@H]1CCOc2ccccc21)C(C)C ZINC000656269476 488073456 /nfs/dbraw/zinc/07/34/56/488073456.db2.gz PZRXBHBWZFYOEZ-AWEZNQCLSA-N 1 1 247.382 3.673 20 0 BHADMO CCC[N@@H+](C[C@H]1CCOc2ccccc21)C(C)C ZINC000656269477 488073491 /nfs/dbraw/zinc/07/34/91/488073491.db2.gz PZRXBHBWZFYOEZ-CQSZACIVSA-N 1 1 247.382 3.673 20 0 BHADMO CCC[N@@H+](Cc1nccc2ccccc21)C(C)C ZINC000656270325 411220289 /nfs/dbraw/zinc/22/02/89/411220289.db2.gz ZLJQUBIJVKNTLE-UHFFFAOYSA-N 1 1 242.366 3.855 20 0 BHADMO CCC[N@@H+](Cc1cc2ccccc2[nH]1)C(C)C ZINC000656270345 411220510 /nfs/dbraw/zinc/22/05/10/411220510.db2.gz ZYMDOTUFFMEMBC-UHFFFAOYSA-N 1 1 230.355 3.788 20 0 BHADMO Fc1cc2c(cc1F)C[NH+](C[C@@H]1CC=CCC1)C2 ZINC000656275437 411225275 /nfs/dbraw/zinc/22/52/75/411225275.db2.gz NVZSKVWIBZYGGN-LLVKDONJSA-N 1 1 249.304 3.637 20 0 BHADMO Fc1cc2c(cc1F)C[NH+](C[C@H]1CC=CCC1)C2 ZINC000656275441 411224980 /nfs/dbraw/zinc/22/49/80/411224980.db2.gz NVZSKVWIBZYGGN-NSHDSACASA-N 1 1 249.304 3.637 20 0 BHADMO Cc1nocc1C[N@H+]1CCC[C@H]1CC1CCCC1 ZINC000656277746 411227486 /nfs/dbraw/zinc/22/74/86/411227486.db2.gz CPUMIJGWGIOTPI-HNNXBMFYSA-N 1 1 248.370 3.528 20 0 BHADMO Cc1nocc1C[N@H+]1CCC[C@@H]1CC1CCCC1 ZINC000656277747 411227982 /nfs/dbraw/zinc/22/79/82/411227982.db2.gz CPUMIJGWGIOTPI-OAHLLOKOSA-N 1 1 248.370 3.528 20 0 BHADMO FC1(F)CCC(C[N@H+]2CCC[C@@H]2C2CC2)CC1 ZINC000656431888 411249719 /nfs/dbraw/zinc/24/97/19/411249719.db2.gz DMPIHFNMIMMYDV-CYBMUJFWSA-N 1 1 243.341 3.686 20 0 BHADMO FC1(F)CCC(C[N@H+]2CCC[C@H]2C2CC2)CC1 ZINC000656431889 411249887 /nfs/dbraw/zinc/24/98/87/411249887.db2.gz DMPIHFNMIMMYDV-ZDUSSCGKSA-N 1 1 243.341 3.686 20 0 BHADMO CC(C)[N@@H+](CC1CC1)CC1CCC(F)(F)CC1 ZINC000656461288 411270265 /nfs/dbraw/zinc/27/02/65/411270265.db2.gz HUYYZZALPROIKQ-UHFFFAOYSA-N 1 1 245.357 3.932 20 0 BHADMO c1cc2cc[nH+]cc2c(NC2CC3(CCC3)C2)c1 ZINC000656529602 411290076 /nfs/dbraw/zinc/29/00/76/411290076.db2.gz ABQCGHXITVRLCC-UHFFFAOYSA-N 1 1 238.334 3.979 20 0 BHADMO CC(C)([NH2+]CCc1cccc(Cl)c1)C(F)F ZINC000656582787 411303907 /nfs/dbraw/zinc/30/39/07/411303907.db2.gz PSMMJSYEVLBQQX-UHFFFAOYSA-N 1 1 247.716 3.516 20 0 BHADMO CC(C)([NH2+]CCc1ccc(Cl)cc1)C(F)F ZINC000656582830 411304460 /nfs/dbraw/zinc/30/44/60/411304460.db2.gz XSRMQWDPWKSOGG-UHFFFAOYSA-N 1 1 247.716 3.516 20 0 BHADMO Clc1cscc1C[NH+]1CC2(C1)CCCC2 ZINC000656623209 411311967 /nfs/dbraw/zinc/31/19/67/411311967.db2.gz XKYQPKKNRIZVFV-UHFFFAOYSA-N 1 1 241.787 3.778 20 0 BHADMO C[N@@H+](Cc1cc2ccccc2[nH]1)C1CC(C)(C)C1 ZINC000657193451 411416938 /nfs/dbraw/zinc/41/69/38/411416938.db2.gz GSGCXVRTYJGPFF-UHFFFAOYSA-N 1 1 242.366 3.788 20 0 BHADMO CCCc1[nH+]ccn1Cc1ccsc1Cl ZINC000657253698 411435564 /nfs/dbraw/zinc/43/55/64/411435564.db2.gz FQMYFMXNOQSXSA-UHFFFAOYSA-N 1 1 240.759 3.599 20 0 BHADMO CCCc1[nH+]ccn1C[C@@H](CC)CC(F)F ZINC000657254350 411435784 /nfs/dbraw/zinc/43/57/84/411435784.db2.gz QKYYEKIANXOBBR-JTQLQIEISA-N 1 1 230.302 3.517 20 0 BHADMO CCCc1[nH+]ccn1C[C@H](CC)CC(F)F ZINC000657254351 411435693 /nfs/dbraw/zinc/43/56/93/411435693.db2.gz QKYYEKIANXOBBR-SNVBAGLBSA-N 1 1 230.302 3.517 20 0 BHADMO CCCc1[nH+]ccn1Cc1cccc(SC)c1 ZINC000657254543 411435930 /nfs/dbraw/zinc/43/59/30/411435930.db2.gz TZWODXFWKWOPOW-UHFFFAOYSA-N 1 1 246.379 3.606 20 0 BHADMO CC[C@@H](CC(F)F)Cn1cc[nH+]c1C(C)C ZINC000657254623 411436010 /nfs/dbraw/zinc/43/60/10/411436010.db2.gz AWXWJKXRIGDBOU-JTQLQIEISA-N 1 1 230.302 3.688 20 0 BHADMO CC[C@H](CC(F)F)Cn1cc[nH+]c1C(C)C ZINC000657254625 411436083 /nfs/dbraw/zinc/43/60/83/411436083.db2.gz AWXWJKXRIGDBOU-SNVBAGLBSA-N 1 1 230.302 3.688 20 0 BHADMO Cc1[nH+]cn(Cc2cccc(C(C)(C)C)c2)c1C ZINC000657255151 411429388 /nfs/dbraw/zinc/42/93/88/411429388.db2.gz ZUDZQIUKXIIRDZ-UHFFFAOYSA-N 1 1 242.366 3.846 20 0 BHADMO CC(C)c1[nH+]ccn1CCCC1CCC1 ZINC000657255318 411429005 /nfs/dbraw/zinc/42/90/05/411429005.db2.gz JBNRTQOZCDWGQB-UHFFFAOYSA-N 1 1 206.333 3.587 20 0 BHADMO CSc1cccc(Cn2cc[nH+]c2C(C)C)c1 ZINC000657255341 411428592 /nfs/dbraw/zinc/42/85/92/411428592.db2.gz JSPONQOBUXPBMK-UHFFFAOYSA-N 1 1 246.379 3.777 20 0 BHADMO Cc1[nH+]cn(CC[C@@H]2CCc3ccccc32)c1C ZINC000657255616 411429055 /nfs/dbraw/zinc/42/90/55/411429055.db2.gz MQARSNURVFLMSJ-HNNXBMFYSA-N 1 1 240.350 3.620 20 0 BHADMO Cc1[nH+]cn(CC[C@H]2CCc3ccccc32)c1C ZINC000657255617 411429357 /nfs/dbraw/zinc/42/93/57/411429357.db2.gz MQARSNURVFLMSJ-OAHLLOKOSA-N 1 1 240.350 3.620 20 0 BHADMO CC(C)c1[nH+]ccn1Cc1ccsc1Cl ZINC000657255653 411429344 /nfs/dbraw/zinc/42/93/44/411429344.db2.gz NRUFSTIEFYYTDJ-UHFFFAOYSA-N 1 1 240.759 3.770 20 0 BHADMO CCc1[nH+]ccn1CC[C@@H]1CCc2ccccc21 ZINC000657256223 411429903 /nfs/dbraw/zinc/42/99/03/411429903.db2.gz XANDLUPRIPMQRH-AWEZNQCLSA-N 1 1 240.350 3.566 20 0 BHADMO CCc1[nH+]ccn1CC[C@H]1CCc2ccccc21 ZINC000657256225 411430459 /nfs/dbraw/zinc/43/04/59/411430459.db2.gz XANDLUPRIPMQRH-CQSZACIVSA-N 1 1 240.350 3.566 20 0 BHADMO Cc1[nH+]ccn1Cc1cccc(C(C)(C)C)c1 ZINC000657256502 411430581 /nfs/dbraw/zinc/43/05/81/411430581.db2.gz ZQRGPKLDSYXNRF-UHFFFAOYSA-N 1 1 228.339 3.537 20 0 BHADMO Clc1ccc2c(c1)C[N@@H+](C1CCCC1)C2 ZINC000657309400 411459200 /nfs/dbraw/zinc/45/92/00/411459200.db2.gz XZACBUQEPKTCKW-UHFFFAOYSA-N 1 1 221.731 3.598 20 0 BHADMO Cc1cccc(C[NH2+][C@H](C)c2cscn2)c1C ZINC000657599757 411558532 /nfs/dbraw/zinc/55/85/32/411558532.db2.gz UKINMTMLZRTZJY-GFCCVEGCSA-N 1 1 246.379 3.611 20 0 BHADMO Cc1cccc(C[NH2+][C@@H](C)c2cscn2)c1C ZINC000657599758 411558688 /nfs/dbraw/zinc/55/86/88/411558688.db2.gz UKINMTMLZRTZJY-LBPRGKRZSA-N 1 1 246.379 3.611 20 0 BHADMO CC(C)[C@H]([NH2+]Cc1ccco1)c1ccccc1F ZINC000657616056 411563920 /nfs/dbraw/zinc/56/39/20/411563920.db2.gz VCNHIUBOUXTOBV-HNNXBMFYSA-N 1 1 247.313 3.906 20 0 BHADMO CC(C)[C@@H]([NH2+]Cc1ccco1)c1ccccc1F ZINC000657616062 411563637 /nfs/dbraw/zinc/56/36/37/411563637.db2.gz VCNHIUBOUXTOBV-OAHLLOKOSA-N 1 1 247.313 3.906 20 0 BHADMO FC(F)C1([NH2+]C2CCC(C3CCC3)CC2)CC1 ZINC000658005295 411195743 /nfs/dbraw/zinc/19/57/43/411195743.db2.gz XWQKLBPYOWZYQV-UHFFFAOYSA-N 1 1 243.341 3.733 20 0 BHADMO c1cc(C2CC2)cc(N[C@@H]2CCCC23CC3)[nH+]1 ZINC000658018875 411198780 /nfs/dbraw/zinc/19/87/80/411198780.db2.gz HLCQRJBLOIQYEN-CYBMUJFWSA-N 1 1 228.339 3.704 20 0 BHADMO c1cc(C2CC2)cc(N[C@H]2CCCC23CC3)[nH+]1 ZINC000658018877 411198522 /nfs/dbraw/zinc/19/85/22/411198522.db2.gz HLCQRJBLOIQYEN-ZDUSSCGKSA-N 1 1 228.339 3.704 20 0 BHADMO COc1cccc([C@@H]2CCC[N@H+]2CCC(C)C)c1 ZINC000658707698 411359407 /nfs/dbraw/zinc/35/94/07/411359407.db2.gz GAJBLSNFNLZTPI-INIZCTEOSA-N 1 1 247.382 3.878 20 0 BHADMO COc1cccc([C@H]2CCC[N@H+]2CCC(C)C)c1 ZINC000658707700 411360408 /nfs/dbraw/zinc/36/04/08/411360408.db2.gz GAJBLSNFNLZTPI-MRXNPFEDSA-N 1 1 247.382 3.878 20 0 BHADMO CC(C)=CCC[N@H+]1CCC[C@H](C(F)(F)F)C1 ZINC000659812625 411460558 /nfs/dbraw/zinc/46/05/58/411460558.db2.gz CBIAKHHAKOUEPA-NSHDSACASA-N 1 1 235.293 3.617 20 0 BHADMO C[N@H+](Cc1cc(C2CC2)no1)CC1CCCCC1 ZINC000659812724 411299875 /nfs/dbraw/zinc/29/98/75/411299875.db2.gz NAZYTSNILKLIEZ-UHFFFAOYSA-N 1 1 248.370 3.564 20 0 BHADMO CCCC[N@@H+](C)Cc1nsc2ccccc21 ZINC000659812982 411461753 /nfs/dbraw/zinc/46/17/53/411461753.db2.gz DPPWCFARFUNSNJ-UHFFFAOYSA-N 1 1 234.368 3.528 20 0 BHADMO COc1ccc([C@@H](C)[N@@H+](C)CC2CC=CC2)cc1 ZINC000659814875 411301518 /nfs/dbraw/zinc/30/15/18/411301518.db2.gz VJNQLPIKLIOCJS-CYBMUJFWSA-N 1 1 245.366 3.654 20 0 BHADMO COc1ccc([C@H](C)[N@@H+](C)CC2CC=CC2)cc1 ZINC000659814876 411301782 /nfs/dbraw/zinc/30/17/82/411301782.db2.gz VJNQLPIKLIOCJS-ZDUSSCGKSA-N 1 1 245.366 3.654 20 0 BHADMO CCCC[N@@H+](C)CCc1nsc2ccccc21 ZINC000659815031 411301707 /nfs/dbraw/zinc/30/17/07/411301707.db2.gz ZIPJPWHTVIUDFF-UHFFFAOYSA-N 1 1 248.395 3.571 20 0 BHADMO C[N@@H+](Cc1cc(C2CC2)no1)C1CCCCCC1 ZINC000659815974 411461828 /nfs/dbraw/zinc/46/18/28/411461828.db2.gz MWOFUXAXULPBIL-UHFFFAOYSA-N 1 1 248.370 3.707 20 0 BHADMO CCC[N@@H+](C[C@H](CC)CC(F)F)CC1CC1 ZINC000659816038 411303116 /nfs/dbraw/zinc/30/31/16/411303116.db2.gz OGLMBWILLSSBKG-LLVKDONJSA-N 1 1 233.346 3.790 20 0 BHADMO CCC[N@@H+](C[C@@H](CC)CC(F)F)CC1CC1 ZINC000659816045 411303101 /nfs/dbraw/zinc/30/31/01/411303101.db2.gz OGLMBWILLSSBKG-NSHDSACASA-N 1 1 233.346 3.790 20 0 BHADMO CC[N@H+](Cc1cccs1)CC1CC=CC1 ZINC000659816125 411302832 /nfs/dbraw/zinc/30/28/32/411302832.db2.gz OYUATBXLFDLIAZ-UHFFFAOYSA-N 1 1 221.369 3.536 20 0 BHADMO CCCC[N@@H+](CC)C[C@H](CC)CC(F)F ZINC000659817096 411462774 /nfs/dbraw/zinc/46/27/74/411462774.db2.gz XULNOJKDAKFNTP-LLVKDONJSA-N 1 1 221.335 3.790 20 0 BHADMO CCCC[N@@H+](CC)C[C@@H](CC)CC(F)F ZINC000659817102 411462510 /nfs/dbraw/zinc/46/25/10/411462510.db2.gz XULNOJKDAKFNTP-NSHDSACASA-N 1 1 221.335 3.790 20 0 BHADMO CC[N@H+](Cc1cccs1)C[C@@H]1C[C@H]2C[C@H]2C1 ZINC000659817361 411463353 /nfs/dbraw/zinc/46/33/53/411463353.db2.gz YNTNFVQAYDVIFV-CLLJXQQHSA-N 1 1 235.396 3.616 20 0 BHADMO CSc1cccc(C[N@@H+](C)Cc2ccco2)c1 ZINC000659817364 411462551 /nfs/dbraw/zinc/46/25/51/411462551.db2.gz YRTGBNNUQMTVEU-UHFFFAOYSA-N 1 1 247.363 3.634 20 0 BHADMO C[N@H+](Cc1ccc(Cl)s1)CC1CC=CC1 ZINC000659817787 411462420 /nfs/dbraw/zinc/46/24/20/411462420.db2.gz PHZWQHZFHGMUDI-UHFFFAOYSA-N 1 1 241.787 3.800 20 0 BHADMO c1csc([C@H]2CCC[N@@H+]2CC2CC=CC2)c1 ZINC000659817983 411462830 /nfs/dbraw/zinc/46/28/30/411462830.db2.gz SDEGYVUYWSEPAS-CYBMUJFWSA-N 1 1 233.380 3.851 20 0 BHADMO c1csc([C@@H]2CCC[N@@H+]2CC2CC=CC2)c1 ZINC000659817984 411462673 /nfs/dbraw/zinc/46/26/73/411462673.db2.gz SDEGYVUYWSEPAS-ZDUSSCGKSA-N 1 1 233.380 3.851 20 0 BHADMO CC(C)=CCC[N@H+](C)Cc1ccsc1 ZINC000659821014 411463298 /nfs/dbraw/zinc/46/32/98/411463298.db2.gz LIWAIDXVUPMLKX-UHFFFAOYSA-N 1 1 209.358 3.536 20 0 BHADMO C[C@H](c1ccccc1)[N@@H+](C)CC1CC=CC1 ZINC000659821429 411305564 /nfs/dbraw/zinc/30/55/64/411305564.db2.gz MHNQUUZKXLJWSG-CYBMUJFWSA-N 1 1 215.340 3.646 20 0 BHADMO C[C@@H](c1ccccc1)[N@@H+](C)CC1CC=CC1 ZINC000659821434 411305957 /nfs/dbraw/zinc/30/59/57/411305957.db2.gz MHNQUUZKXLJWSG-ZDUSSCGKSA-N 1 1 215.340 3.646 20 0 BHADMO c1csc(C[N@H+](CC2CC=CC2)C2CC2)c1 ZINC000659821535 411462757 /nfs/dbraw/zinc/46/27/57/411462757.db2.gz NJXGKIIXQZJJAE-UHFFFAOYSA-N 1 1 233.380 3.679 20 0 BHADMO C[N@@H+](Cc1ccsc1)[C@@H]1C[C@@H]1c1ccccc1 ZINC000659822287 411305288 /nfs/dbraw/zinc/30/52/88/411305288.db2.gz RZIOIGIVONGMGE-HUUCEWRRSA-N 1 1 243.375 3.736 20 0 BHADMO CC1CCC([N@@H+](C)Cc2cc(C3CC3)no2)CC1 ZINC000659822391 411463889 /nfs/dbraw/zinc/46/38/89/411463889.db2.gz STVFDJRAZLGHBD-UHFFFAOYSA-N 1 1 248.370 3.563 20 0 BHADMO CC[C@@H](CC(F)F)C[N@@H+](C)Cc1ccsc1 ZINC000659823140 411464426 /nfs/dbraw/zinc/46/44/26/411464426.db2.gz YZFYOGIWGFTWNK-JTQLQIEISA-N 1 1 247.354 3.861 20 0 BHADMO CC[C@H](CC(F)F)C[N@@H+](C)Cc1ccsc1 ZINC000659823141 411463655 /nfs/dbraw/zinc/46/36/55/411463655.db2.gz YZFYOGIWGFTWNK-SNVBAGLBSA-N 1 1 247.354 3.861 20 0 BHADMO CC[C@@H](CC(F)F)C[N@@H+](C)C1CCCC1 ZINC000659823795 411463792 /nfs/dbraw/zinc/46/37/92/411463792.db2.gz KBXFPVNLBCXKOJ-JTQLQIEISA-N 1 1 219.319 3.542 20 0 BHADMO CC[C@H](CC(F)F)C[N@@H+](C)C1CCCC1 ZINC000659823797 411463688 /nfs/dbraw/zinc/46/36/88/411463688.db2.gz KBXFPVNLBCXKOJ-SNVBAGLBSA-N 1 1 219.319 3.542 20 0 BHADMO CC[C@H](CC(F)F)C[N@@H+](C)[C@H](C)C(C)C ZINC000659824233 411307369 /nfs/dbraw/zinc/30/73/69/411307369.db2.gz AMFDSRGSAHYKKI-GHMZBOCLSA-N 1 1 221.335 3.644 20 0 BHADMO CC[C@@H](CC(F)F)C[N@@H+](C)[C@H](C)C(C)C ZINC000659824235 411307294 /nfs/dbraw/zinc/30/72/94/411307294.db2.gz AMFDSRGSAHYKKI-MNOVXSKESA-N 1 1 221.335 3.644 20 0 BHADMO CC[C@@H](CC(F)F)C[N@@H+](C)[C@@H](C)C(C)C ZINC000659824237 411307278 /nfs/dbraw/zinc/30/72/78/411307278.db2.gz AMFDSRGSAHYKKI-QWRGUYRKSA-N 1 1 221.335 3.644 20 0 BHADMO CC[C@H](CC(F)F)C[N@@H+](C)[C@@H](C)C(C)C ZINC000659824240 411307344 /nfs/dbraw/zinc/30/73/44/411307344.db2.gz AMFDSRGSAHYKKI-WDEREUQCSA-N 1 1 221.335 3.644 20 0 BHADMO C[N@@H+](Cc1nsc2ccccc21)C1CCCC1 ZINC000659824851 411307916 /nfs/dbraw/zinc/30/79/16/411307916.db2.gz YVEMBWDEZTVSHF-UHFFFAOYSA-N 1 1 246.379 3.671 20 0 BHADMO CC[C@@H](CC(F)F)C[N@H+]1CCC[C@@H](CC)C1 ZINC000659824896 411464285 /nfs/dbraw/zinc/46/42/85/411464285.db2.gz IWTPVFRAVLZRGH-NEPJUHHUSA-N 1 1 233.346 3.790 20 0 BHADMO CC[C@H](CC(F)F)C[N@H+]1CCC[C@H](CC)C1 ZINC000659824898 411464251 /nfs/dbraw/zinc/46/42/51/411464251.db2.gz IWTPVFRAVLZRGH-NWDGAFQWSA-N 1 1 233.346 3.790 20 0 BHADMO CC[C@@H](CC(F)F)C[N@H+]1CCC[C@H](CC)C1 ZINC000659824900 411463808 /nfs/dbraw/zinc/46/38/08/411463808.db2.gz IWTPVFRAVLZRGH-RYUDHWBXSA-N 1 1 233.346 3.790 20 0 BHADMO CC[C@H](CC(F)F)C[N@H+]1CCC[C@@H](CC)C1 ZINC000659824901 411463836 /nfs/dbraw/zinc/46/38/36/411463836.db2.gz IWTPVFRAVLZRGH-VXGBXAGGSA-N 1 1 233.346 3.790 20 0 BHADMO CC(C)[C@@H](C)[N@@H+](C)Cc1nsc2ccccc21 ZINC000659825154 411464254 /nfs/dbraw/zinc/46/42/54/411464254.db2.gz ORFHWWRXGBLCST-LLVKDONJSA-N 1 1 248.395 3.773 20 0 BHADMO CC(C)[C@H](C)[N@@H+](C)Cc1nsc2ccccc21 ZINC000659825155 411464392 /nfs/dbraw/zinc/46/43/92/411464392.db2.gz ORFHWWRXGBLCST-NSHDSACASA-N 1 1 248.395 3.773 20 0 BHADMO C[C@@H](C1CC1)[N@@H+](C)Cc1nsc2ccccc21 ZINC000659825487 411308012 /nfs/dbraw/zinc/30/80/12/411308012.db2.gz BDGMEXDOSXGPQV-JTQLQIEISA-N 1 1 246.379 3.527 20 0 BHADMO C[C@H](C1CC1)[N@@H+](C)Cc1nsc2ccccc21 ZINC000659825488 411307990 /nfs/dbraw/zinc/30/79/90/411307990.db2.gz BDGMEXDOSXGPQV-SNVBAGLBSA-N 1 1 246.379 3.527 20 0 BHADMO CC(C)=CCC[N@H+](C)Cc1cccs1 ZINC000659826515 411309385 /nfs/dbraw/zinc/30/93/85/411309385.db2.gz MRJULOSMICPDPE-UHFFFAOYSA-N 1 1 209.358 3.536 20 0 BHADMO CC[C@H](CC(F)F)C[N@@H+](C)Cc1ccccc1 ZINC000659826600 411309656 /nfs/dbraw/zinc/30/96/56/411309656.db2.gz IQYWGQYSQGSUST-GFCCVEGCSA-N 1 1 241.325 3.800 20 0 BHADMO CC[C@@H](CC(F)F)C[N@@H+](C)Cc1ccccc1 ZINC000659826607 411309175 /nfs/dbraw/zinc/30/91/75/411309175.db2.gz IQYWGQYSQGSUST-LBPRGKRZSA-N 1 1 241.325 3.800 20 0 BHADMO CC[C@H](CC(F)F)C[N@@H+](C)Cc1ccc(C)o1 ZINC000659826897 411465273 /nfs/dbraw/zinc/46/52/73/411465273.db2.gz LFRFROTYYXYZHR-LLVKDONJSA-N 1 1 245.313 3.701 20 0 BHADMO CC[C@@H](CC(F)F)C[N@@H+](C)Cc1ccc(C)o1 ZINC000659826898 411465680 /nfs/dbraw/zinc/46/56/80/411465680.db2.gz LFRFROTYYXYZHR-NSHDSACASA-N 1 1 245.313 3.701 20 0 BHADMO CC[C@@H](CC(F)F)C[N@@H+](C)Cc1cccs1 ZINC000659827120 411310313 /nfs/dbraw/zinc/31/03/13/411310313.db2.gz UBWDDQLHTBGWCV-JTQLQIEISA-N 1 1 247.354 3.861 20 0 BHADMO CC[C@H](CC(F)F)C[N@@H+](C)Cc1cccs1 ZINC000659827122 411310760 /nfs/dbraw/zinc/31/07/60/411310760.db2.gz UBWDDQLHTBGWCV-SNVBAGLBSA-N 1 1 247.354 3.861 20 0 BHADMO CSc1cccc(C[N@@H+](C)[C@H](C)C2CC2)c1 ZINC000659827834 411466251 /nfs/dbraw/zinc/46/62/51/411466251.db2.gz YUGPLXZCMATNOB-LLVKDONJSA-N 1 1 235.396 3.639 20 0 BHADMO CSc1cccc(C[N@@H+](C)[C@@H](C)C2CC2)c1 ZINC000659827835 411466720 /nfs/dbraw/zinc/46/67/20/411466720.db2.gz YUGPLXZCMATNOB-NSHDSACASA-N 1 1 235.396 3.639 20 0 BHADMO C[C@@H]1CCCC[N@H+]1Cc1nsc2ccccc21 ZINC000659828443 411466533 /nfs/dbraw/zinc/46/65/33/411466533.db2.gz DHHSHQLTEYJLNL-LLVKDONJSA-N 1 1 246.379 3.671 20 0 BHADMO C[C@H]1CCCC[N@H+]1Cc1nsc2ccccc21 ZINC000659828444 411467024 /nfs/dbraw/zinc/46/70/24/411467024.db2.gz DHHSHQLTEYJLNL-NSHDSACASA-N 1 1 246.379 3.671 20 0 BHADMO C[C@@H]1CCC[N@@H+](Cc2nsc3ccccc32)C1 ZINC000659829503 411312216 /nfs/dbraw/zinc/31/22/16/411312216.db2.gz ROBLTIIOECQTBC-LLVKDONJSA-N 1 1 246.379 3.528 20 0 BHADMO C[C@H]1CCC[N@@H+](Cc2nsc3ccccc32)C1 ZINC000659829504 411312298 /nfs/dbraw/zinc/31/22/98/411312298.db2.gz ROBLTIIOECQTBC-NSHDSACASA-N 1 1 246.379 3.528 20 0 BHADMO CC[C@H](CC(F)F)C[N@@H+](C)C1CCCCC1 ZINC000659829877 411313395 /nfs/dbraw/zinc/31/33/95/411313395.db2.gz WCMDGQGQSGEQGN-LLVKDONJSA-N 1 1 233.346 3.932 20 0 BHADMO CC[C@@H](CC(F)F)C[N@@H+](C)C1CCCCC1 ZINC000659829878 411313466 /nfs/dbraw/zinc/31/34/66/411313466.db2.gz WCMDGQGQSGEQGN-NSHDSACASA-N 1 1 233.346 3.932 20 0 BHADMO CC[C@H](CC(F)F)C[N@H+]1CCCC[C@H]1C ZINC000659829945 411466836 /nfs/dbraw/zinc/46/68/36/411466836.db2.gz XJGOTDJTPCVFMH-GHMZBOCLSA-N 1 1 219.319 3.542 20 0 BHADMO CC[C@@H](CC(F)F)C[N@H+]1CCCC[C@H]1C ZINC000659829946 411467029 /nfs/dbraw/zinc/46/70/29/411467029.db2.gz XJGOTDJTPCVFMH-MNOVXSKESA-N 1 1 219.319 3.542 20 0 BHADMO CC[C@@H](CC(F)F)C[N@H+]1CCCC[C@@H]1C ZINC000659829947 411466928 /nfs/dbraw/zinc/46/69/28/411466928.db2.gz XJGOTDJTPCVFMH-QWRGUYRKSA-N 1 1 219.319 3.542 20 0 BHADMO CC[C@H](CC(F)F)C[N@H+]1CCCC[C@@H]1C ZINC000659829948 411466985 /nfs/dbraw/zinc/46/69/85/411466985.db2.gz XJGOTDJTPCVFMH-WDEREUQCSA-N 1 1 219.319 3.542 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)C[C@H](CC)CC(F)F ZINC000659835559 411469650 /nfs/dbraw/zinc/46/96/50/411469650.db2.gz FNMGGEDXLLUWAF-GHMZBOCLSA-N 1 1 221.335 3.788 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)C[C@@H](CC)CC(F)F ZINC000659835561 411469161 /nfs/dbraw/zinc/46/91/61/411469161.db2.gz FNMGGEDXLLUWAF-MNOVXSKESA-N 1 1 221.335 3.788 20 0 BHADMO CCC[C@H](C)[N@@H+](C)C[C@@H](CC)CC(F)F ZINC000659835562 411469965 /nfs/dbraw/zinc/46/99/65/411469965.db2.gz FNMGGEDXLLUWAF-QWRGUYRKSA-N 1 1 221.335 3.788 20 0 BHADMO CCC[C@H](C)[N@@H+](C)C[C@H](CC)CC(F)F ZINC000659835563 411469385 /nfs/dbraw/zinc/46/93/85/411469385.db2.gz FNMGGEDXLLUWAF-WDEREUQCSA-N 1 1 221.335 3.788 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)Cc1nsc2ccccc21 ZINC000659835700 411470125 /nfs/dbraw/zinc/47/01/25/411470125.db2.gz GPHQQYVAHYCJOF-LLVKDONJSA-N 1 1 248.395 3.917 20 0 BHADMO CCC[C@H](C)[N@@H+](C)Cc1nsc2ccccc21 ZINC000659835701 411469890 /nfs/dbraw/zinc/46/98/90/411469890.db2.gz GPHQQYVAHYCJOF-NSHDSACASA-N 1 1 248.395 3.917 20 0 BHADMO C[N@@H+](CC1CC=CC1)[C@H]1CCc2ccccc21 ZINC000659836294 411469461 /nfs/dbraw/zinc/46/94/61/411469461.db2.gz XVZNJWWRNGVSMI-INIZCTEOSA-N 1 1 227.351 3.572 20 0 BHADMO C[N@@H+](CC1CC=CC1)[C@@H]1CCc2ccccc21 ZINC000659836295 411469812 /nfs/dbraw/zinc/46/98/12/411469812.db2.gz XVZNJWWRNGVSMI-MRXNPFEDSA-N 1 1 227.351 3.572 20 0 BHADMO CC[C@H](CC(F)F)C[N@@H+](CC(C)C)C1CC1 ZINC000659837266 411471072 /nfs/dbraw/zinc/47/10/72/411471072.db2.gz INERMEZSNFSXFF-LLVKDONJSA-N 1 1 233.346 3.788 20 0 BHADMO CC[C@@H](CC(F)F)C[N@@H+](CC(C)C)C1CC1 ZINC000659837267 411470752 /nfs/dbraw/zinc/47/07/52/411470752.db2.gz INERMEZSNFSXFF-NSHDSACASA-N 1 1 233.346 3.788 20 0 BHADMO 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218.344 3.508 20 0 BHADMO CC(C)=CCC[N@H+]1CCC[C@@H]1c1ccc[nH]1 ZINC000660032763 411530303 /nfs/dbraw/zinc/53/03/03/411530303.db2.gz RDVOSJHRQDGEAT-CQSZACIVSA-N 1 1 218.344 3.508 20 0 BHADMO c1c[nH]c([C@@H]2CCC[N@@H+]2CCCC2CCC2)c1 ZINC000660032768 411530166 /nfs/dbraw/zinc/53/01/66/411530166.db2.gz REZXRXAYWUVXDD-HNNXBMFYSA-N 1 1 232.371 3.732 20 0 BHADMO c1c[nH]c([C@H]2CCC[N@@H+]2CCCC2CCC2)c1 ZINC000660032769 411530359 /nfs/dbraw/zinc/53/03/59/411530359.db2.gz REZXRXAYWUVXDD-OAHLLOKOSA-N 1 1 232.371 3.732 20 0 BHADMO CC(C)=CCC[N@H+]1CCC[C@H]1c1ccc(O)cc1 ZINC000660035864 411530433 /nfs/dbraw/zinc/53/04/33/411530433.db2.gz FCYOJSPCFOZOAO-INIZCTEOSA-N 1 1 245.366 3.885 20 0 BHADMO CC(C)=CCC[N@H+]1CCC[C@@H]1c1ccc(O)cc1 ZINC000660035865 411529921 /nfs/dbraw/zinc/52/99/21/411529921.db2.gz FCYOJSPCFOZOAO-MRXNPFEDSA-N 1 1 245.366 3.885 20 0 BHADMO Oc1ccc([C@@H]2CCC[N@H+]2CCC2CCC2)cc1 ZINC000660036496 411530390 /nfs/dbraw/zinc/53/03/90/411530390.db2.gz PPDLMCKGIYMQBF-INIZCTEOSA-N 1 1 245.366 3.719 20 0 BHADMO Oc1ccc([C@H]2CCC[N@H+]2CCC2CCC2)cc1 ZINC000660036497 411530254 /nfs/dbraw/zinc/53/02/54/411530254.db2.gz PPDLMCKGIYMQBF-MRXNPFEDSA-N 1 1 245.366 3.719 20 0 BHADMO Cc1nc(C[N@H+](C(C)C)C2CCCCC2)co1 ZINC000660055495 411531428 /nfs/dbraw/zinc/53/14/28/411531428.db2.gz GQMNLYNXKGJKNS-UHFFFAOYSA-N 1 1 236.359 3.526 20 0 BHADMO CC(C)[N@@H+](CC1CC=CC1)C1CCCC1 ZINC000660061575 411202914 /nfs/dbraw/zinc/20/29/14/411202914.db2.gz LUYVWDMBPLULBA-UHFFFAOYSA-N 1 1 207.361 3.606 20 0 BHADMO CC(C)[N@@H+](Cc1cc(C2CC2)no1)C1CCCC1 ZINC000660062891 411532493 /nfs/dbraw/zinc/53/24/93/411532493.db2.gz ZOVTUDAORYRITB-UHFFFAOYSA-N 1 1 248.370 3.705 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1cccc(OC)c1Cl ZINC000660063572 411532704 /nfs/dbraw/zinc/53/27/04/411532704.db2.gz OAZYFIBOKRCBDB-JTQLQIEISA-N 1 1 241.762 3.579 20 0 BHADMO CC[C@@H](C)[N@@H+](C)Cc1cccc(OC)c1Cl ZINC000660063573 411532697 /nfs/dbraw/zinc/53/26/97/411532697.db2.gz OAZYFIBOKRCBDB-SNVBAGLBSA-N 1 1 241.762 3.579 20 0 BHADMO CC[C@@H](C)[N@@H+](C)Cc1cccc(SC)c1 ZINC000660063925 411532370 /nfs/dbraw/zinc/53/23/70/411532370.db2.gz QTWKMXODDJHZTO-LLVKDONJSA-N 1 1 223.385 3.639 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1cccc(SC)c1 ZINC000660063927 411532394 /nfs/dbraw/zinc/53/23/94/411532394.db2.gz QTWKMXODDJHZTO-NSHDSACASA-N 1 1 223.385 3.639 20 0 BHADMO CC[C@@H](C)[N@@H+](C)CCc1nsc2ccccc21 ZINC000660063999 411532752 /nfs/dbraw/zinc/53/27/52/411532752.db2.gz RPHWQUXXGOAGIZ-LLVKDONJSA-N 1 1 248.395 3.569 20 0 BHADMO CC[C@H](C)[N@@H+](C)CCc1nsc2ccccc21 ZINC000660064008 411532582 /nfs/dbraw/zinc/53/25/82/411532582.db2.gz RPHWQUXXGOAGIZ-NSHDSACASA-N 1 1 248.395 3.569 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1nsc2ccccc21 ZINC000660064042 411532308 /nfs/dbraw/zinc/53/23/08/411532308.db2.gz SBUAEMNYCRGCMT-JTQLQIEISA-N 1 1 234.368 3.527 20 0 BHADMO CC[C@@H](C)[N@@H+](C)Cc1nsc2ccccc21 ZINC000660064044 411532215 /nfs/dbraw/zinc/53/22/15/411532215.db2.gz SBUAEMNYCRGCMT-SNVBAGLBSA-N 1 1 234.368 3.527 20 0 BHADMO CC(C)=CCC[N@H+](C)[C@H](C)c1cccc(O)c1 ZINC000660072496 411216138 /nfs/dbraw/zinc/21/61/38/411216138.db2.gz YOGRTYUXYLGZMH-CYBMUJFWSA-N 1 1 233.355 3.741 20 0 BHADMO CC(C)=CCC[N@H+](C)[C@@H](C)c1cccc(O)c1 ZINC000660072497 411216002 /nfs/dbraw/zinc/21/60/02/411216002.db2.gz YOGRTYUXYLGZMH-ZDUSSCGKSA-N 1 1 233.355 3.741 20 0 BHADMO C[C@H](c1cccc(O)c1)[N@@H+](C)CCC1CCC1 ZINC000660072547 411217461 /nfs/dbraw/zinc/21/74/61/411217461.db2.gz ZUMIJFNPMVLLTK-GFCCVEGCSA-N 1 1 233.355 3.575 20 0 BHADMO C[C@@H](c1cccc(O)c1)[N@@H+](C)CCC1CCC1 ZINC000660072548 411217937 /nfs/dbraw/zinc/21/79/37/411217937.db2.gz ZUMIJFNPMVLLTK-LBPRGKRZSA-N 1 1 233.355 3.575 20 0 BHADMO CC[C@@H](CC(F)F)C[N@@H+](C)C(C)(C)CC ZINC000660074178 411533322 /nfs/dbraw/zinc/53/33/22/411533322.db2.gz MUFZOZIQULGVCD-JTQLQIEISA-N 1 1 221.335 3.788 20 0 BHADMO CC[C@H](CC(F)F)C[N@@H+](C)C(C)(C)CC ZINC000660074179 411533166 /nfs/dbraw/zinc/53/31/66/411533166.db2.gz MUFZOZIQULGVCD-SNVBAGLBSA-N 1 1 221.335 3.788 20 0 BHADMO CCC(C)(C)[N@@H+](C)Cc1nsc2ccccc21 ZINC000660075279 411533277 /nfs/dbraw/zinc/53/32/77/411533277.db2.gz ZQVFUUNDGBBXDR-UHFFFAOYSA-N 1 1 248.395 3.917 20 0 BHADMO CC[C@H](CC(F)F)C[N@@H+](C(C)C)C1CCC1 ZINC000660080056 411534173 /nfs/dbraw/zinc/53/41/73/411534173.db2.gz VOWPFJALZSEDLE-LLVKDONJSA-N 1 1 233.346 3.931 20 0 BHADMO CC[C@@H](CC(F)F)C[N@@H+](C(C)C)C1CCC1 ZINC000660080057 411534947 /nfs/dbraw/zinc/53/49/47/411534947.db2.gz VOWPFJALZSEDLE-NSHDSACASA-N 1 1 233.346 3.931 20 0 BHADMO C[C@@H](c1ccco1)[N@@H+](C[C@@H]1C[C@H]2C[C@H]2C1)C1CC1 ZINC000660096948 411537417 /nfs/dbraw/zinc/53/74/17/411537417.db2.gz FUIHGPOVKYQEIE-FQUUOJAGSA-N 1 1 245.366 3.851 20 0 BHADMO C[C@H](c1ccco1)[N@@H+](C[C@@H]1C[C@H]2C[C@H]2C1)C1CC1 ZINC000660096951 411537281 /nfs/dbraw/zinc/53/72/81/411537281.db2.gz FUIHGPOVKYQEIE-YIYPIFLZSA-N 1 1 245.366 3.851 20 0 BHADMO C[C@H](c1ccco1)[N@@H+](CC1CC=CC1)C1CC1 ZINC000660097158 411230552 /nfs/dbraw/zinc/23/05/52/411230552.db2.gz JAHPCMSRZQODJJ-GFCCVEGCSA-N 1 1 231.339 3.771 20 0 BHADMO C[C@@H](c1ccco1)[N@@H+](CC1CC=CC1)C1CC1 ZINC000660097159 411230537 /nfs/dbraw/zinc/23/05/37/411230537.db2.gz JAHPCMSRZQODJJ-LBPRGKRZSA-N 1 1 231.339 3.771 20 0 BHADMO CC(C)=CCC[N@H+](C)Cc1nc2ccccc2o1 ZINC000660099738 411536937 /nfs/dbraw/zinc/53/69/37/411536937.db2.gz IHPUIVXWRKEUMR-UHFFFAOYSA-N 1 1 244.338 3.616 20 0 BHADMO C[N@@H+](CCC1CC1)Cc1nsc2ccccc21 ZINC000660118825 411238649 /nfs/dbraw/zinc/23/86/49/411238649.db2.gz XFQJXUNCXHYQMW-UHFFFAOYSA-N 1 1 246.379 3.528 20 0 BHADMO CSc1cccc(C[N@@H+]2CC=C(C)CC2)c1 ZINC000660127796 411542420 /nfs/dbraw/zinc/54/24/20/411542420.db2.gz PTGIDIFRTPIHBP-UHFFFAOYSA-N 1 1 233.380 3.561 20 0 BHADMO CC(C)=CCC[N@@H+]1CC=C(C(F)(F)F)CC1 ZINC000660129261 411542266 /nfs/dbraw/zinc/54/22/66/411542266.db2.gz FYGVKEIVXRTRJW-UHFFFAOYSA-N 1 1 233.277 3.537 20 0 BHADMO CCc1nocc1C[N@H+]1CCCC12CCCCC2 ZINC000660133368 411542737 /nfs/dbraw/zinc/54/27/37/411542737.db2.gz PMXIDJGBJGQXKU-UHFFFAOYSA-N 1 1 248.370 3.536 20 0 BHADMO Cc1nc(C[N@H+]2CCCC23CCCCC3)c(C)o1 ZINC000660134340 411542678 /nfs/dbraw/zinc/54/26/78/411542678.db2.gz YBLQWFGUZUNZDC-UHFFFAOYSA-N 1 1 248.370 3.590 20 0 BHADMO c1cc([C@@H]2CCC[N@@H+]2CCCC2CCC2)ccn1 ZINC000660135706 411542695 /nfs/dbraw/zinc/54/26/95/411542695.db2.gz DASSQKBMKWBCGV-INIZCTEOSA-N 1 1 244.382 3.799 20 0 BHADMO c1cc([C@H]2CCC[N@@H+]2CCCC2CCC2)ccn1 ZINC000660135707 411543299 /nfs/dbraw/zinc/54/32/99/411543299.db2.gz DASSQKBMKWBCGV-MRXNPFEDSA-N 1 1 244.382 3.799 20 0 BHADMO CC(C)=CCC[N@H+]1CCC[C@H]1c1cccnc1 ZINC000660136585 411543600 /nfs/dbraw/zinc/54/36/00/411543600.db2.gz DBOQTSDHLXGIFV-HNNXBMFYSA-N 1 1 230.355 3.575 20 0 BHADMO CC(C)=CCC[N@H+]1CCC[C@@H]1c1cccnc1 ZINC000660136586 411543411 /nfs/dbraw/zinc/54/34/11/411543411.db2.gz DBOQTSDHLXGIFV-OAHLLOKOSA-N 1 1 230.355 3.575 20 0 BHADMO c1cc(C[N@H+](CCCC2CCC2)C2CC2)ccn1 ZINC000660137563 411543692 /nfs/dbraw/zinc/54/36/92/411543692.db2.gz KUHNKTKYMXOFKF-UHFFFAOYSA-N 1 1 244.382 3.626 20 0 BHADMO CC(C)=CCC[N@H+]1CCC[C@H]1c1ccncc1 ZINC000660138216 411543987 /nfs/dbraw/zinc/54/39/87/411543987.db2.gz QHMMKJSECXRGOB-HNNXBMFYSA-N 1 1 230.355 3.575 20 0 BHADMO CC(C)=CCC[N@H+]1CCC[C@@H]1c1ccncc1 ZINC000660138217 411544217 /nfs/dbraw/zinc/54/42/17/411544217.db2.gz QHMMKJSECXRGOB-OAHLLOKOSA-N 1 1 230.355 3.575 20 0 BHADMO c1cncc(C[N@H+](CCCC2CCC2)C2CC2)c1 ZINC000660138494 411543708 /nfs/dbraw/zinc/54/37/08/411543708.db2.gz VNWQXAUWDYXAOF-UHFFFAOYSA-N 1 1 244.382 3.626 20 0 BHADMO c1cncc([C@@H]2CCC[N@@H+]2CCCC2CCC2)c1 ZINC000660138776 411254402 /nfs/dbraw/zinc/25/44/02/411254402.db2.gz ZRIGELVVZLDWGM-INIZCTEOSA-N 1 1 244.382 3.799 20 0 BHADMO c1cncc([C@H]2CCC[N@@H+]2CCCC2CCC2)c1 ZINC000660138778 411254598 /nfs/dbraw/zinc/25/45/98/411254598.db2.gz ZRIGELVVZLDWGM-MRXNPFEDSA-N 1 1 244.382 3.799 20 0 BHADMO C[C@H](c1ccncc1)[N@@H+](C)C[C@@H]1CC[C@H]2C[C@H]2C1 ZINC000660139561 411254484 /nfs/dbraw/zinc/25/44/84/411254484.db2.gz CLFWHTUSOAHIGN-LUYZLQTOSA-N 1 1 244.382 3.511 20 0 BHADMO C[C@H](c1ccncc1)[N@@H+](C)C[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC000660139564 487678966 /nfs/dbraw/zinc/67/89/66/487678966.db2.gz CLFWHTUSOAHIGN-XOUADPBQSA-N 1 1 244.382 3.511 20 0 BHADMO C[C@H](c1ccncc1)[N@@H+](C)CCCC1CCC1 ZINC000660140087 411255527 /nfs/dbraw/zinc/25/55/27/411255527.db2.gz JCQIQCIWTJELPW-CYBMUJFWSA-N 1 1 232.371 3.655 20 0 BHADMO C[C@@H](c1ccncc1)[N@@H+](C)CCCC1CCC1 ZINC000660140090 411255515 /nfs/dbraw/zinc/25/55/15/411255515.db2.gz JCQIQCIWTJELPW-ZDUSSCGKSA-N 1 1 232.371 3.655 20 0 BHADMO C[C@H](c1ccccn1)[N@@H+](C)C[C@@H]1CC[C@H]2C[C@H]2C1 ZINC000660140743 411543877 /nfs/dbraw/zinc/54/38/77/411543877.db2.gz PNCQKDFBAAJXGK-APIJFGDWSA-N 1 1 244.382 3.511 20 0 BHADMO C[C@H](c1ccccn1)[N@@H+](C)C[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC000660140747 411543918 /nfs/dbraw/zinc/54/39/18/411543918.db2.gz PNCQKDFBAAJXGK-TUVASFSCSA-N 1 1 244.382 3.511 20 0 BHADMO C[C@H](c1ccccn1)[N@@H+](C)CCCC1CCC1 ZINC000660141117 411543648 /nfs/dbraw/zinc/54/36/48/411543648.db2.gz UBDQBMHWNYSBDO-CYBMUJFWSA-N 1 1 232.371 3.655 20 0 BHADMO C[C@@H](c1ccccn1)[N@@H+](C)CCCC1CCC1 ZINC000660141118 411544263 /nfs/dbraw/zinc/54/42/63/411544263.db2.gz UBDQBMHWNYSBDO-ZDUSSCGKSA-N 1 1 232.371 3.655 20 0 BHADMO C[C@H](c1cccnc1)[N@@H+](C)CCCC1CCC1 ZINC000660141257 411544147 /nfs/dbraw/zinc/54/41/47/411544147.db2.gz UILYQUYRWIYTBC-CYBMUJFWSA-N 1 1 232.371 3.655 20 0 BHADMO C[C@@H](c1cccnc1)[N@@H+](C)CCCC1CCC1 ZINC000660141260 411543824 /nfs/dbraw/zinc/54/38/24/411543824.db2.gz UILYQUYRWIYTBC-ZDUSSCGKSA-N 1 1 232.371 3.655 20 0 BHADMO C[C@H](c1cccnc1)[N@@H+](C)C[C@@H]1CC[C@H]2C[C@H]2C1 ZINC000660141621 411256093 /nfs/dbraw/zinc/25/60/93/411256093.db2.gz WEWZJLVMMUGAIC-HGTKMLMNSA-N 1 1 244.382 3.511 20 0 BHADMO C[C@H](c1cccnc1)[N@@H+](C)C[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC000660141651 411256540 /nfs/dbraw/zinc/25/65/40/411256540.db2.gz WEWZJLVMMUGAIC-KQTLUZQSSA-N 1 1 244.382 3.511 20 0 BHADMO CC[C@H](c1ccncc1)[N@@H+](C)C[C@@H]1C[C@H]2C[C@H]2C1 ZINC000660146254 411545504 /nfs/dbraw/zinc/54/55/04/411545504.db2.gz DGBWWFJSMZDRCE-SLBVQIDZSA-N 1 1 244.382 3.511 20 0 BHADMO CC[C@@H](c1ccncc1)[N@@H+](C)C[C@@H]1C[C@H]2C[C@H]2C1 ZINC000660146255 411545628 /nfs/dbraw/zinc/54/56/28/411545628.db2.gz DGBWWFJSMZDRCE-UKMLZYKCSA-N 1 1 244.382 3.511 20 0 BHADMO CC[C@@H](c1ccncc1)[N@@H+](C)CCC1CCC1 ZINC000660146706 411262566 /nfs/dbraw/zinc/26/25/66/411262566.db2.gz KTNNYUCCNZLHAJ-HNNXBMFYSA-N 1 1 232.371 3.655 20 0 BHADMO CC[C@H](c1ccncc1)[N@@H+](C)CCC1CCC1 ZINC000660146707 411262271 /nfs/dbraw/zinc/26/22/71/411262271.db2.gz KTNNYUCCNZLHAJ-OAHLLOKOSA-N 1 1 232.371 3.655 20 0 BHADMO CC[C@@H](c1ccncc1)[N@@H+](C)CCC=C(C)C ZINC000660147321 411263055 /nfs/dbraw/zinc/26/30/55/411263055.db2.gz UKCINQGMZAIRES-HNNXBMFYSA-N 1 1 232.371 3.821 20 0 BHADMO CC[C@H](c1ccncc1)[N@@H+](C)CCC=C(C)C ZINC000660147330 411263107 /nfs/dbraw/zinc/26/31/07/411263107.db2.gz UKCINQGMZAIRES-OAHLLOKOSA-N 1 1 232.371 3.821 20 0 BHADMO CC(C)=CCC[N@H+]1CCC[C@H]1c1c(C)n[nH]c1C ZINC000660147689 411546614 /nfs/dbraw/zinc/54/66/14/411546614.db2.gz PGHNKBQUKGLWMI-AWEZNQCLSA-N 1 1 247.386 3.520 20 0 BHADMO CC(C)=CCC[N@H+]1CCC[C@@H]1c1c(C)n[nH]c1C ZINC000660147690 411546527 /nfs/dbraw/zinc/54/65/27/411546527.db2.gz PGHNKBQUKGLWMI-CQSZACIVSA-N 1 1 247.386 3.520 20 0 BHADMO c1ccc(C[N@H+](CCCC2CCC2)C2CC2)nc1 ZINC000660168448 411551501 /nfs/dbraw/zinc/55/15/01/411551501.db2.gz RDQFAZQKGNUDDB-UHFFFAOYSA-N 1 1 244.382 3.626 20 0 BHADMO CC[C@H]([NH2+]Cc1coc(C)n1)c1ccc(C)cc1 ZINC000660174180 411281142 /nfs/dbraw/zinc/28/11/42/411281142.db2.gz FWXJCCNHAGOZCQ-HNNXBMFYSA-N 1 1 244.338 3.532 20 0 BHADMO CC[C@@H]([NH2+]Cc1coc(C)n1)c1ccc(C)cc1 ZINC000660174184 411281134 /nfs/dbraw/zinc/28/11/34/411281134.db2.gz FWXJCCNHAGOZCQ-OAHLLOKOSA-N 1 1 244.338 3.532 20 0 BHADMO CCC[C@H]([NH2+]Cc1coc(C)n1)c1ccccc1 ZINC000660175995 411551986 /nfs/dbraw/zinc/55/19/86/411551986.db2.gz WXBMJDGZFKJILV-HNNXBMFYSA-N 1 1 244.338 3.614 20 0 BHADMO CCC[C@@H]([NH2+]Cc1coc(C)n1)c1ccccc1 ZINC000660175996 411551941 /nfs/dbraw/zinc/55/19/41/411551941.db2.gz WXBMJDGZFKJILV-OAHLLOKOSA-N 1 1 244.338 3.614 20 0 BHADMO CC[C@H]([NH2+]Cc1nc(C)oc1C)c1ccccc1 ZINC000660178883 411287373 /nfs/dbraw/zinc/28/73/73/411287373.db2.gz VHSYTMFPJQQUDV-AWEZNQCLSA-N 1 1 244.338 3.532 20 0 BHADMO CC[C@@H]([NH2+]Cc1nc(C)oc1C)c1ccccc1 ZINC000660178885 411287379 /nfs/dbraw/zinc/28/73/79/411287379.db2.gz VHSYTMFPJQQUDV-CQSZACIVSA-N 1 1 244.338 3.532 20 0 BHADMO C[C@H]1CC[C@@H](C(F)(F)F)C[N@H+]1CC1CC=CC1 ZINC000660234153 411557055 /nfs/dbraw/zinc/55/70/55/411557055.db2.gz JDMRVBFZTSCESX-CMPLNLGQSA-N 1 1 247.304 3.615 20 0 BHADMO C[C@H]1CC[C@H](C(F)(F)F)C[N@H+]1CC1CC=CC1 ZINC000660234154 411556978 /nfs/dbraw/zinc/55/69/78/411556978.db2.gz JDMRVBFZTSCESX-JQWIXIFHSA-N 1 1 247.304 3.615 20 0 BHADMO C[C@@H]1CC[C@H](C(F)(F)F)C[N@H+]1CC1CC=CC1 ZINC000660234155 411556995 /nfs/dbraw/zinc/55/69/95/411556995.db2.gz JDMRVBFZTSCESX-PWSUYJOCSA-N 1 1 247.304 3.615 20 0 BHADMO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@H+]1CC1CC=CC1 ZINC000660234156 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ZINC000660275075 411562988 /nfs/dbraw/zinc/56/29/88/411562988.db2.gz BLTDBRSPYZPUBE-ZDUSSCGKSA-N 1 1 248.370 3.707 20 0 BHADMO CC[C@H](CC(F)F)C[N@@H+](CC)CCC1CC1 ZINC000660276425 411564409 /nfs/dbraw/zinc/56/44/09/411564409.db2.gz CRSAMGVMDCAWOC-LLVKDONJSA-N 1 1 233.346 3.790 20 0 BHADMO CC[C@@H](CC(F)F)C[N@@H+](CC)CCC1CC1 ZINC000660276426 411564053 /nfs/dbraw/zinc/56/40/53/411564053.db2.gz CRSAMGVMDCAWOC-NSHDSACASA-N 1 1 233.346 3.790 20 0 BHADMO CC(C)=CCC[N@H+]1C[C@H](C)C[C@@H]1c1cccnc1 ZINC000660278945 411564627 /nfs/dbraw/zinc/56/46/27/411564627.db2.gz RHKCPPVHPXYAHS-GDBMZVCRSA-N 1 1 244.382 3.821 20 0 BHADMO CC(C)=CCC[N@H+]1C[C@@H](C)C[C@@H]1c1cccnc1 ZINC000660278946 411564735 /nfs/dbraw/zinc/56/47/35/411564735.db2.gz RHKCPPVHPXYAHS-GOEBONIOSA-N 1 1 244.382 3.821 20 0 BHADMO CC(C)=CCC[N@H+]1C[C@@H](C)C[C@H]1c1cccnc1 ZINC000660278947 411564663 /nfs/dbraw/zinc/56/46/63/411564663.db2.gz RHKCPPVHPXYAHS-HOCLYGCPSA-N 1 1 244.382 3.821 20 0 BHADMO CC(C)=CCC[N@H+]1C[C@H](C)C[C@H]1c1cccnc1 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CC[C@@H](CC(F)F)C[N@H+]1CCCC2(CC2)C1 ZINC000660308524 411567215 /nfs/dbraw/zinc/56/72/15/411567215.db2.gz YJMVNXNZJMQYCW-NSHDSACASA-N 1 1 231.330 3.544 20 0 BHADMO Cc1nc([C@H]2CCC[N@H+]2CC2CC=CC2)cs1 ZINC000660309074 411567497 /nfs/dbraw/zinc/56/74/97/411567497.db2.gz CJVPFVYICVJAPI-CQSZACIVSA-N 1 1 248.395 3.555 20 0 BHADMO C1=CCC(C[N@H+]2Cc3ccccc3C3(CC3)C2)C1 ZINC000660317234 411409547 /nfs/dbraw/zinc/40/95/47/411409547.db2.gz AHTUPGNGCBLHNW-UHFFFAOYSA-N 1 1 239.362 3.500 20 0 BHADMO CC[C@H](CC(F)F)C[N@H+]1CC[C@@H]2CCC[C@H]21 ZINC000660331714 411570280 /nfs/dbraw/zinc/57/02/80/411570280.db2.gz BVZSLSWVEKIPKU-GRYCIOLGSA-N 1 1 231.330 3.542 20 0 BHADMO CC[C@H](CC(F)F)C[N@H+]1CC[C@H]2CCC[C@H]21 ZINC000660331715 411569944 /nfs/dbraw/zinc/56/99/44/411569944.db2.gz BVZSLSWVEKIPKU-IJLUTSLNSA-N 1 1 231.330 3.542 20 0 BHADMO CC[C@H](CC(F)F)C[N@H+]1CC[C@H]2CCC[C@@H]21 ZINC000660331716 411569974 /nfs/dbraw/zinc/56/99/74/411569974.db2.gz BVZSLSWVEKIPKU-UTUOFQBUSA-N 1 1 231.330 3.542 20 0 BHADMO CC[C@H](CC(F)F)C[N@H+]1CC[C@@H]2CCC[C@@H]21 ZINC000660331717 411569922 /nfs/dbraw/zinc/56/99/22/411569922.db2.gz BVZSLSWVEKIPKU-WOPDTQHZSA-N 1 1 231.330 3.542 20 0 BHADMO C[C@@H]1CCCC[C@@H]1[N@@H+](C)Cc1cc(C2CC2)no1 ZINC000660365980 411572765 /nfs/dbraw/zinc/57/27/65/411572765.db2.gz ALESZOCGXPRFSF-ABAIWWIYSA-N 1 1 248.370 3.563 20 0 BHADMO C[C@@H]1CCCC[C@H]1[N@@H+](C)Cc1cc(C2CC2)no1 ZINC000660365981 411573033 /nfs/dbraw/zinc/57/30/33/411573033.db2.gz ALESZOCGXPRFSF-IAQYHMDHSA-N 1 1 248.370 3.563 20 0 BHADMO C[C@H]1CCCC[C@@H]1[N@@H+](C)Cc1cc(C2CC2)no1 ZINC000660365982 411573052 /nfs/dbraw/zinc/57/30/52/411573052.db2.gz ALESZOCGXPRFSF-NHYWBVRUSA-N 1 1 248.370 3.563 20 0 BHADMO C[C@H]1CCCC[C@H]1[N@@H+](C)Cc1cc(C2CC2)no1 ZINC000660365983 411573010 /nfs/dbraw/zinc/57/30/10/411573010.db2.gz ALESZOCGXPRFSF-XHDPSFHLSA-N 1 1 248.370 3.563 20 0 BHADMO CC[N@@H+](Cc1cncs1)[C@H]1CCCC[C@@H]1C ZINC000660367311 411572862 /nfs/dbraw/zinc/57/28/62/411572862.db2.gz GWMBXWIXJNQINY-AAEUAGOBSA-N 1 1 238.400 3.544 20 0 BHADMO CC[N@@H+](Cc1cncs1)[C@@H]1CCCC[C@H]1C ZINC000660367313 411572655 /nfs/dbraw/zinc/57/26/55/411572655.db2.gz GWMBXWIXJNQINY-DGCLKSJQSA-N 1 1 238.400 3.544 20 0 BHADMO CC[N@@H+](Cc1cncs1)[C@@H]1CCCC[C@@H]1C ZINC000660367315 411572650 /nfs/dbraw/zinc/57/26/50/411572650.db2.gz GWMBXWIXJNQINY-WCQYABFASA-N 1 1 238.400 3.544 20 0 BHADMO CC[N@@H+](Cc1cncs1)[C@H]1CCCC[C@H]1C ZINC000660367317 411572698 /nfs/dbraw/zinc/57/26/98/411572698.db2.gz GWMBXWIXJNQINY-YPMHNXCESA-N 1 1 238.400 3.544 20 0 BHADMO CC1(C)[C@H](C(F)(F)F)CC[N@H+]1CC1CC=CC1 ZINC000660388040 411577563 /nfs/dbraw/zinc/57/75/63/411577563.db2.gz IRBHDZOFBYYPLK-LLVKDONJSA-N 1 1 247.304 3.615 20 0 BHADMO CC1(C)[C@@H](C(F)(F)F)CC[N@H+]1CC1CC=CC1 ZINC000660388041 411577537 /nfs/dbraw/zinc/57/75/37/411577537.db2.gz IRBHDZOFBYYPLK-NSHDSACASA-N 1 1 247.304 3.615 20 0 BHADMO CC(C)=CCC[N@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000660420189 411582996 /nfs/dbraw/zinc/58/29/96/411582996.db2.gz HMSYTHOFDCEJAI-LLVKDONJSA-N 1 1 235.293 3.617 20 0 BHADMO CC(C)=CCC[N@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000660420190 411582823 /nfs/dbraw/zinc/58/28/23/411582823.db2.gz HMSYTHOFDCEJAI-NSHDSACASA-N 1 1 235.293 3.617 20 0 BHADMO FC(F)(F)C[C@H]1CC[N@@H+](CCCC2CCC2)C1 ZINC000660421583 411582919 /nfs/dbraw/zinc/58/29/19/411582919.db2.gz PNJGDRIUQZDYKT-GFCCVEGCSA-N 1 1 249.320 3.841 20 0 BHADMO FC(F)(F)C[C@@H]1CC[N@@H+](CCCC2CCC2)C1 ZINC000660421584 411582924 /nfs/dbraw/zinc/58/29/24/411582924.db2.gz PNJGDRIUQZDYKT-LBPRGKRZSA-N 1 1 249.320 3.841 20 0 BHADMO CC(C)[N@H+](Cc1cc(C2CC2)no1)CC1CCC1 ZINC000660422575 411582901 /nfs/dbraw/zinc/58/29/01/411582901.db2.gz GDAZENJCOBZQTQ-UHFFFAOYSA-N 1 1 248.370 3.563 20 0 BHADMO CC[C@H](CC(F)F)C[N@@H+](C)C1(C)CCCC1 ZINC000660435374 411584550 /nfs/dbraw/zinc/58/45/50/411584550.db2.gz OQHJROBPPKSFQU-LLVKDONJSA-N 1 1 233.346 3.932 20 0 BHADMO CC[C@@H](CC(F)F)C[N@@H+](C)C1(C)CCCC1 ZINC000660435375 411584231 /nfs/dbraw/zinc/58/42/31/411584231.db2.gz OQHJROBPPKSFQU-NSHDSACASA-N 1 1 233.346 3.932 20 0 BHADMO CC(C)=CCC[N@@H+]1CC[C@@H](C(F)(F)F)[C@H]1C ZINC000660446746 411586909 /nfs/dbraw/zinc/58/69/09/411586909.db2.gz NQDRNJDRXMUBLL-GHMZBOCLSA-N 1 1 235.293 3.615 20 0 BHADMO CC(C)=CCC[N@@H+]1CC[C@H](C(F)(F)F)[C@H]1C ZINC000660446747 411586350 /nfs/dbraw/zinc/58/63/50/411586350.db2.gz NQDRNJDRXMUBLL-MNOVXSKESA-N 1 1 235.293 3.615 20 0 BHADMO CC(C)=CCC[N@@H+]1CC[C@H](C(F)(F)F)[C@@H]1C ZINC000660446749 411586708 /nfs/dbraw/zinc/58/67/08/411586708.db2.gz NQDRNJDRXMUBLL-QWRGUYRKSA-N 1 1 235.293 3.615 20 0 BHADMO CC(C)=CCC[N@@H+]1CC[C@@H](C(F)(F)F)[C@@H]1C ZINC000660446750 411586722 /nfs/dbraw/zinc/58/67/22/411586722.db2.gz NQDRNJDRXMUBLL-WDEREUQCSA-N 1 1 235.293 3.615 20 0 BHADMO C[N@@H+](Cc1cc(C2CC2)no1)[C@@H]1CCC(C)(C)C1 ZINC000660453358 411587498 /nfs/dbraw/zinc/58/74/98/411587498.db2.gz PNCNNEAGDPHUCY-GFCCVEGCSA-N 1 1 248.370 3.563 20 0 BHADMO C[N@@H+](Cc1cc(C2CC2)no1)[C@H]1CCC(C)(C)C1 ZINC000660453359 411587567 /nfs/dbraw/zinc/58/75/67/411587567.db2.gz 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411627598 /nfs/dbraw/zinc/62/75/98/411627598.db2.gz MJCLFGUAZQFBQO-SNVBAGLBSA-N 1 1 233.346 3.788 20 0 BHADMO Clc1ccc2c(c1)C[N@H+](CC1CC=CC1)C2 ZINC000660781757 411629721 /nfs/dbraw/zinc/62/97/21/411629721.db2.gz WBSSJNIOBMRSHX-UHFFFAOYSA-N 1 1 233.742 3.622 20 0 BHADMO CC(C)=CCC[N@H+]1CCSC2(CCC2)CC1 ZINC000660796301 411635427 /nfs/dbraw/zinc/63/54/27/411635427.db2.gz HAHRHSBUXURIMT-UHFFFAOYSA-N 1 1 239.428 3.704 20 0 BHADMO C(C[N@H+]1CCSC2(CCC2)CC1)C1CCC1 ZINC000660798125 411635994 /nfs/dbraw/zinc/63/59/94/411635994.db2.gz XMARWGZGXGAYPP-UHFFFAOYSA-N 1 1 239.428 3.538 20 0 BHADMO CCC(CC)C[N@H+]1Cc2ccc(C(C)=O)cc2C1 ZINC000660801226 411637481 /nfs/dbraw/zinc/63/74/81/411637481.db2.gz OKKGETXEONZFKQ-UHFFFAOYSA-N 1 1 245.366 3.641 20 0 BHADMO CC(C)=CCC[N@H+]1Cc2ccc(C(C)=O)cc2C1 ZINC000660802041 411636925 /nfs/dbraw/zinc/63/69/25/411636925.db2.gz VQDXUOXYUBATCR-UHFFFAOYSA-N 1 1 243.350 3.561 20 0 BHADMO CC(C)=CCC[N@@H+]1Cc2ccc(C(C)=O)cc2C1 ZINC000660802041 411636921 /nfs/dbraw/zinc/63/69/21/411636921.db2.gz VQDXUOXYUBATCR-UHFFFAOYSA-N 1 1 243.350 3.561 20 0 BHADMO CC[N@@H+](Cc1cc(C2CC2)no1)C1CC(C)(C)C1 ZINC000660807191 411638840 /nfs/dbraw/zinc/63/88/40/411638840.db2.gz HUWUNKWLGFBNEY-UHFFFAOYSA-N 1 1 248.370 3.563 20 0 BHADMO CC[C@@H](CC(F)F)C[N@H+]1CC[C@H](C2CCC2)C1 ZINC000660813856 411644753 /nfs/dbraw/zinc/64/47/53/411644753.db2.gz MOSRGMCCKUCSMA-AAEUAGOBSA-N 1 1 245.357 3.790 20 0 BHADMO CC[C@H](CC(F)F)C[N@H+]1CC[C@@H](C2CCC2)C1 ZINC000660813857 411644390 /nfs/dbraw/zinc/64/43/90/411644390.db2.gz MOSRGMCCKUCSMA-DGCLKSJQSA-N 1 1 245.357 3.790 20 0 BHADMO CC[C@@H](CC(F)F)C[N@H+]1CC[C@@H](C2CCC2)C1 ZINC000660813858 411644880 /nfs/dbraw/zinc/64/48/80/411644880.db2.gz MOSRGMCCKUCSMA-WCQYABFASA-N 1 1 245.357 3.790 20 0 BHADMO CC[C@H](CC(F)F)C[N@H+]1CC[C@H](C2CCC2)C1 ZINC000660813859 411644787 /nfs/dbraw/zinc/64/47/87/411644787.db2.gz MOSRGMCCKUCSMA-YPMHNXCESA-N 1 1 245.357 3.790 20 0 BHADMO COCCCC[N@@H+](C)Cc1cccc(C(C)C)c1 ZINC000660826611 411646653 /nfs/dbraw/zinc/64/66/53/411646653.db2.gz PRWBTXWKOFVVLG-UHFFFAOYSA-N 1 1 249.398 3.668 20 0 BHADMO FC(F)(F)C[C@H]1CCC[N@@H+](CCC2CCC2)C1 ZINC000660829890 411649172 /nfs/dbraw/zinc/64/91/72/411649172.db2.gz BQGVOYLPOCTPTA-GFCCVEGCSA-N 1 1 249.320 3.841 20 0 BHADMO FC(F)(F)C[C@@H]1CCC[N@@H+](CCC2CCC2)C1 ZINC000660829891 411648313 /nfs/dbraw/zinc/64/83/13/411648313.db2.gz BQGVOYLPOCTPTA-LBPRGKRZSA-N 1 1 249.320 3.841 20 0 BHADMO FC(F)(F)C[C@H]1CCC[N@@H+](CC2CC=CC2)C1 ZINC000660833596 411651331 /nfs/dbraw/zinc/65/13/31/411651331.db2.gz PLZGTJLYPZTICT-GFCCVEGCSA-N 1 1 247.304 3.617 20 0 BHADMO FC(F)(F)C[C@@H]1CCC[N@@H+](CC2CC=CC2)C1 ZINC000660833597 411650149 /nfs/dbraw/zinc/65/01/49/411650149.db2.gz PLZGTJLYPZTICT-LBPRGKRZSA-N 1 1 247.304 3.617 20 0 BHADMO CC[C@H](CC(F)F)C[N@H+]1CC[C@@H]2CCCC[C@@H]21 ZINC000660897287 411664151 /nfs/dbraw/zinc/66/41/51/411664151.db2.gz FTHZAWBJPKYVEQ-AGIUHOORSA-N 1 1 245.357 3.932 20 0 BHADMO CC[C@@H](CC(F)F)C[N@H+]1CC[C@@H]2CCCC[C@@H]21 ZINC000660897288 411663299 /nfs/dbraw/zinc/66/32/99/411663299.db2.gz FTHZAWBJPKYVEQ-AVGNSLFASA-N 1 1 245.357 3.932 20 0 BHADMO COc1cccc(C[N@@H+](C)C(C)(C)C)c1Cl ZINC000660900991 411664792 /nfs/dbraw/zinc/66/47/92/411664792.db2.gz DGQAQIPNGCKEQZ-UHFFFAOYSA-N 1 1 241.762 3.579 20 0 BHADMO C[N@@H+](CCc1nsc2ccccc21)C(C)(C)C ZINC000660901204 409946408 /nfs/dbraw/zinc/94/64/08/409946408.db2.gz FJFGJAOIDRRWCT-UHFFFAOYSA-N 1 1 248.395 3.569 20 0 BHADMO C[N@@H+](Cc1nsc2ccccc21)C(C)(C)C ZINC000660901416 409949454 /nfs/dbraw/zinc/94/94/54/409949454.db2.gz HGYMKTSZUAUYCB-UHFFFAOYSA-N 1 1 234.368 3.527 20 0 BHADMO CSc1cccc(C[N@@H+](C)C(C)(C)C)c1 ZINC000660902436 411666264 /nfs/dbraw/zinc/66/62/64/411666264.db2.gz KNZNSZBZOZZRQL-UHFFFAOYSA-N 1 1 223.385 3.639 20 0 BHADMO CC[C@H](CC(F)F)C[N@H+]1CCC12CCCC2 ZINC000660909653 411668905 /nfs/dbraw/zinc/66/89/05/411668905.db2.gz NVUKVZNJHWJMCH-LLVKDONJSA-N 1 1 231.330 3.686 20 0 BHADMO CC[C@@H](CC(F)F)C[N@H+]1CCC12CCCC2 ZINC000660909655 411668239 /nfs/dbraw/zinc/66/82/39/411668239.db2.gz NVUKVZNJHWJMCH-NSHDSACASA-N 1 1 231.330 3.686 20 0 BHADMO CCC[N@@H+](C[C@H](CC)CC(F)F)C(C)C ZINC000660923498 411675458 /nfs/dbraw/zinc/67/54/58/411675458.db2.gz DQGNLPSDQSVVFP-LLVKDONJSA-N 1 1 221.335 3.788 20 0 BHADMO CCC[N@@H+](C[C@@H](CC)CC(F)F)C(C)C ZINC000660923499 411674510 /nfs/dbraw/zinc/67/45/10/411674510.db2.gz DQGNLPSDQSVVFP-NSHDSACASA-N 1 1 221.335 3.788 20 0 BHADMO CCC[N@@H+](Cc1nsc2ccccc21)C(C)C ZINC000660923964 411674220 /nfs/dbraw/zinc/67/42/20/411674220.db2.gz INSRFWIFGKKPLJ-UHFFFAOYSA-N 1 1 248.395 3.917 20 0 BHADMO Cc1nc(C[N@H+]2CCC[C@H]2CC2CCCC2)co1 ZINC000660927391 411677570 /nfs/dbraw/zinc/67/75/70/411677570.db2.gz ZBSBLISWPTZSNI-HNNXBMFYSA-N 1 1 248.370 3.528 20 0 BHADMO Cc1nc(C[N@H+]2CCC[C@@H]2CC2CCCC2)co1 ZINC000660927392 411676803 /nfs/dbraw/zinc/67/68/03/411676803.db2.gz ZBSBLISWPTZSNI-OAHLLOKOSA-N 1 1 248.370 3.528 20 0 BHADMO C[C@@H](c1ccccc1)[N@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000660927520 411677607 /nfs/dbraw/zinc/67/76/07/411677607.db2.gz CQUFIJOMSAONTH-QEJZJMRPSA-N 1 1 215.340 3.622 20 0 BHADMO C[C@H](c1ccccc1)[N@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000660927521 411677408 /nfs/dbraw/zinc/67/74/08/411677408.db2.gz CQUFIJOMSAONTH-SNPRPXQTSA-N 1 1 215.340 3.622 20 0 BHADMO C(=C/c1ccccc1)\C[N@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000660927703 409976586 /nfs/dbraw/zinc/97/65/86/409976586.db2.gz FQEGNEVONJKRKI-MYNUTGAYSA-N 1 1 227.351 3.574 20 0 BHADMO C(=C\c1ccccc1)\C[N@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000660927704 409975963 /nfs/dbraw/zinc/97/59/63/409975963.db2.gz FQEGNEVONJKRKI-OCLYVHKGSA-N 1 1 227.351 3.574 20 0 BHADMO C[C@@H](c1ccc(F)cc1)[N@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000660927713 411679756 /nfs/dbraw/zinc/67/97/56/411679756.db2.gz FVMASIIDXVFDER-WHOFXGATSA-N 1 1 233.330 3.761 20 0 BHADMO C[C@H](c1ccc(F)cc1)[N@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000660927714 411678987 /nfs/dbraw/zinc/67/89/87/411678987.db2.gz FVMASIIDXVFDER-ZLDLUXBVSA-N 1 1 233.330 3.761 20 0 BHADMO Clc1ccc(C[N@H+]2C[C@@H]3CCCC[C@@H]32)s1 ZINC000660927724 411678595 /nfs/dbraw/zinc/67/85/95/411678595.db2.gz GFGWCRUYNMKVQZ-ONGXEEELSA-N 1 1 241.787 3.776 20 0 BHADMO C[C@@H](c1ccccc1F)[N@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000660928194 409976137 /nfs/dbraw/zinc/97/61/37/409976137.db2.gz LEJSOCKLQJWFOT-HUBLWGQQSA-N 1 1 233.330 3.761 20 0 BHADMO C[C@H](c1ccccc1F)[N@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000660928196 409975733 /nfs/dbraw/zinc/97/57/33/409975733.db2.gz LEJSOCKLQJWFOT-XUJVJEKNSA-N 1 1 233.330 3.761 20 0 BHADMO COc1cccc([C@@H](C)[N@H+]2C[C@@H]3CCCC[C@@H]32)c1 ZINC000660930273 411681838 /nfs/dbraw/zinc/68/18/38/411681838.db2.gz MDZOFGLLTXZGQM-INWMFGNUSA-N 1 1 245.366 3.631 20 0 BHADMO COc1cccc([C@H](C)[N@H+]2C[C@@H]3CCCC[C@@H]32)c1 ZINC000660930274 411682507 /nfs/dbraw/zinc/68/25/07/411682507.db2.gz MDZOFGLLTXZGQM-NOLJZWGESA-N 1 1 245.366 3.631 20 0 BHADMO Fc1ccc2c(c1)[C@@H]([N@H+]1C[C@@H]3CCCC[C@@H]31)CC2 ZINC000660931182 411680747 /nfs/dbraw/zinc/68/07/47/411680747.db2.gz PEVMPYSKOKSNSK-RCBQFDQVSA-N 1 1 245.341 3.687 20 0 BHADMO Fc1ccc2c(c1)[C@H]([N@H+]1C[C@@H]3CCCC[C@@H]31)CC2 ZINC000660931188 411681478 /nfs/dbraw/zinc/68/14/78/411681478.db2.gz PEVMPYSKOKSNSK-VBNZEHGJSA-N 1 1 245.341 3.687 20 0 BHADMO c1ccc([C@@H]2C[C@H]2C[N@H+]2C[C@@H]3CCCC[C@@H]32)cc1 ZINC000660931441 411680969 /nfs/dbraw/zinc/68/09/69/411680969.db2.gz NBOPLCHJFBIMFH-QAETUUGQSA-N 1 1 241.378 3.665 20 0 BHADMO Clc1ccsc1C[N@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000660931820 411681574 /nfs/dbraw/zinc/68/15/74/411681574.db2.gz PWAKHVKGBKYZFZ-ONGXEEELSA-N 1 1 241.787 3.776 20 0 BHADMO c1ccc2c(c1)CC[C@@H]2[N@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000660931870 409978974 /nfs/dbraw/zinc/97/89/74/409978974.db2.gz RQIPLPWREMENCY-BPUTZDHNSA-N 1 1 227.351 3.548 20 0 BHADMO c1ccc2c(c1)CC[C@H]2[N@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000660931871 409978329 /nfs/dbraw/zinc/97/83/29/409978329.db2.gz RQIPLPWREMENCY-CWRNSKLLSA-N 1 1 227.351 3.548 20 0 BHADMO c1cc(CCC[N@H+]2C[C@@H]3CCCC[C@@H]32)cs1 ZINC000660931888 409979049 /nfs/dbraw/zinc/97/90/49/409979049.db2.gz RZSXWULLTUJPPQ-KBPBESRZSA-N 1 1 235.396 3.555 20 0 BHADMO C[C@@H](c1cccc(F)c1)[N@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000660931959 411681957 /nfs/dbraw/zinc/68/19/57/411681957.db2.gz WAGIBUAGXIKDKJ-WHOFXGATSA-N 1 1 233.330 3.761 20 0 BHADMO C[C@H](c1cccc(F)c1)[N@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000660931961 411681049 /nfs/dbraw/zinc/68/10/49/411681049.db2.gz WAGIBUAGXIKDKJ-ZLDLUXBVSA-N 1 1 233.330 3.761 20 0 BHADMO FC(F)(F)CCCC[N@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000660932684 411680999 /nfs/dbraw/zinc/68/09/99/411680999.db2.gz BTCKJZSWHOSKPI-QWRGUYRKSA-N 1 1 235.293 3.593 20 0 BHADMO CC[C@@H](CC(F)F)C[N@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000660934140 411683178 /nfs/dbraw/zinc/68/31/78/411683178.db2.gz LQNMLBYNNLPYET-SRVKXCTJSA-N 1 1 231.330 3.542 20 0 BHADMO CC[C@H](CC(F)F)C[N@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000660934141 411683956 /nfs/dbraw/zinc/68/39/56/411683956.db2.gz LQNMLBYNNLPYET-WOPDTQHZSA-N 1 1 231.330 3.542 20 0 BHADMO Clc1sccc1C[N@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000660934864 411683708 /nfs/dbraw/zinc/68/37/08/411683708.db2.gz WLXUBVMUICDXEG-ONGXEEELSA-N 1 1 241.787 3.776 20 0 BHADMO FC1(F)CCC(C[N@H+]2C[C@@H]3CCCC[C@@H]32)CC1 ZINC000660935059 411684032 /nfs/dbraw/zinc/68/40/32/411684032.db2.gz XUXPAMJJFYKGNQ-STQMWFEESA-N 1 1 243.341 3.686 20 0 BHADMO CC[C@@H](C)[N@@H+](CC)C[C@@H]1CCC(F)(F)C1 ZINC000661102767 410213336 /nfs/dbraw/zinc/21/33/36/410213336.db2.gz AAEIANUJIMZHJE-GHMZBOCLSA-N 1 1 219.319 3.542 20 0 BHADMO CC[C@@H](C)[N@@H+](CC)C[C@H]1CCC(F)(F)C1 ZINC000661102768 410213364 /nfs/dbraw/zinc/21/33/64/410213364.db2.gz AAEIANUJIMZHJE-MNOVXSKESA-N 1 1 219.319 3.542 20 0 BHADMO CC[C@H](C)[N@@H+](CC)C[C@H]1CCC(F)(F)C1 ZINC000661102769 410213182 /nfs/dbraw/zinc/21/31/82/410213182.db2.gz AAEIANUJIMZHJE-QWRGUYRKSA-N 1 1 219.319 3.542 20 0 BHADMO CC[C@H](C)[N@@H+](CC)C[C@@H]1CCC(F)(F)C1 ZINC000661102770 410213528 /nfs/dbraw/zinc/21/35/28/410213528.db2.gz AAEIANUJIMZHJE-WDEREUQCSA-N 1 1 219.319 3.542 20 0 BHADMO CC[C@@H](C)[N@@H+](CC)Cc1ccc2ncccc2c1 ZINC000661102841 411706450 /nfs/dbraw/zinc/70/64/50/411706450.db2.gz BBHQXDVEQGQYIM-CYBMUJFWSA-N 1 1 242.366 3.855 20 0 BHADMO CC[C@H](C)[N@@H+](CC)Cc1ccc2ncccc2c1 ZINC000661102843 411707596 /nfs/dbraw/zinc/70/75/96/411707596.db2.gz BBHQXDVEQGQYIM-ZDUSSCGKSA-N 1 1 242.366 3.855 20 0 BHADMO CC[C@@H](C)[N@@H+](CC)Cc1nsc2ccccc21 ZINC000661102918 411707581 /nfs/dbraw/zinc/70/75/81/411707581.db2.gz CIHXMYRNAZGTMI-LLVKDONJSA-N 1 1 248.395 3.917 20 0 BHADMO CC[C@H](C)[N@@H+](CC)Cc1nsc2ccccc21 ZINC000661102920 410216089 /nfs/dbraw/zinc/21/60/89/410216089.db2.gz CIHXMYRNAZGTMI-NSHDSACASA-N 1 1 248.395 3.917 20 0 BHADMO CC[C@H](CC(F)F)C[N@@H+](CC)[C@H](C)CC ZINC000661103104 411704458 /nfs/dbraw/zinc/70/44/58/411704458.db2.gz DTPFVNQKMRHACV-GHMZBOCLSA-N 1 1 221.335 3.788 20 0 BHADMO CC[C@@H](C)[N@H+](CC)C[C@@H](CC)CC(F)F ZINC000661103106 411704877 /nfs/dbraw/zinc/70/48/77/411704877.db2.gz DTPFVNQKMRHACV-MNOVXSKESA-N 1 1 221.335 3.788 20 0 BHADMO CC[C@@H](CC(F)F)C[N@@H+](CC)[C@@H](C)CC ZINC000661103108 411706153 /nfs/dbraw/zinc/70/61/53/411706153.db2.gz DTPFVNQKMRHACV-QWRGUYRKSA-N 1 1 221.335 3.788 20 0 BHADMO CC[C@H](CC(F)F)C[N@@H+](CC)[C@@H](C)CC ZINC000661103109 411704410 /nfs/dbraw/zinc/70/44/10/411704410.db2.gz DTPFVNQKMRHACV-WDEREUQCSA-N 1 1 221.335 3.788 20 0 BHADMO CC[C@@H](C)[N@@H+](CC)Cc1cccc(C(C)=O)c1 ZINC000661103191 410216279 /nfs/dbraw/zinc/21/62/79/410216279.db2.gz FHEDNYNIVQQKJP-GFCCVEGCSA-N 1 1 233.355 3.510 20 0 BHADMO CC[C@H](C)[N@@H+](CC)Cc1cccc(C(C)=O)c1 ZINC000661103208 410215535 /nfs/dbraw/zinc/21/55/35/410215535.db2.gz FHEDNYNIVQQKJP-LBPRGKRZSA-N 1 1 233.355 3.510 20 0 BHADMO CC[C@@H](C)[N@@H+](CC)Cc1cnc2ccccc2c1 ZINC000661103503 410222570 /nfs/dbraw/zinc/22/25/70/410222570.db2.gz GQGLTWXQQITSPI-CYBMUJFWSA-N 1 1 242.366 3.855 20 0 BHADMO CC[C@H](C)[N@@H+](CC)Cc1cnc2ccccc2c1 ZINC000661103505 410220474 /nfs/dbraw/zinc/22/04/74/410220474.db2.gz GQGLTWXQQITSPI-ZDUSSCGKSA-N 1 1 242.366 3.855 20 0 BHADMO CCCc1nc(C)c(C[N@@H+](CC)[C@H](C)CC)o1 ZINC000661103570 410220881 /nfs/dbraw/zinc/22/08/81/410220881.db2.gz HEDIHNXSAVQILD-LLVKDONJSA-N 1 1 238.375 3.556 20 0 BHADMO CCCc1nc(C)c(C[N@@H+](CC)[C@@H](C)CC)o1 ZINC000661103571 410220440 /nfs/dbraw/zinc/22/04/40/410220440.db2.gz HEDIHNXSAVQILD-NSHDSACASA-N 1 1 238.375 3.556 20 0 BHADMO CC[C@H](C)[N@@H+](CC)CCCCC1CCOCC1 ZINC000661103820 411708166 /nfs/dbraw/zinc/70/81/66/411708166.db2.gz HXWDLMYZRQNDSX-AWEZNQCLSA-N 1 1 241.419 3.704 20 0 BHADMO CC[C@@H](C)[N@@H+](CC)CCCCC1CCOCC1 ZINC000661103824 411708220 /nfs/dbraw/zinc/70/82/20/411708220.db2.gz HXWDLMYZRQNDSX-CQSZACIVSA-N 1 1 241.419 3.704 20 0 BHADMO CC[C@@H](C)[N@@H+](CC)Cc1nc2ccccc2s1 ZINC000661104003 410225030 /nfs/dbraw/zinc/22/50/30/410225030.db2.gz JFTQFEAJOQUMLJ-LLVKDONJSA-N 1 1 248.395 3.917 20 0 BHADMO CC[C@H](C)[N@@H+](CC)Cc1nc2ccccc2s1 ZINC000661104004 410224822 /nfs/dbraw/zinc/22/48/22/410224822.db2.gz JFTQFEAJOQUMLJ-NSHDSACASA-N 1 1 248.395 3.917 20 0 BHADMO CC[C@@H](C)[N@@H+](CC)Cc1cccc2cccnc21 ZINC000661104065 410223822 /nfs/dbraw/zinc/22/38/22/410223822.db2.gz JRXAXPJCIJFUDI-CYBMUJFWSA-N 1 1 242.366 3.855 20 0 BHADMO CC[C@H](C)[N@@H+](CC)Cc1cccc2cccnc21 ZINC000661104068 410225683 /nfs/dbraw/zinc/22/56/83/410225683.db2.gz JRXAXPJCIJFUDI-ZDUSSCGKSA-N 1 1 242.366 3.855 20 0 BHADMO CC[C@@H](C)[N@@H+](CC)Cc1cc(C(C)(C)C)on1 ZINC000661104259 410230713 /nfs/dbraw/zinc/23/07/13/410230713.db2.gz KFNQXCGUTQKUDH-LLVKDONJSA-N 1 1 238.375 3.593 20 0 BHADMO CC[C@H](C)[N@@H+](CC)Cc1cc(C(C)(C)C)on1 ZINC000661104260 410230511 /nfs/dbraw/zinc/23/05/11/410230511.db2.gz KFNQXCGUTQKUDH-NSHDSACASA-N 1 1 238.375 3.593 20 0 BHADMO CC[C@@H](C)[N@@H+](CC)Cc1ncc(C(C)(C)C)o1 ZINC000661105141 411708648 /nfs/dbraw/zinc/70/86/48/411708648.db2.gz FYVJPINHRDOKSQ-LLVKDONJSA-N 1 1 238.375 3.593 20 0 BHADMO CC[C@H](C)[N@@H+](CC)Cc1ncc(C(C)(C)C)o1 ZINC000661105143 411707288 /nfs/dbraw/zinc/70/72/88/411707288.db2.gz FYVJPINHRDOKSQ-NSHDSACASA-N 1 1 238.375 3.593 20 0 BHADMO CC[C@@H](C)[N@@H+](CC)CC1CCC(F)(F)CC1 ZINC000661105345 488016221 /nfs/dbraw/zinc/01/62/21/488016221.db2.gz VYLOSINFHFJILF-LLVKDONJSA-N 1 1 233.346 3.932 20 0 BHADMO CC[C@H](C)[N@@H+](CC)CC1CCC(F)(F)CC1 ZINC000661105346 488016246 /nfs/dbraw/zinc/01/62/46/488016246.db2.gz VYLOSINFHFJILF-NSHDSACASA-N 1 1 233.346 3.932 20 0 BHADMO CC[C@@H](C)[N@@H+](CC)CCCCOC(C)(C)C ZINC000661105418 410242728 /nfs/dbraw/zinc/24/27/28/410242728.db2.gz XDMDBBBFHJQVGO-CYBMUJFWSA-N 1 1 229.408 3.702 20 0 BHADMO CC[C@H](C)[N@@H+](CC)CCCCOC(C)(C)C ZINC000661105427 410243801 /nfs/dbraw/zinc/24/38/01/410243801.db2.gz XDMDBBBFHJQVGO-ZDUSSCGKSA-N 1 1 229.408 3.702 20 0 BHADMO CC[C@H](C)[N@@H+](CC)C[C@@H]1CCC2(CCCC2)O1 ZINC000661105436 410242841 /nfs/dbraw/zinc/24/28/41/410242841.db2.gz XEHGUHFHKPHLGT-KBPBESRZSA-N 1 1 239.403 3.599 20 0 BHADMO CC[C@@H](C)[N@@H+](CC)C[C@@H]1CCC2(CCCC2)O1 ZINC000661105437 410243164 /nfs/dbraw/zinc/24/31/64/410243164.db2.gz XEHGUHFHKPHLGT-KGLIPLIRSA-N 1 1 239.403 3.599 20 0 BHADMO CC[C@H](C)[N@@H+](CC)C[C@H]1CCC2(CCCC2)O1 ZINC000661105439 410242970 /nfs/dbraw/zinc/24/29/70/410242970.db2.gz XEHGUHFHKPHLGT-UONOGXRCSA-N 1 1 239.403 3.599 20 0 BHADMO CC[C@@H](C)[N@@H+](CC)C[C@H]1CCC2(CCCC2)O1 ZINC000661105443 410244023 /nfs/dbraw/zinc/24/40/23/410244023.db2.gz XEHGUHFHKPHLGT-ZIAGYGMSSA-N 1 1 239.403 3.599 20 0 BHADMO CC[C@@H](C)[N@@H+](CC)Cc1csc(C(C)C)n1 ZINC000661106238 411710124 /nfs/dbraw/zinc/71/01/24/411710124.db2.gz MMHMNRWFYWXCIK-LLVKDONJSA-N 1 1 240.416 3.887 20 0 BHADMO CC[C@H](C)[N@@H+](CC)Cc1csc(C(C)C)n1 ZINC000661106239 411711771 /nfs/dbraw/zinc/71/17/71/411711771.db2.gz MMHMNRWFYWXCIK-NSHDSACASA-N 1 1 240.416 3.887 20 0 BHADMO CCCc1nc(C[N@@H+](CC)[C@H](C)CC)cs1 ZINC000661106255 410250769 /nfs/dbraw/zinc/25/07/69/410250769.db2.gz MTIVKRZHZXUGPO-LLVKDONJSA-N 1 1 240.416 3.716 20 0 BHADMO CCCc1nc(C[N@@H+](CC)[C@@H](C)CC)cs1 ZINC000661106256 410250687 /nfs/dbraw/zinc/25/06/87/410250687.db2.gz MTIVKRZHZXUGPO-NSHDSACASA-N 1 1 240.416 3.716 20 0 BHADMO CC[C@H](C)[N@@H+](CC)CCCCC(F)(F)F ZINC000661106992 411710696 /nfs/dbraw/zinc/71/06/96/411710696.db2.gz KERCGCKFJPZBBK-JTQLQIEISA-N 1 1 225.298 3.839 20 0 BHADMO CC[C@@H](C)[N@@H+](CC)CCCCC(F)(F)F ZINC000661106994 411711834 /nfs/dbraw/zinc/71/18/34/411711834.db2.gz KERCGCKFJPZBBK-SNVBAGLBSA-N 1 1 225.298 3.839 20 0 BHADMO CC[C@H](C)[N@@H+](CC)Cc1csc(C2CC2)n1 ZINC000661107009 411711458 /nfs/dbraw/zinc/71/14/58/411711458.db2.gz KKPJFRFVTIJVGK-JTQLQIEISA-N 1 1 238.400 3.641 20 0 BHADMO CC[C@@H](C)[N@@H+](CC)Cc1csc(C2CC2)n1 ZINC000661107013 411711122 /nfs/dbraw/zinc/71/11/22/411711122.db2.gz KKPJFRFVTIJVGK-SNVBAGLBSA-N 1 1 238.400 3.641 20 0 BHADMO CC[C@@H](C)[N@@H+](CC)Cc1cc(-c2ccco2)on1 ZINC000661107577 411710508 /nfs/dbraw/zinc/71/05/08/411710508.db2.gz SBALLSVOIAPYRT-LLVKDONJSA-N 1 1 248.326 3.555 20 0 BHADMO CC[C@H](C)[N@@H+](CC)Cc1cc(-c2ccco2)on1 ZINC000661107578 411710221 /nfs/dbraw/zinc/71/02/21/411710221.db2.gz SBALLSVOIAPYRT-NSHDSACASA-N 1 1 248.326 3.555 20 0 BHADMO CC[C@@H](C)[N@@H+](CC)Cc1ccn(C2CCCC2)n1 ZINC000661108354 411712082 /nfs/dbraw/zinc/71/20/82/411712082.db2.gz SMEBUWQPTNIWJD-CYBMUJFWSA-N 1 1 249.402 3.619 20 0 BHADMO CC[C@H](C)[N@@H+](CC)Cc1ccn(C2CCCC2)n1 ZINC000661108355 411712182 /nfs/dbraw/zinc/71/21/82/411712182.db2.gz SMEBUWQPTNIWJD-ZDUSSCGKSA-N 1 1 249.402 3.619 20 0 BHADMO C[N@@H+](Cc1cccc2ncccc12)C1CCCC1 ZINC000661130080 411715304 /nfs/dbraw/zinc/71/53/04/411715304.db2.gz BUSCPONJXYISOK-UHFFFAOYSA-N 1 1 240.350 3.609 20 0 BHADMO CC[C@@H](C)C[N@@H+](C)Cc1cccc2ncccc12 ZINC000661130238 411715170 /nfs/dbraw/zinc/71/51/70/411715170.db2.gz CUWQYAFQCHDMTE-CYBMUJFWSA-N 1 1 242.366 3.713 20 0 BHADMO CC[C@H](C)C[N@@H+](C)Cc1cccc2ncccc12 ZINC000661130239 411715080 /nfs/dbraw/zinc/71/50/80/411715080.db2.gz CUWQYAFQCHDMTE-ZDUSSCGKSA-N 1 1 242.366 3.713 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)Cc1cccc2ncccc12 ZINC000661130359 411715061 /nfs/dbraw/zinc/71/50/61/411715061.db2.gz FVBGVBCQBDCVMP-CYBMUJFWSA-N 1 1 242.366 3.855 20 0 BHADMO CCC[C@H](C)[N@@H+](C)Cc1cccc2ncccc12 ZINC000661130360 411715133 /nfs/dbraw/zinc/71/51/33/411715133.db2.gz FVBGVBCQBDCVMP-ZDUSSCGKSA-N 1 1 242.366 3.855 20 0 BHADMO CC(C)[C@@H](C)[N@@H+](C)Cc1cccc2ncccc12 ZINC000661131702 411714970 /nfs/dbraw/zinc/71/49/70/411714970.db2.gz RXLBROXRMNYIPZ-CYBMUJFWSA-N 1 1 242.366 3.711 20 0 BHADMO CC(C)[C@H](C)[N@@H+](C)Cc1cccc2ncccc12 ZINC000661131703 411715684 /nfs/dbraw/zinc/71/56/84/411715684.db2.gz RXLBROXRMNYIPZ-ZDUSSCGKSA-N 1 1 242.366 3.711 20 0 BHADMO Cc1cccc(C)c1[C@@H]1CCC[N@H+]1CCCF ZINC000661133937 410292738 /nfs/dbraw/zinc/29/27/38/410292738.db2.gz WWQBPEACFOJVPC-AWEZNQCLSA-N 1 1 235.346 3.800 20 0 BHADMO Cc1cccc(C)c1[C@H]1CCC[N@H+]1CCCF ZINC000661133941 410293133 /nfs/dbraw/zinc/29/31/33/410293133.db2.gz WWQBPEACFOJVPC-CQSZACIVSA-N 1 1 235.346 3.800 20 0 BHADMO CC(C)(C)[N@H+](Cc1ccsc1)CC1CC1 ZINC000661136746 411717613 /nfs/dbraw/zinc/71/76/13/411717613.db2.gz UMAAJBWPURSZGO-UHFFFAOYSA-N 1 1 223.385 3.759 20 0 BHADMO CC(C)(C)[N@@H+](CCCF)Cc1ccsc1 ZINC000661136788 488069454 /nfs/dbraw/zinc/06/94/54/488069454.db2.gz VKFRQEROJULCKA-UHFFFAOYSA-N 1 1 229.364 3.708 20 0 BHADMO CC(C)CC[N@@H+](C)Cc1cccc2ncccc12 ZINC000661136814 411717622 /nfs/dbraw/zinc/71/76/22/411717622.db2.gz LHIVZARVVXBMHZ-UHFFFAOYSA-N 1 1 242.366 3.713 20 0 BHADMO CCC[N@@H+](Cc1ccsc1)C(C)(C)C ZINC000661137821 411716233 /nfs/dbraw/zinc/71/62/33/411716233.db2.gz VDNYJJUXIOZMMR-UHFFFAOYSA-N 1 1 211.374 3.759 20 0 BHADMO Cc1cc(C[N@H+]2CCCC3(CCCC3)CC2)on1 ZINC000661226606 411735748 /nfs/dbraw/zinc/73/57/48/411735748.db2.gz CSCVRCYLSLQFTK-UHFFFAOYSA-N 1 1 248.370 3.529 20 0 BHADMO Cc1cc(C[N@H+]2CCCC3(CCCC3)CC2)no1 ZINC000661227664 411735192 /nfs/dbraw/zinc/73/51/92/411735192.db2.gz KBURIZDUIOETCG-UHFFFAOYSA-N 1 1 248.370 3.529 20 0 BHADMO c1cncc(C[N@H+]2CCCC3(CCCC3)CC2)c1 ZINC000661227667 411735300 /nfs/dbraw/zinc/73/53/00/411735300.db2.gz KESAFEHCHZIVSE-UHFFFAOYSA-N 1 1 244.382 3.628 20 0 BHADMO c1ccc(C[N@H+]2CCCC3(CCCC3)CC2)nc1 ZINC000661228684 411735665 /nfs/dbraw/zinc/73/56/65/411735665.db2.gz SWRHZGFBIUQGBA-UHFFFAOYSA-N 1 1 244.382 3.628 20 0 BHADMO Cc1cnc(C[N@H+]2CCCC3(CCCC3)CC2)o1 ZINC000661229542 411735833 /nfs/dbraw/zinc/73/58/33/411735833.db2.gz IEMAHWZVGDTESK-UHFFFAOYSA-N 1 1 248.370 3.529 20 0 BHADMO c1cc(C[N@H+]2CCCC3(CCCC3)CC2)ccn1 ZINC000661229911 411735389 /nfs/dbraw/zinc/73/53/89/411735389.db2.gz PZWPCMGXCKGXPO-UHFFFAOYSA-N 1 1 244.382 3.628 20 0 BHADMO Cc1nc(C[N@H+]2CCCC3(CCCC3)CC2)co1 ZINC000661230939 411737360 /nfs/dbraw/zinc/73/73/60/411737360.db2.gz HPFYYYBUHFFSSC-UHFFFAOYSA-N 1 1 248.370 3.529 20 0 BHADMO Cc1nocc1C[N@H+]1CCCC2(CCCC2)CC1 ZINC000661231374 410380413 /nfs/dbraw/zinc/38/04/13/410380413.db2.gz MAHSMESTIKJDBB-UHFFFAOYSA-N 1 1 248.370 3.529 20 0 BHADMO CC[C@H](C)[N@H+]1CC2(CCCC2)[C@H]1c1ccco1 ZINC000661435055 411774411 /nfs/dbraw/zinc/77/44/11/411774411.db2.gz FPRSCSCHCVHYAI-GXTWGEPZSA-N 1 1 233.355 3.995 20 0 BHADMO CC[C@H](C)[N@H+]1CC2(CCCC2)[C@@H]1c1ccco1 ZINC000661435056 411773996 /nfs/dbraw/zinc/77/39/96/411773996.db2.gz FPRSCSCHCVHYAI-JSGCOSHPSA-N 1 1 233.355 3.995 20 0 BHADMO CC[C@@H](C)[N@H+]1CC2(CCCC2)[C@@H]1c1ccco1 ZINC000661435057 411775739 /nfs/dbraw/zinc/77/57/39/411775739.db2.gz FPRSCSCHCVHYAI-OCCSQVGLSA-N 1 1 233.355 3.995 20 0 BHADMO CC[C@@H](C)[N@H+]1CC2(CCCC2)[C@H]1c1ccco1 ZINC000661435058 411774910 /nfs/dbraw/zinc/77/49/10/411774910.db2.gz FPRSCSCHCVHYAI-TZMCWYRMSA-N 1 1 233.355 3.995 20 0 BHADMO c1coc([C@@H]2[N@@H+](CC3CCC3)CC23CCCC3)c1 ZINC000661436379 411775976 /nfs/dbraw/zinc/77/59/76/411775976.db2.gz SQIKPIKIXXSLRF-HNNXBMFYSA-N 1 1 245.366 3.997 20 0 BHADMO c1coc([C@H]2[N@@H+](CC3CCC3)CC23CCCC3)c1 ZINC000661436380 411775036 /nfs/dbraw/zinc/77/50/36/411775036.db2.gz SQIKPIKIXXSLRF-OAHLLOKOSA-N 1 1 245.366 3.997 20 0 BHADMO CC(C)[N@H+]1CC2(CCCC2)[C@H]1c1ccco1 ZINC000661440604 411779077 /nfs/dbraw/zinc/77/90/77/411779077.db2.gz RLUODMQEACJLRP-CYBMUJFWSA-N 1 1 219.328 3.605 20 0 BHADMO CC(C)[N@H+]1CC2(CCCC2)[C@@H]1c1ccco1 ZINC000661440605 411778832 /nfs/dbraw/zinc/77/88/32/411778832.db2.gz RLUODMQEACJLRP-ZDUSSCGKSA-N 1 1 219.328 3.605 20 0 BHADMO CC(C)C[N@H+]1CC2(CCCC2)[C@@H]1c1ccco1 ZINC000661445699 411777612 /nfs/dbraw/zinc/77/76/12/411777612.db2.gz KAQJTTXNZZLEMS-AWEZNQCLSA-N 1 1 233.355 3.853 20 0 BHADMO CC(C)C[N@H+]1CC2(CCCC2)[C@H]1c1ccco1 ZINC000661445701 411778469 /nfs/dbraw/zinc/77/84/69/411778469.db2.gz KAQJTTXNZZLEMS-CQSZACIVSA-N 1 1 233.355 3.853 20 0 BHADMO FCCC[N@H+]1CC2(CCCC2)[C@H]1c1ccco1 ZINC000661446227 411777845 /nfs/dbraw/zinc/77/78/45/411777845.db2.gz MOIZKBCBXDSPDT-CYBMUJFWSA-N 1 1 237.318 3.556 20 0 BHADMO FCCC[N@H+]1CC2(CCCC2)[C@@H]1c1ccco1 ZINC000661446228 411777682 /nfs/dbraw/zinc/77/76/82/411777682.db2.gz MOIZKBCBXDSPDT-ZDUSSCGKSA-N 1 1 237.318 3.556 20 0 BHADMO CCC[N@H+]1CC2(CCCC2)[C@H]1c1ccco1 ZINC000661446237 411777548 /nfs/dbraw/zinc/77/75/48/411777548.db2.gz MPZCWQVAJINEMW-CYBMUJFWSA-N 1 1 219.328 3.607 20 0 BHADMO CCC[N@H+]1CC2(CCCC2)[C@@H]1c1ccco1 ZINC000661446242 411777915 /nfs/dbraw/zinc/77/79/15/411777915.db2.gz MPZCWQVAJINEMW-ZDUSSCGKSA-N 1 1 219.328 3.607 20 0 BHADMO c1coc([C@@H]2[N@@H+](CC3CC3)CC23CCCC3)c1 ZINC000661446323 411779129 /nfs/dbraw/zinc/77/91/29/411779129.db2.gz MUGAVYUJSXYWNV-AWEZNQCLSA-N 1 1 231.339 3.607 20 0 BHADMO c1coc([C@H]2[N@@H+](CC3CC3)CC23CCCC3)c1 ZINC000661446325 411780295 /nfs/dbraw/zinc/78/02/95/411780295.db2.gz MUGAVYUJSXYWNV-CQSZACIVSA-N 1 1 231.339 3.607 20 0 BHADMO CC(C)=CCC[N@H+]1CC[C@H]1c1ccc(F)cc1 ZINC000661506750 411791220 /nfs/dbraw/zinc/79/12/20/411791220.db2.gz HJUYQDRGKAPJLM-HNNXBMFYSA-N 1 1 233.330 3.929 20 0 BHADMO CC(C)=CCC[N@H+]1CC[C@@H]1c1ccc(F)cc1 ZINC000661506752 411791177 /nfs/dbraw/zinc/79/11/77/411791177.db2.gz HJUYQDRGKAPJLM-OAHLLOKOSA-N 1 1 233.330 3.929 20 0 BHADMO Fc1ccc([C@@H]2CC[N@H+]2CC2CC=CC2)cc1 ZINC000661508668 411792307 /nfs/dbraw/zinc/79/23/07/411792307.db2.gz PUWVFQXGVGJBQC-HNNXBMFYSA-N 1 1 231.314 3.539 20 0 BHADMO Fc1ccc([C@H]2CC[N@H+]2CC2CC=CC2)cc1 ZINC000661508670 411792276 /nfs/dbraw/zinc/79/22/76/411792276.db2.gz PUWVFQXGVGJBQC-OAHLLOKOSA-N 1 1 231.314 3.539 20 0 BHADMO Fc1ccc([C@@H]2CC[N@H+]2CC2=CCCC2)cc1 ZINC000661510008 410718873 /nfs/dbraw/zinc/71/88/73/410718873.db2.gz SEWUXVWBHWNBLZ-HNNXBMFYSA-N 1 1 231.314 3.683 20 0 BHADMO Fc1ccc([C@H]2CC[N@H+]2CC2=CCCC2)cc1 ZINC000661510038 410718966 /nfs/dbraw/zinc/71/89/66/410718966.db2.gz SEWUXVWBHWNBLZ-OAHLLOKOSA-N 1 1 231.314 3.683 20 0 BHADMO Fc1ccc([C@@H]2CC[N@H+]2[C@@H]2C=CCCC2)cc1 ZINC000661510349 411791443 /nfs/dbraw/zinc/79/14/43/411791443.db2.gz GHXADTYWEVXKND-CABCVRRESA-N 1 1 231.314 3.681 20 0 BHADMO Fc1ccc([C@@H]2CC[N@H+]2[C@H]2C=CCCC2)cc1 ZINC000661510352 411791465 /nfs/dbraw/zinc/79/14/65/411791465.db2.gz GHXADTYWEVXKND-GJZGRUSLSA-N 1 1 231.314 3.681 20 0 BHADMO Fc1ccc([C@H]2CC[N@H+]2[C@@H]2C=CCCC2)cc1 ZINC000661510353 411792476 /nfs/dbraw/zinc/79/24/76/411792476.db2.gz GHXADTYWEVXKND-HUUCEWRRSA-N 1 1 231.314 3.681 20 0 BHADMO Fc1ccc([C@H]2CC[N@H+]2[C@H]2C=CCCC2)cc1 ZINC000661510354 411791929 /nfs/dbraw/zinc/79/19/29/411791929.db2.gz GHXADTYWEVXKND-LSDHHAIUSA-N 1 1 231.314 3.681 20 0 BHADMO CC(C)CC[N@H+]1CC[C@H]1c1ccc(F)cc1 ZINC000661511769 411793584 /nfs/dbraw/zinc/79/35/84/411793584.db2.gz MFZIIYGAMNHAGM-AWEZNQCLSA-N 1 1 221.319 3.619 20 0 BHADMO CC(C)CC[N@H+]1CC[C@@H]1c1ccc(F)cc1 ZINC000661511771 411794444 /nfs/dbraw/zinc/79/44/44/411794444.db2.gz MFZIIYGAMNHAGM-CQSZACIVSA-N 1 1 221.319 3.619 20 0 BHADMO CC[C@@H](C)C[N@H+]1CC[C@@H]1c1ccc(F)cc1 ZINC000661512653 411794836 /nfs/dbraw/zinc/79/48/36/411794836.db2.gz LONCKVYEVRFHTD-BXUZGUMPSA-N 1 1 221.319 3.619 20 0 BHADMO CC[C@H](C)C[N@H+]1CC[C@H]1c1ccc(F)cc1 ZINC000661512654 411794474 /nfs/dbraw/zinc/79/44/74/411794474.db2.gz LONCKVYEVRFHTD-FZMZJTMJSA-N 1 1 221.319 3.619 20 0 BHADMO CC[C@@H](C)C[N@H+]1CC[C@H]1c1ccc(F)cc1 ZINC000661512656 411793509 /nfs/dbraw/zinc/79/35/09/411793509.db2.gz LONCKVYEVRFHTD-RISCZKNCSA-N 1 1 221.319 3.619 20 0 BHADMO CC[C@H](C)C[N@H+]1CC[C@@H]1c1ccc(F)cc1 ZINC000661512658 411793616 /nfs/dbraw/zinc/79/36/16/411793616.db2.gz LONCKVYEVRFHTD-SMDDNHRTSA-N 1 1 221.319 3.619 20 0 BHADMO Fc1ccc([C@H]2CC[N@H+]2CCC(F)(F)F)cc1 ZINC000661514168 410720460 /nfs/dbraw/zinc/72/04/60/410720460.db2.gz QYJSQQQMDVQOET-LLVKDONJSA-N 1 1 247.235 3.525 20 0 BHADMO Fc1ccc([C@H]2CC[N@@H+]2CCC(F)(F)F)cc1 ZINC000661514168 410720454 /nfs/dbraw/zinc/72/04/54/410720454.db2.gz QYJSQQQMDVQOET-LLVKDONJSA-N 1 1 247.235 3.525 20 0 BHADMO Fc1ccc([C@@H]2CC[N@H+]2CCC(F)(F)F)cc1 ZINC000661514169 410720290 /nfs/dbraw/zinc/72/02/90/410720290.db2.gz QYJSQQQMDVQOET-NSHDSACASA-N 1 1 247.235 3.525 20 0 BHADMO Fc1ccc([C@@H]2CC[N@@H+]2CCC(F)(F)F)cc1 ZINC000661514169 410720284 /nfs/dbraw/zinc/72/02/84/410720284.db2.gz QYJSQQQMDVQOET-NSHDSACASA-N 1 1 247.235 3.525 20 0 BHADMO FCCCCC[N@H+]1CC[C@H]1c1ccc(F)cc1 ZINC000661514902 411793216 /nfs/dbraw/zinc/79/32/16/411793216.db2.gz UDBTZXRYFVVNOG-AWEZNQCLSA-N 1 1 239.309 3.712 20 0 BHADMO FCCCCC[N@H+]1CC[C@@H]1c1ccc(F)cc1 ZINC000661514903 411794810 /nfs/dbraw/zinc/79/48/10/411794810.db2.gz UDBTZXRYFVVNOG-CQSZACIVSA-N 1 1 239.309 3.712 20 0 BHADMO CC(C)=CC[N@H+]1CC[C@H]1c1ccc(F)cc1 ZINC000661515038 411793336 /nfs/dbraw/zinc/79/33/36/411793336.db2.gz UKNPIDSYOUOSFK-AWEZNQCLSA-N 1 1 219.303 3.539 20 0 BHADMO CC(C)=CC[N@H+]1CC[C@@H]1c1ccc(F)cc1 ZINC000661515039 411794362 /nfs/dbraw/zinc/79/43/62/411794362.db2.gz UKNPIDSYOUOSFK-CQSZACIVSA-N 1 1 219.303 3.539 20 0 BHADMO Fc1ccc([C@@H]2CC[N@H+]2Cc2ccccc2)cc1 ZINC000661515187 411794588 /nfs/dbraw/zinc/79/45/88/411794588.db2.gz ZUCACMTXQKOTEH-INIZCTEOSA-N 1 1 241.309 3.773 20 0 BHADMO Fc1ccc([C@H]2CC[N@H+]2Cc2ccccc2)cc1 ZINC000661515188 411794421 /nfs/dbraw/zinc/79/44/21/411794421.db2.gz ZUCACMTXQKOTEH-MRXNPFEDSA-N 1 1 241.309 3.773 20 0 BHADMO Fc1ccc([C@@H]2CC[N@H+]2C2CCCC2)cc1 ZINC000661515303 411793189 /nfs/dbraw/zinc/79/31/89/411793189.db2.gz WYNNBRFACCMNKD-AWEZNQCLSA-N 1 1 219.303 3.515 20 0 BHADMO Fc1ccc([C@H]2CC[N@H+]2C2CCCC2)cc1 ZINC000661515304 411794241 /nfs/dbraw/zinc/79/42/41/411794241.db2.gz WYNNBRFACCMNKD-CQSZACIVSA-N 1 1 219.303 3.515 20 0 BHADMO CCC1(CC)CCC[N@@H+](Cc2nccs2)C1 ZINC000661671564 411141359 /nfs/dbraw/zinc/14/13/59/411141359.db2.gz DQCDKLHUYCXIQE-UHFFFAOYSA-N 1 1 238.400 3.545 20 0 BHADMO CCC1(CC)CCC[N@@H+](CCc2ccncc2)C1 ZINC000661673292 411834741 /nfs/dbraw/zinc/83/47/41/411834741.db2.gz TVAHFDPFMASHDE-UHFFFAOYSA-N 1 1 246.398 3.526 20 0 BHADMO CCC1(CC)CCC[N@@H+](Cc2cncs2)C1 ZINC000661673670 411834191 /nfs/dbraw/zinc/83/41/91/411834191.db2.gz WWKBNRHUBIYSPV-UHFFFAOYSA-N 1 1 238.400 3.545 20 0 BHADMO CCC1(CC)CCC[N@@H+](CCc2ccccn2)C1 ZINC000661673865 411834322 /nfs/dbraw/zinc/83/43/22/411834322.db2.gz FSVSXJDBVRQTET-UHFFFAOYSA-N 1 1 246.398 3.526 20 0 BHADMO CCC1(CC)CCC[N@@H+](CCc2cccnc2)C1 ZINC000661673990 411834394 /nfs/dbraw/zinc/83/43/94/411834394.db2.gz XPPRTKJFSLZFLB-UHFFFAOYSA-N 1 1 246.398 3.526 20 0 BHADMO CCC1(CC)CCC[N@@H+](Cc2cscn2)C1 ZINC000661675699 411834182 /nfs/dbraw/zinc/83/41/82/411834182.db2.gz XRVJBWCZSCJTCZ-UHFFFAOYSA-N 1 1 238.400 3.545 20 0 BHADMO FCC[C@@H]1CCC[N@H+]([C@H]2CCc3ccccc32)C1 ZINC000661690406 491079693 /nfs/dbraw/zinc/07/96/93/491079693.db2.gz QHTVVYZRIYPLTM-BBRMVZONSA-N 1 1 247.357 3.746 20 0 BHADMO FCC[C@H]1CCC[N@H+]([C@H]2CCc3ccccc32)C1 ZINC000661690412 491079704 /nfs/dbraw/zinc/07/97/04/491079704.db2.gz QHTVVYZRIYPLTM-CJNGLKHVSA-N 1 1 247.357 3.746 20 0 BHADMO FCC[C@H]1CCC[N@H+]([C@@H]2CCc3ccccc32)C1 ZINC000661690417 491079702 /nfs/dbraw/zinc/07/97/02/491079702.db2.gz QHTVVYZRIYPLTM-CZUORRHYSA-N 1 1 247.357 3.746 20 0 BHADMO FCC[C@@H]1CCC[N@H+]([C@@H]2CCc3ccccc32)C1 ZINC000661690419 491079697 /nfs/dbraw/zinc/07/96/97/491079697.db2.gz QHTVVYZRIYPLTM-XJKSGUPXSA-N 1 1 247.357 3.746 20 0 BHADMO FCC[C@H]1CCC[N@H+]([C@@H]2C[C@@H]2c2ccccc2)C1 ZINC000661690590 411842183 /nfs/dbraw/zinc/84/21/83/411842183.db2.gz RZNGLRJCOXEOLH-FVQBIDKESA-N 1 1 247.357 3.614 20 0 BHADMO FCC[C@@H]1CCC[N@H+]([C@@H]2C[C@@H]2c2ccccc2)C1 ZINC000661690594 411842177 /nfs/dbraw/zinc/84/21/77/411842177.db2.gz RZNGLRJCOXEOLH-NUEKZKHPSA-N 1 1 247.357 3.614 20 0 BHADMO Cc1cc(C[N@H+]2CCC[C@H](CCF)C2)cs1 ZINC000661690996 411841440 /nfs/dbraw/zinc/84/14/40/411841440.db2.gz ZKOVPVCUJIHEMP-GFCCVEGCSA-N 1 1 241.375 3.628 20 0 BHADMO Cc1cc(C[N@H+]2CCC[C@@H](CCF)C2)cs1 ZINC000661690997 411840699 /nfs/dbraw/zinc/84/06/99/411840699.db2.gz ZKOVPVCUJIHEMP-LBPRGKRZSA-N 1 1 241.375 3.628 20 0 BHADMO C[C@@H](c1ccccc1)[N@H+]1CCC[C@@H](CCF)C1 ZINC000661693590 411842888 /nfs/dbraw/zinc/84/28/88/411842888.db2.gz PTXPBQTUBRQMFH-KBPBESRZSA-N 1 1 235.346 3.819 20 0 BHADMO C[C@H](c1ccccc1)[N@H+]1CCC[C@@H](CCF)C1 ZINC000661693591 411842966 /nfs/dbraw/zinc/84/29/66/411842966.db2.gz PTXPBQTUBRQMFH-KGLIPLIRSA-N 1 1 235.346 3.819 20 0 BHADMO C[C@@H](c1ccccc1)[N@H+]1CCC[C@H](CCF)C1 ZINC000661693592 411843394 /nfs/dbraw/zinc/84/33/94/411843394.db2.gz PTXPBQTUBRQMFH-UONOGXRCSA-N 1 1 235.346 3.819 20 0 BHADMO C[C@H](c1ccccc1)[N@H+]1CCC[C@H](CCF)C1 ZINC000661693593 411843872 /nfs/dbraw/zinc/84/38/72/411843872.db2.gz PTXPBQTUBRQMFH-ZIAGYGMSSA-N 1 1 235.346 3.819 20 0 BHADMO Cc1ccccc1C[N@H+]1CCC[C@@H](CCF)C1 ZINC000661693880 411843271 /nfs/dbraw/zinc/84/32/71/411843271.db2.gz AUPLQGIJQBOYBB-AWEZNQCLSA-N 1 1 235.346 3.567 20 0 BHADMO Cc1ccccc1C[N@H+]1CCC[C@H](CCF)C1 ZINC000661693881 411843862 /nfs/dbraw/zinc/84/38/62/411843862.db2.gz AUPLQGIJQBOYBB-CQSZACIVSA-N 1 1 235.346 3.567 20 0 BHADMO Cc1cccc(C[N@H+]2CCC[C@@H](CCF)C2)c1 ZINC000661695046 411843330 /nfs/dbraw/zinc/84/33/30/411843330.db2.gz CBDBEFHWAKMDSB-AWEZNQCLSA-N 1 1 235.346 3.567 20 0 BHADMO Cc1cccc(C[N@H+]2CCC[C@H](CCF)C2)c1 ZINC000661695047 411844164 /nfs/dbraw/zinc/84/41/64/411844164.db2.gz CBDBEFHWAKMDSB-CQSZACIVSA-N 1 1 235.346 3.567 20 0 BHADMO Cc1ccc(C[N@H+]2CCC[C@@H](CCF)C2)cc1 ZINC000661696537 411843107 /nfs/dbraw/zinc/84/31/07/411843107.db2.gz LHOXUWGQVYQZGX-AWEZNQCLSA-N 1 1 235.346 3.567 20 0 BHADMO Cc1ccc(C[N@H+]2CCC[C@H](CCF)C2)cc1 ZINC000661696538 411842932 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Cc1cccc([C@@H](C)[N@H+]2CC[C@@H](C)O[C@@H](C)C2)c1 ZINC000661859262 488064979 /nfs/dbraw/zinc/06/49/79/488064979.db2.gz SCPXYVDAAJSXMH-QLFBSQMISA-N 1 1 247.382 3.555 20 0 BHADMO CC[C@@H]1CC[C@@H](C)[N@@H+](Cc2cc(C3CC3)no2)C1 ZINC000661859834 411907024 /nfs/dbraw/zinc/90/70/24/411907024.db2.gz IDRNSXFPPAFUIZ-VXGBXAGGSA-N 1 1 248.370 3.563 20 0 BHADMO CC[C@@H]1CC[C@@H](C)[N@@H+](CCCc2ccncc2)C1 ZINC000661860648 411320400 /nfs/dbraw/zinc/32/04/00/411320400.db2.gz DQZREHHXLGJZLT-HUUCEWRRSA-N 1 1 246.398 3.525 20 0 BHADMO CC[C@@H]1CC[C@@H](C)[N@@H+](Cc2ncc(C3CC3)o2)C1 ZINC000661861343 411906848 /nfs/dbraw/zinc/90/68/48/411906848.db2.gz QFMGRLORBHMHFN-VXGBXAGGSA-N 1 1 248.370 3.563 20 0 BHADMO C[C@H](c1ccc(Cl)cc1)[N@H+]1CC[C@@H]2C[C@@H]2C1 ZINC000661966332 411923859 /nfs/dbraw/zinc/92/38/59/411923859.db2.gz GQVUZJAHNAQBOP-RAIGVLPGSA-N 1 1 235.758 3.743 20 0 BHADMO C[C@H](c1ccc(Cl)cc1)[N@H+]1CC[C@H]2C[C@H]2C1 ZINC000661966334 411923509 /nfs/dbraw/zinc/92/35/09/411923509.db2.gz 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ZINC000661976473 411342488 /nfs/dbraw/zinc/34/24/88/411342488.db2.gz SSSQCCKUTHFHMS-WXHSDQCUSA-N 1 1 235.758 3.743 20 0 BHADMO CC[C@H](c1ccc(F)cc1)[N@H+]1CC[C@H]2C[C@H]2C1 ZINC000661977813 411342855 /nfs/dbraw/zinc/34/28/55/411342855.db2.gz ZSMTVGMZAFDDAJ-KCQAQPDRSA-N 1 1 233.330 3.619 20 0 BHADMO CC[C@H](c1ccc(F)cc1)[N@H+]1CC[C@@H]2C[C@@H]2C1 ZINC000661977814 411342992 /nfs/dbraw/zinc/34/29/92/411342992.db2.gz ZSMTVGMZAFDDAJ-UMVBOHGHSA-N 1 1 233.330 3.619 20 0 BHADMO CCC(CC)CCC[N@@H+](C)Cc1cc(C)no1 ZINC000662034873 411953424 /nfs/dbraw/zinc/95/34/24/411953424.db2.gz AWJHAXCTYQEMSR-UHFFFAOYSA-N 1 1 238.375 3.631 20 0 BHADMO CCC(CC)CCC[N@@H+](C)Cc1conc1C ZINC000662034981 411953155 /nfs/dbraw/zinc/95/31/55/411953155.db2.gz CFNWVUUIUCMDAQ-UHFFFAOYSA-N 1 1 238.375 3.631 20 0 BHADMO CCC(CC)CCC[N@@H+](C)Cc1nccs1 ZINC000662035855 411952398 /nfs/dbraw/zinc/95/23/98/411952398.db2.gz FTLGRWZVHNDJKY-UHFFFAOYSA-N 1 1 240.416 3.791 20 0 BHADMO CCC(CC)CCC[N@H+](C)Cc1nccs1 ZINC000662035855 411952394 /nfs/dbraw/zinc/95/23/94/411952394.db2.gz FTLGRWZVHNDJKY-UHFFFAOYSA-N 1 1 240.416 3.791 20 0 BHADMO CCC(CC)CCC[N@@H+](C)Cc1coc(C)n1 ZINC000662037050 411953578 /nfs/dbraw/zinc/95/35/78/411953578.db2.gz KJGAMTODZOCSNL-UHFFFAOYSA-N 1 1 238.375 3.631 20 0 BHADMO CCC(CC)CCC[N@H+](C)Cc1coc(C)n1 ZINC000662037050 411953576 /nfs/dbraw/zinc/95/35/76/411953576.db2.gz KJGAMTODZOCSNL-UHFFFAOYSA-N 1 1 238.375 3.631 20 0 BHADMO CCC(CC)CCC[N@@H+](C)CC[C@H]1CCOC1 ZINC000662037508 411955378 /nfs/dbraw/zinc/95/53/78/411955378.db2.gz LVFVNBNWBDTIEL-HNNXBMFYSA-N 1 1 241.419 3.561 20 0 BHADMO CCC(CC)CCC[N@@H+](C)CC[C@@H]1CCOC1 ZINC000662037510 411954882 /nfs/dbraw/zinc/95/48/82/411954882.db2.gz LVFVNBNWBDTIEL-OAHLLOKOSA-N 1 1 241.419 3.561 20 0 BHADMO CCC(CC)CCC[N@@H+](C)C[C@@H]1CCCOC1 ZINC000662037611 411955862 /nfs/dbraw/zinc/95/58/62/411955862.db2.gz IPLHLQLDWIOPNP-HNNXBMFYSA-N 1 1 241.419 3.561 20 0 BHADMO CCC(CC)CCC[N@@H+](C)C[C@H]1CCCOC1 ZINC000662037616 411955339 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CC[C@@H](c1ccccc1)[N@@H+](CC[C@H](C)O)C(C)C ZINC000662104332 411987273 /nfs/dbraw/zinc/98/72/73/411987273.db2.gz BRIUFLKJRNDODH-HOCLYGCPSA-N 1 1 249.398 3.619 20 0 BHADMO CC[C@@H](c1ccccc1)[N@@H+](CC[C@@H](C)O)C(C)C ZINC000662104334 411988451 /nfs/dbraw/zinc/98/84/51/411988451.db2.gz BRIUFLKJRNDODH-ZBFHGGJFSA-N 1 1 249.398 3.619 20 0 BHADMO CC[C@@H](O)C[N@@H+](C(C)C)[C@@H](CC)c1ccccc1 ZINC000662109388 411988133 /nfs/dbraw/zinc/98/81/33/411988133.db2.gz VHGCEVSXFYJKTP-CVEARBPZSA-N 1 1 249.398 3.619 20 0 BHADMO CC[C@@H](O)C[N@@H+](C(C)C)[C@H](CC)c1ccccc1 ZINC000662109390 411988064 /nfs/dbraw/zinc/98/80/64/411988064.db2.gz VHGCEVSXFYJKTP-HZPDHXFCSA-N 1 1 249.398 3.619 20 0 BHADMO CC1C[C@H]2CC[C@@H](C1)[N@@H+]2CCCCC(F)(F)F ZINC000662130351 411996646 /nfs/dbraw/zinc/99/66/46/411996646.db2.gz SFPCUSMPPMTRGU-YOGCLGLASA-N 1 1 249.320 3.982 20 0 BHADMO CC1C[C@H]2CC[C@@H](C1)[N@@H+]2C[C@H]1CCC(F)(F)C1 ZINC000662130913 411996197 /nfs/dbraw/zinc/99/61/97/411996197.db2.gz 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DDBYTOTXWAIDRW-INIZCTEOSA-N 1 1 244.382 3.626 20 0 BHADMO c1cc(C[N@@H+]2CCCC[C@@H]2CC2CCC2)ccn1 ZINC000662155163 412011857 /nfs/dbraw/zinc/01/18/57/412011857.db2.gz DDBYTOTXWAIDRW-MRXNPFEDSA-N 1 1 244.382 3.626 20 0 BHADMO CCCCC[C@H]1CCCC[N@H+]1Cc1ccon1 ZINC000662156006 412010395 /nfs/dbraw/zinc/01/03/95/412010395.db2.gz OPFWDZHVNKZRMR-AWEZNQCLSA-N 1 1 236.359 3.609 20 0 BHADMO CCCCC[C@@H]1CCCC[N@H+]1Cc1ccon1 ZINC000662156009 412011458 /nfs/dbraw/zinc/01/14/58/412011458.db2.gz OPFWDZHVNKZRMR-CQSZACIVSA-N 1 1 236.359 3.609 20 0 BHADMO Cc1cc(C[N@H+]2CCCC[C@H]2CC2CCC2)on1 ZINC000662156070 412011623 /nfs/dbraw/zinc/01/16/23/412011623.db2.gz KIQBZJKIUOJOEA-AWEZNQCLSA-N 1 1 248.370 3.528 20 0 BHADMO Cc1cc(C[N@H+]2CCCC[C@@H]2CC2CCC2)on1 ZINC000662156072 412011231 /nfs/dbraw/zinc/01/12/31/412011231.db2.gz KIQBZJKIUOJOEA-CQSZACIVSA-N 1 1 248.370 3.528 20 0 BHADMO CC[C@@H]1CCC[C@H](C)[N@H+]1Cc1nc(C)cs1 ZINC000662156781 412010708 /nfs/dbraw/zinc/01/07/08/412010708.db2.gz DUZAQHWDJURDLN-NWDGAFQWSA-N 1 1 238.400 3.605 20 0 BHADMO Cc1nocc1C[N@H+]1CCCC[C@H]1CC1CCC1 ZINC000662156912 412011765 /nfs/dbraw/zinc/01/17/65/412011765.db2.gz NANFGEKJFREQSL-HNNXBMFYSA-N 1 1 248.370 3.528 20 0 BHADMO Cc1nocc1C[N@H+]1CCCC[C@@H]1CC1CCC1 ZINC000662156913 412011632 /nfs/dbraw/zinc/01/16/32/412011632.db2.gz NANFGEKJFREQSL-OAHLLOKOSA-N 1 1 248.370 3.528 20 0 BHADMO CC[C@@H]1CCC[C@H](C)[N@H+]1Cc1cnc(C)s1 ZINC000662156939 412011098 /nfs/dbraw/zinc/01/10/98/412011098.db2.gz FWSSGOZEPSVWPQ-CMPLNLGQSA-N 1 1 238.400 3.605 20 0 BHADMO CC[C@@H]1CCC[C@H](C)[N@H+]1Cc1csc(C)n1 ZINC000662157092 411368638 /nfs/dbraw/zinc/36/86/38/411368638.db2.gz IMVPGOHOOMPNHY-GXFFZTMASA-N 1 1 238.400 3.605 20 0 BHADMO CCCCC[C@H]1CCCC[N@H+]1CCC[C@@H](C)O ZINC000662157295 412010455 /nfs/dbraw/zinc/01/04/55/412010455.db2.gz VQSVGMQUYOXDBM-CABCVRRESA-N 1 1 241.419 3.582 20 0 BHADMO CCCCC[C@H]1CCCC[N@H+]1CCC[C@H](C)O ZINC000662157296 412011512 /nfs/dbraw/zinc/01/15/12/412011512.db2.gz VQSVGMQUYOXDBM-GJZGRUSLSA-N 1 1 241.419 3.582 20 0 BHADMO CCCCC[C@@H]1CCCC[N@H+]1CCC[C@@H](C)O ZINC000662157297 412010893 /nfs/dbraw/zinc/01/08/93/412010893.db2.gz VQSVGMQUYOXDBM-HUUCEWRRSA-N 1 1 241.419 3.582 20 0 BHADMO CCCCC[C@@H]1CCCC[N@H+]1CCC[C@H](C)O ZINC000662157298 412011147 /nfs/dbraw/zinc/01/11/47/412011147.db2.gz VQSVGMQUYOXDBM-LSDHHAIUSA-N 1 1 241.419 3.582 20 0 BHADMO Cc1nc(C[N@H+]2CCCC[C@H]2CC2CCC2)co1 ZINC000662157545 412010563 /nfs/dbraw/zinc/01/05/63/412010563.db2.gz PWXRJHIRSJWFLD-HNNXBMFYSA-N 1 1 248.370 3.528 20 0 BHADMO Cc1nc(C[N@H+]2CCCC[C@@H]2CC2CCC2)co1 ZINC000662157549 412010923 /nfs/dbraw/zinc/01/09/23/412010923.db2.gz PWXRJHIRSJWFLD-OAHLLOKOSA-N 1 1 248.370 3.528 20 0 BHADMO CCCCC[C@@H]1CCCC[N@H+]1Cc1ccno1 ZINC000662158024 412011903 /nfs/dbraw/zinc/01/19/03/412011903.db2.gz ZGWUUYSFHDYSKB-CYBMUJFWSA-N 1 1 236.359 3.609 20 0 BHADMO CCCCC[C@H]1CCCC[N@H+]1Cc1ccno1 ZINC000662158026 412011207 /nfs/dbraw/zinc/01/12/07/412011207.db2.gz ZGWUUYSFHDYSKB-ZDUSSCGKSA-N 1 1 236.359 3.609 20 0 BHADMO CCCCC[C@H]1CCCC[N@H+]1CCCCCO ZINC000662158028 412011138 /nfs/dbraw/zinc/01/11/38/412011138.db2.gz ZGZKDTGQIOJXOH-HNNXBMFYSA-N 1 1 241.419 3.584 20 0 BHADMO CCCCC[C@@H]1CCCC[N@H+]1CCCCCO ZINC000662158030 412011120 /nfs/dbraw/zinc/01/11/20/412011120.db2.gz ZGZKDTGQIOJXOH-OAHLLOKOSA-N 1 1 241.419 3.584 20 0 BHADMO CC[C@@H]1CCC[C@H](C)[N@H+]1Cc1cccc(C)n1 ZINC000662158128 412011046 /nfs/dbraw/zinc/01/10/46/412011046.db2.gz PVQFAWMIXSGRJK-DZGCQCFKSA-N 1 1 232.371 3.543 20 0 BHADMO c1ccc(C[N@@H+]2CCCC[C@H]2CC2CCC2)nc1 ZINC000662158438 412010902 /nfs/dbraw/zinc/01/09/02/412010902.db2.gz UBHLIUDEPOAIBZ-INIZCTEOSA-N 1 1 244.382 3.626 20 0 BHADMO c1ccc(C[N@@H+]2CCCC[C@@H]2CC2CCC2)nc1 ZINC000662158439 412011084 /nfs/dbraw/zinc/01/10/84/412011084.db2.gz UBHLIUDEPOAIBZ-MRXNPFEDSA-N 1 1 244.382 3.626 20 0 BHADMO CC[C@@H]1CCC[C@H](C)[N@H+]1Cc1ccn(C(C)C)n1 ZINC000662158535 412011786 /nfs/dbraw/zinc/01/17/86/412011786.db2.gz SVDYEVFAHMKXNJ-DZGCQCFKSA-N 1 1 249.402 3.617 20 0 BHADMO Cc1cnc(C[N@H+]2CCCC[C@H]2CC2CCC2)o1 ZINC000662158878 412012931 /nfs/dbraw/zinc/01/29/31/412012931.db2.gz YEDKXNUNBHAWSU-AWEZNQCLSA-N 1 1 248.370 3.528 20 0 BHADMO Cc1cnc(C[N@H+]2CCCC[C@@H]2CC2CCC2)o1 ZINC000662158880 412013241 /nfs/dbraw/zinc/01/32/41/412013241.db2.gz YEDKXNUNBHAWSU-CQSZACIVSA-N 1 1 248.370 3.528 20 0 BHADMO CC[C@@H]1CCC[C@H](C)[N@H+]1CCC(F)(F)F ZINC000662158987 412013525 /nfs/dbraw/zinc/01/35/25/412013525.db2.gz ZYCBAVIXWJNQLO-VHSXEESVSA-N 1 1 223.282 3.592 20 0 BHADMO CC[C@@H]1CCC[C@H](C)[N@H+]1Cc1cc(C)ccn1 ZINC000662159667 412012383 /nfs/dbraw/zinc/01/23/83/412012383.db2.gz BQSCPDZZSYELLT-DZGCQCFKSA-N 1 1 232.371 3.543 20 0 BHADMO CC[C@@H]1CCC[C@H](C)[N@H+]1Cc1cc(C2CC2)no1 ZINC000662159916 412013688 /nfs/dbraw/zinc/01/36/88/412013688.db2.gz DDXGWLDKSJYNOJ-WCQYABFASA-N 1 1 248.370 3.705 20 0 BHADMO CC[C@@H]1CCC[C@H](C)[N@H+]1Cc1scnc1C ZINC000662160263 412013851 /nfs/dbraw/zinc/01/38/51/412013851.db2.gz HSOOQALMTZFKBM-CMPLNLGQSA-N 1 1 238.400 3.605 20 0 BHADMO CC[C@@H]1CCC[C@H](C)[N@H+]1Cc1cnccc1C ZINC000662160274 412013220 /nfs/dbraw/zinc/01/32/20/412013220.db2.gz HYIAJEIMCCAXJX-DZGCQCFKSA-N 1 1 232.371 3.543 20 0 BHADMO CC[C@@H]1CCC[C@H](C)[N@H+]1CCc1cccc(C)n1 ZINC000662160314 412013022 /nfs/dbraw/zinc/01/30/22/412013022.db2.gz JLPHVUMBIKVEFH-GOEBONIOSA-N 1 1 246.398 3.586 20 0 BHADMO CC[C@@H]1CCC[C@H](C)[N@H+]1Cc1cncc(C)c1 ZINC000662160591 412012677 /nfs/dbraw/zinc/01/26/77/412012677.db2.gz LGKODUJGPNSGKC-DZGCQCFKSA-N 1 1 232.371 3.543 20 0 BHADMO CC[C@@H]1CCC[C@H](C)[N@H+]1Cc1cccnc1C ZINC000662160608 412013707 /nfs/dbraw/zinc/01/37/07/412013707.db2.gz LWOIPTZUMHNWIO-SWLSCSKDSA-N 1 1 232.371 3.543 20 0 BHADMO CC[C@@H]1CCC[C@H](C)[N@H+]1CC[C@H]1CCCCO1 ZINC000662160845 412013631 /nfs/dbraw/zinc/01/36/31/412013631.db2.gz NDQXKADCOFGNRR-RRFJBIMHSA-N 1 1 239.403 3.599 20 0 BHADMO CC[C@@H]1CCC[C@H](C)[N@H+]1CC[C@@H]1CCCCO1 ZINC000662160846 412012570 /nfs/dbraw/zinc/01/25/70/412012570.db2.gz NDQXKADCOFGNRR-ZNMIVQPWSA-N 1 1 239.403 3.599 20 0 BHADMO CC[C@@H]1CCC[C@H](C)[N@H+]1Cc1ncccc1C ZINC000662160894 411369357 /nfs/dbraw/zinc/36/93/57/411369357.db2.gz OOKIEAUQDCZBEH-UONOGXRCSA-N 1 1 232.371 3.543 20 0 BHADMO CC[C@@H]1CCC[C@H](C)[N@H+]1Cc1ccc(C)cn1 ZINC000662161016 412012512 /nfs/dbraw/zinc/01/25/12/412012512.db2.gz PYXYWSSWAVQHOS-DZGCQCFKSA-N 1 1 232.371 3.543 20 0 BHADMO CC[C@@H]1CCC[C@H](C)[N@H+]1CCCc1ccncc1 ZINC000662161020 412013163 /nfs/dbraw/zinc/01/31/63/412013163.db2.gz QFDCOQGSCWPCSJ-GOEBONIOSA-N 1 1 246.398 3.667 20 0 BHADMO CC[C@@H]1CCC[C@H](C)[N@H+]1CCc1ccncc1C ZINC000662161281 412013775 /nfs/dbraw/zinc/01/37/75/412013775.db2.gz QUGOXDYXKVSXOF-GOEBONIOSA-N 1 1 246.398 3.586 20 0 BHADMO CC[C@@H]1CCC[C@H](C)[N@H+]1Cc1ccc(C)nc1 ZINC000662161488 412013104 /nfs/dbraw/zinc/01/31/04/412013104.db2.gz TYDWAWSKZLNZOV-DZGCQCFKSA-N 1 1 232.371 3.543 20 0 BHADMO CC[C@@H]1CCC[C@H](C)[N@H+]1Cc1ncc(C2CC2)o1 ZINC000662161709 412012503 /nfs/dbraw/zinc/01/25/03/412012503.db2.gz XKZZKCFAFHNINN-WCQYABFASA-N 1 1 248.370 3.705 20 0 BHADMO FCCCCC[N@@H+](CCC1CC1)CC1CC1 ZINC000662177639 412018951 /nfs/dbraw/zinc/01/89/51/412018951.db2.gz JZSOJFTWTYFXSZ-UHFFFAOYSA-N 1 1 227.367 3.638 20 0 BHADMO C[C@H](c1ccccn1)[N@@H+](CCC1CC1)CC1CC1 ZINC000662177752 412020075 /nfs/dbraw/zinc/02/00/75/412020075.db2.gz NHCGLVFUNPMRCQ-CYBMUJFWSA-N 1 1 244.382 3.655 20 0 BHADMO C[C@@H](c1ccccn1)[N@@H+](CCC1CC1)CC1CC1 ZINC000662177753 412019021 /nfs/dbraw/zinc/01/90/21/412019021.db2.gz NHCGLVFUNPMRCQ-ZDUSSCGKSA-N 1 1 244.382 3.655 20 0 BHADMO Cc1cnc([C@@H](C)[N@@H+](CCC2CC2)CC2CC2)o1 ZINC000662177798 488143814 /nfs/dbraw/zinc/14/38/14/488143814.db2.gz OZELZSHTYAFLTE-GFCCVEGCSA-N 1 1 248.370 3.556 20 0 BHADMO Cc1cnc([C@H](C)[N@@H+](CCC2CC2)CC2CC2)o1 ZINC000662177799 488144141 /nfs/dbraw/zinc/14/41/41/488144141.db2.gz OZELZSHTYAFLTE-LBPRGKRZSA-N 1 1 248.370 3.556 20 0 BHADMO C[C@H](c1cccnc1)[N@@H+](CCC1CC1)CC1CC1 ZINC000662179516 412020873 /nfs/dbraw/zinc/02/08/73/412020873.db2.gz PRDXRWJXGJABMI-CYBMUJFWSA-N 1 1 244.382 3.655 20 0 BHADMO C[C@@H](c1cccnc1)[N@@H+](CCC1CC1)CC1CC1 ZINC000662179518 488143760 /nfs/dbraw/zinc/14/37/60/488143760.db2.gz PRDXRWJXGJABMI-ZDUSSCGKSA-N 1 1 244.382 3.655 20 0 BHADMO C[C@H](c1ccncc1)[N@@H+](CCC1CC1)CC1CC1 ZINC000662180070 412020742 /nfs/dbraw/zinc/02/07/42/412020742.db2.gz ZFAMAGSSVHXKDL-CYBMUJFWSA-N 1 1 244.382 3.655 20 0 BHADMO C[C@@H](c1ccncc1)[N@@H+](CCC1CC1)CC1CC1 ZINC000662180071 412021171 /nfs/dbraw/zinc/02/11/71/412021171.db2.gz ZFAMAGSSVHXKDL-ZDUSSCGKSA-N 1 1 244.382 3.655 20 0 BHADMO C[N@H+](CC1=CCSC1)CC1CCCCCC1 ZINC000662264409 412056949 /nfs/dbraw/zinc/05/69/49/412056949.db2.gz RKDUEUAMCDSWKP-UHFFFAOYSA-N 1 1 239.428 3.562 20 0 BHADMO C[N@@H+](CCC1CCCCC1)CC1=CCSC1 ZINC000662267495 412060901 /nfs/dbraw/zinc/06/09/01/412060901.db2.gz HDMNSCLZVVBEIE-UHFFFAOYSA-N 1 1 239.428 3.562 20 0 BHADMO C[N@@H+](CCCC1CCCC1)CC1=CCSC1 ZINC000662268722 412060872 /nfs/dbraw/zinc/06/08/72/412060872.db2.gz JAZVORHCMDHNSD-UHFFFAOYSA-N 1 1 239.428 3.562 20 0 BHADMO Cc1cccc([C@@H](C)[N@@H+](C)CC2=CCSC2)c1 ZINC000662268822 412061044 /nfs/dbraw/zinc/06/10/44/412061044.db2.gz MRKKXYRYXUBBCG-CYBMUJFWSA-N 1 1 247.407 3.661 20 0 BHADMO Cc1cccc([C@H](C)[N@@H+](C)CC2=CCSC2)c1 ZINC000662268823 412060481 /nfs/dbraw/zinc/06/04/81/412060481.db2.gz MRKKXYRYXUBBCG-ZDUSSCGKSA-N 1 1 247.407 3.661 20 0 BHADMO CC[C@@H](c1ccccc1)[N@@H+](C)CC1=CCSC1 ZINC000662269104 409571494 /nfs/dbraw/zinc/57/14/94/409571494.db2.gz XXOGCJLABMWELT-HNNXBMFYSA-N 1 1 247.407 3.743 20 0 BHADMO CC[C@H](c1ccccc1)[N@@H+](C)CC1=CCSC1 ZINC000662269105 409571597 /nfs/dbraw/zinc/57/15/97/409571597.db2.gz XXOGCJLABMWELT-OAHLLOKOSA-N 1 1 247.407 3.743 20 0 BHADMO Cc1ccccc1[C@@H](C)[N@@H+](C)CC1=CCSC1 ZINC000662269140 412060300 /nfs/dbraw/zinc/06/03/00/412060300.db2.gz ZKEVDUIKEDJQAX-CYBMUJFWSA-N 1 1 247.407 3.661 20 0 BHADMO Cc1ccccc1[C@H](C)[N@@H+](C)CC1=CCSC1 ZINC000662269141 412060570 /nfs/dbraw/zinc/06/05/70/412060570.db2.gz ZKEVDUIKEDJQAX-ZDUSSCGKSA-N 1 1 247.407 3.661 20 0 BHADMO C[C@@H]1c2ccccc2C[N@@H+]1CCCOC(C)(C)C ZINC000662289218 412080144 /nfs/dbraw/zinc/08/01/44/412080144.db2.gz REZGTUUUNSAWDJ-CYBMUJFWSA-N 1 1 247.382 3.768 20 0 BHADMO C[C@H](c1ccncc1)[N@H+]1Cc2ccccc2[C@H]1C ZINC000662289365 412079795 /nfs/dbraw/zinc/07/97/95/412079795.db2.gz VOCRVOUEBRAYFI-CHWSQXEVSA-N 1 1 238.334 3.719 20 0 BHADMO C[C@@H](c1ccncc1)[N@H+]1Cc2ccccc2[C@H]1C ZINC000662289366 412078966 /nfs/dbraw/zinc/07/89/66/412078966.db2.gz VOCRVOUEBRAYFI-QWHCGFSZSA-N 1 1 238.334 3.719 20 0 BHADMO C1=CCC(C[N@H+]2CC3CC2(c2ccccc2)C3)C1 ZINC000662329906 412104693 /nfs/dbraw/zinc/10/46/93/412104693.db2.gz RJNLCJBNMVRWGD-UHFFFAOYSA-N 1 1 239.362 3.574 20 0 BHADMO C1=C(C[N@H+]2CC3CC2(c2ccccc2)C3)CCC1 ZINC000662330961 412104555 /nfs/dbraw/zinc/10/45/55/412104555.db2.gz DGAROLRGUSCJHG-UHFFFAOYSA-N 1 1 239.362 3.718 20 0 BHADMO CC(C)=CC[N@H+]1CC2CC1(c1ccccc1)C2 ZINC000662331342 412104751 /nfs/dbraw/zinc/10/47/51/412104751.db2.gz GQTNLLUSCDYRKN-UHFFFAOYSA-N 1 1 227.351 3.574 20 0 BHADMO FCCCCC[N@H+]1CC2CC1(c1ccccc1)C2 ZINC000662331827 412105672 /nfs/dbraw/zinc/10/56/72/412105672.db2.gz KLVSWVBVPFSUEB-UHFFFAOYSA-N 1 1 247.357 3.747 20 0 BHADMO c1ccc(C23CC(C2)C[N@H+]3[C@@H]2C=CCCC2)cc1 ZINC000662333987 412106835 /nfs/dbraw/zinc/10/68/35/412106835.db2.gz HXJAWBJOGPCBJT-ARWYELJZSA-N 1 1 239.362 3.716 20 0 BHADMO c1ccc(C23CC(C2)C[N@H+]3[C@H]2C=CCCC2)cc1 ZINC000662333988 412106810 /nfs/dbraw/zinc/10/68/10/412106810.db2.gz HXJAWBJOGPCBJT-WIHSUSGWSA-N 1 1 239.362 3.716 20 0 BHADMO C[N@@H+](CCCCC(F)(F)F)C[C@@H]1CC1(C)C ZINC000662344644 409656583 /nfs/dbraw/zinc/65/65/83/409656583.db2.gz INJPPEXWFXPNDU-JTQLQIEISA-N 1 1 237.309 3.697 20 0 BHADMO C[N@@H+](CCCCC(F)(F)F)C[C@H]1CC1(C)C ZINC000662344645 409656080 /nfs/dbraw/zinc/65/60/80/409656080.db2.gz INJPPEXWFXPNDU-SNVBAGLBSA-N 1 1 237.309 3.697 20 0 BHADMO CC[C@H](CC(F)F)C[N@@H+](C)C[C@H]1CC1(C)C ZINC000662344781 409657515 /nfs/dbraw/zinc/65/75/15/409657515.db2.gz STXKYCKYCDSADL-GHMZBOCLSA-N 1 1 233.346 3.646 20 0 BHADMO CC[C@H](CC(F)F)C[N@@H+](C)C[C@@H]1CC1(C)C ZINC000662344782 409657392 /nfs/dbraw/zinc/65/73/92/409657392.db2.gz STXKYCKYCDSADL-MNOVXSKESA-N 1 1 233.346 3.646 20 0 BHADMO CC[C@@H](CC(F)F)C[N@@H+](C)C[C@@H]1CC1(C)C ZINC000662344784 409656979 /nfs/dbraw/zinc/65/69/79/409656979.db2.gz STXKYCKYCDSADL-QWRGUYRKSA-N 1 1 233.346 3.646 20 0 BHADMO CC[C@@H](CC(F)F)C[N@@H+](C)C[C@H]1CC1(C)C ZINC000662344786 409657131 /nfs/dbraw/zinc/65/71/31/409657131.db2.gz STXKYCKYCDSADL-WDEREUQCSA-N 1 1 233.346 3.646 20 0 BHADMO C[N@@H+](CCCCOC(C)(C)C)C[C@H]1CC1(C)C ZINC000662346001 412116715 /nfs/dbraw/zinc/11/67/15/412116715.db2.gz PUSLAIKHEUWJJP-CYBMUJFWSA-N 1 1 241.419 3.560 20 0 BHADMO C[N@@H+](CCCCOC(C)(C)C)C[C@@H]1CC1(C)C ZINC000662346002 412116970 /nfs/dbraw/zinc/11/69/70/412116970.db2.gz PUSLAIKHEUWJJP-ZDUSSCGKSA-N 1 1 241.419 3.560 20 0 BHADMO Cc1ccnc(C[N@H+]2CCC[C@@H]3CCCC[C@@H]32)c1 ZINC000662376321 412129771 /nfs/dbraw/zinc/12/97/71/412129771.db2.gz IYEBMHVAWZLXJF-HOCLYGCPSA-N 1 1 244.382 3.545 20 0 BHADMO C[C@H](c1ccccc1Cl)[N@H+]1CC2CC1(C)C2 ZINC000662381052 412134152 /nfs/dbraw/zinc/13/41/52/412134152.db2.gz NNNAGCKMYXZEOL-CDWSIMAYSA-N 1 1 235.758 3.885 20 0 BHADMO C[C@@H](c1ccccc1Cl)[N@H+]1CC2CC1(C)C2 ZINC000662381053 412133987 /nfs/dbraw/zinc/13/39/87/412133987.db2.gz NNNAGCKMYXZEOL-IFQILLTASA-N 1 1 235.758 3.885 20 0 BHADMO CC[C@@H](c1ccccc1)[N@H+]1CC2CC1(C)C2 ZINC000662381803 412133487 /nfs/dbraw/zinc/13/34/87/412133487.db2.gz FQPPGIFUKCIJCU-BLZCZZARSA-N 1 1 215.340 3.622 20 0 BHADMO CC[C@H](c1ccccc1)[N@H+]1CC2CC1(C)C2 ZINC000662381804 412134365 /nfs/dbraw/zinc/13/43/65/412134365.db2.gz FQPPGIFUKCIJCU-HNFVBEJKSA-N 1 1 215.340 3.622 20 0 BHADMO C[C@H](c1cccc(Cl)c1)[N@H+]1CC2CC1(C)C2 ZINC000662381832 412133573 /nfs/dbraw/zinc/13/35/73/412133573.db2.gz GTOMWPOMYFHTNJ-CDWSIMAYSA-N 1 1 235.758 3.885 20 0 BHADMO C[C@@H](c1cccc(Cl)c1)[N@H+]1CC2CC1(C)C2 ZINC000662381833 412133094 /nfs/dbraw/zinc/13/30/94/412133094.db2.gz GTOMWPOMYFHTNJ-IFQILLTASA-N 1 1 235.758 3.885 20 0 BHADMO C[C@@H](c1ccc(F)cc1F)[N@H+]1CC2CC1(C)C2 ZINC000662382143 412134774 /nfs/dbraw/zinc/13/47/74/412134774.db2.gz NXVVSBSJLNPJRR-IPWFMCSPSA-N 1 1 237.293 3.510 20 0 BHADMO C[C@H](c1ccc(F)cc1F)[N@H+]1CC2CC1(C)C2 ZINC000662382144 412133404 /nfs/dbraw/zinc/13/34/04/412133404.db2.gz NXVVSBSJLNPJRR-NAUIOFCNSA-N 1 1 237.293 3.510 20 0 BHADMO C[C@@H](c1c(F)cccc1F)[N@H+]1CC2CC1(C)C2 ZINC000662382274 412133519 /nfs/dbraw/zinc/13/35/19/412133519.db2.gz PCYZDLYDXUQOMT-IPWFMCSPSA-N 1 1 237.293 3.510 20 0 BHADMO C[C@H](c1c(F)cccc1F)[N@H+]1CC2CC1(C)C2 ZINC000662382275 412133239 /nfs/dbraw/zinc/13/32/39/412133239.db2.gz PCYZDLYDXUQOMT-NAUIOFCNSA-N 1 1 237.293 3.510 20 0 BHADMO C[C@@H](c1cc(F)ccc1F)[N@H+]1CC2CC1(C)C2 ZINC000662382279 412134393 /nfs/dbraw/zinc/13/43/93/412134393.db2.gz PIZRKBHLRIRGFR-IPWFMCSPSA-N 1 1 237.293 3.510 20 0 BHADMO C[C@H](c1cc(F)ccc1F)[N@H+]1CC2CC1(C)C2 ZINC000662382280 412133974 /nfs/dbraw/zinc/13/39/74/412133974.db2.gz PIZRKBHLRIRGFR-NAUIOFCNSA-N 1 1 237.293 3.510 20 0 BHADMO C[C@H](c1ccc(Cl)cc1)[N@H+]1CC2CC1(C)C2 ZINC000662382334 412133666 /nfs/dbraw/zinc/13/36/66/412133666.db2.gz SELSPJRTGUCLHZ-CDWSIMAYSA-N 1 1 235.758 3.885 20 0 BHADMO C[C@@H](c1ccc(Cl)cc1)[N@H+]1CC2CC1(C)C2 ZINC000662382335 412133701 /nfs/dbraw/zinc/13/37/01/412133701.db2.gz SELSPJRTGUCLHZ-IFQILLTASA-N 1 1 235.758 3.885 20 0 BHADMO Cc1ccccc1[C@@H](C)[N@H+]1CC2CC1(C)C2 ZINC000662382456 412134209 /nfs/dbraw/zinc/13/42/09/412134209.db2.gz MGJFYVATSJNOBM-DNOWBOINSA-N 1 1 215.340 3.540 20 0 BHADMO Cc1ccccc1[C@H](C)[N@H+]1CC2CC1(C)C2 ZINC000662382457 412134543 /nfs/dbraw/zinc/13/45/43/412134543.db2.gz MGJFYVATSJNOBM-OPFPJEHXSA-N 1 1 215.340 3.540 20 0 BHADMO C[C@@H](c1ccc(F)c(F)c1)[N@H+]1CC2CC1(C)C2 ZINC000662382505 412134705 /nfs/dbraw/zinc/13/47/05/412134705.db2.gz WMZSGZZLIIWIIM-IPWFMCSPSA-N 1 1 237.293 3.510 20 0 BHADMO C[C@H](c1ccc(F)c(F)c1)[N@H+]1CC2CC1(C)C2 ZINC000662382506 412133221 /nfs/dbraw/zinc/13/32/21/412133221.db2.gz WMZSGZZLIIWIIM-NAUIOFCNSA-N 1 1 237.293 3.510 20 0 BHADMO CC[C@@H](c1ccc(F)cc1)[N@H+]1CC2CC1(C)C2 ZINC000662382630 409687798 /nfs/dbraw/zinc/68/77/98/409687798.db2.gz AAZXFVXWXJSZJD-WPBUFGDCSA-N 1 1 233.330 3.761 20 0 BHADMO CC[C@H](c1ccc(F)cc1)[N@H+]1CC2CC1(C)C2 ZINC000662382631 409686820 /nfs/dbraw/zinc/68/68/20/409686820.db2.gz AAZXFVXWXJSZJD-XGTXGMFGSA-N 1 1 233.330 3.761 20 0 BHADMO Cc1cccc([C@@H](C)[N@H+]2CC3CC2(C)C3)c1 ZINC000662383256 412136820 /nfs/dbraw/zinc/13/68/20/412136820.db2.gz JVAFVHYPLYCQNO-DNOWBOINSA-N 1 1 215.340 3.540 20 0 BHADMO Cc1cccc([C@H](C)[N@H+]2CC3CC2(C)C3)c1 ZINC000662383257 412136606 /nfs/dbraw/zinc/13/66/06/412136606.db2.gz JVAFVHYPLYCQNO-OPFPJEHXSA-N 1 1 215.340 3.540 20 0 BHADMO CC12CC(C1)C[N@H+]2[C@@H]1CCCc2ccccc21 ZINC000662383678 412135229 /nfs/dbraw/zinc/13/52/29/412135229.db2.gz PDICMPOBYVEBNU-DSSZZKGTSA-N 1 1 227.351 3.548 20 0 BHADMO CC12CC(C1)C[N@H+]2[C@H]1CCCc2ccccc21 ZINC000662383679 412136128 /nfs/dbraw/zinc/13/61/28/412136128.db2.gz PDICMPOBYVEBNU-NRAUKZCXSA-N 1 1 227.351 3.548 20 0 BHADMO C[C@@H](c1ncc(C(C)(C)C)o1)[N@H+]1CC2CC1(C)C2 ZINC000662384282 412136189 /nfs/dbraw/zinc/13/61/89/412136189.db2.gz WUTCMOLRQVKROY-NLTNOIMHSA-N 1 1 248.370 3.517 20 0 BHADMO C[C@@H](c1ncc(C(C)(C)C)o1)[N@@H+]1CC2CC1(C)C2 ZINC000662384282 412136185 /nfs/dbraw/zinc/13/61/85/412136185.db2.gz WUTCMOLRQVKROY-NLTNOIMHSA-N 1 1 248.370 3.517 20 0 BHADMO C[C@H](c1ncc(C(C)(C)C)o1)[N@H+]1CC2CC1(C)C2 ZINC000662384283 412136631 /nfs/dbraw/zinc/13/66/31/412136631.db2.gz WUTCMOLRQVKROY-RWWNRMGGSA-N 1 1 248.370 3.517 20 0 BHADMO C[C@H](c1ncc(C(C)(C)C)o1)[N@@H+]1CC2CC1(C)C2 ZINC000662384283 412136630 /nfs/dbraw/zinc/13/66/30/412136630.db2.gz WUTCMOLRQVKROY-RWWNRMGGSA-N 1 1 248.370 3.517 20 0 BHADMO CC12CC(C1)C[N@H+]2[C@@H]1CCc2c1cccc2Cl ZINC000662384892 412135671 /nfs/dbraw/zinc/13/56/71/412135671.db2.gz ALDSEBGERMYEOL-CIQACWJJSA-N 1 1 247.769 3.812 20 0 BHADMO CC12CC(C1)C[N@H+]2[C@H]1CCc2c1cccc2Cl ZINC000662384893 412136472 /nfs/dbraw/zinc/13/64/72/412136472.db2.gz ALDSEBGERMYEOL-CUMGRINNSA-N 1 1 247.769 3.812 20 0 BHADMO CC12CC(C1)C[N@H+]2Cc1cccc(C(F)F)c1 ZINC000662385015 409685893 /nfs/dbraw/zinc/68/58/93/409685893.db2.gz FTLJQADJYAMJOG-UHFFFAOYSA-N 1 1 237.293 3.609 20 0 BHADMO CC12CC(C1)C[N@H+]2[C@H]1CCCc2ccc(F)cc21 ZINC000662385157 409687196 /nfs/dbraw/zinc/68/71/96/409687196.db2.gz LRJQRKNGGAJUKV-AJQRCPHMSA-N 1 1 245.341 3.687 20 0 BHADMO CC12CC(C1)C[N@H+]2[C@@H]1CCCc2ccc(F)cc21 ZINC000662385158 409687776 /nfs/dbraw/zinc/68/77/76/409687776.db2.gz LRJQRKNGGAJUKV-YWCUFVOSSA-N 1 1 245.341 3.687 20 0 BHADMO CC12CC(C1)C[N@H+]2Cc1ccc(C(F)F)cc1 ZINC000662385224 409689893 /nfs/dbraw/zinc/68/98/93/409689893.db2.gz OBNOFZVRAMVICH-UHFFFAOYSA-N 1 1 237.293 3.609 20 0 BHADMO CC12CC(C1)C[N@H+]2CC[C@H]1CCc2ccccc21 ZINC000662386207 412140740 /nfs/dbraw/zinc/14/07/40/412140740.db2.gz YATOEPHQMKRDLB-GNHJJJEISA-N 1 1 241.378 3.591 20 0 BHADMO CC12CC(C1)C[N@H+]2CC[C@@H]1CCc2ccccc21 ZINC000662386208 412140572 /nfs/dbraw/zinc/14/05/72/412140572.db2.gz YATOEPHQMKRDLB-GULBITTBSA-N 1 1 241.378 3.591 20 0 BHADMO CC12CC(C1)C[N@H+]2CC/C=C\c1ccccc1 ZINC000662386250 412139615 /nfs/dbraw/zinc/13/96/15/412139615.db2.gz ZXFPDWFOSYRKIT-UITAMQMPSA-N 1 1 227.351 3.574 20 0 BHADMO CC12CC(C1)C[N@H+]2CC/C=C/c1ccccc1 ZINC000662386251 412139640 /nfs/dbraw/zinc/13/96/40/412139640.db2.gz ZXFPDWFOSYRKIT-WEVVVXLNSA-N 1 1 227.351 3.574 20 0 BHADMO CCc1[nH+]ccn1Cc1cccc(C(C)C)c1 ZINC000663249293 582718210 /nfs/dbraw/zinc/71/82/10/582718210.db2.gz WHVNWVATFRUTKE-UHFFFAOYSA-N 1 1 228.339 3.617 20 0 BHADMO c1cc2cc[nH+]cc2c(NC[C@@H]2C[C@H]3C[C@H]3C2)c1 ZINC000663280074 412408360 /nfs/dbraw/zinc/40/83/60/412408360.db2.gz NPQDPBLCZAHDNK-UBSAEIQESA-N 1 1 238.334 3.693 20 0 BHADMO Cc1cc(C(F)(F)F)cc(NC2CC=CC2)[nH+]1 ZINC000663717337 411731957 /nfs/dbraw/zinc/73/19/57/411731957.db2.gz UDHYLSNUVPRJGI-UHFFFAOYSA-N 1 1 242.244 3.539 20 0 BHADMO c1cc2[nH+]ccc(N3C[C@@H]4CCCC[C@@H]43)c2s1 ZINC000664082922 411844920 /nfs/dbraw/zinc/84/49/20/411844920.db2.gz MOUNPIISXRQYFQ-JQWIXIFHSA-N 1 1 244.363 3.675 20 0 BHADMO 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244.382 3.821 20 0 BHADMO CC/C=C/CC[N@H+]1CC(C)(C)[C@H]1c1cccnc1 ZINC000664824587 412027156 /nfs/dbraw/zinc/02/71/56/412027156.db2.gz WOZPMLYDIYBFDK-LLYBFZRZSA-N 1 1 244.382 3.821 20 0 BHADMO CC/C=C/CC[N@H+]1CC(C)(C)[C@@H]1c1cccnc1 ZINC000664824588 412026212 /nfs/dbraw/zinc/02/62/12/412026212.db2.gz WOZPMLYDIYBFDK-NFAHFFEMSA-N 1 1 244.382 3.821 20 0 BHADMO CC/C=C\CC[N@H+]1CC(C)(C)[C@@H]1c1cccnc1 ZINC000664824589 412026227 /nfs/dbraw/zinc/02/62/27/412026227.db2.gz WOZPMLYDIYBFDK-YVACAVLKSA-N 1 1 244.382 3.821 20 0 BHADMO CC1(C)C[N@H+]([C@@H]2C=CCCC2)[C@H]1c1cccnc1 ZINC000664826706 412026904 /nfs/dbraw/zinc/02/69/04/412026904.db2.gz XDFMDTHVJUVUAA-CABCVRRESA-N 1 1 242.366 3.573 20 0 BHADMO CC1(C)C[N@H+]([C@H]2C=CCCC2)[C@H]1c1cccnc1 ZINC000664826707 412027481 /nfs/dbraw/zinc/02/74/81/412027481.db2.gz XDFMDTHVJUVUAA-GJZGRUSLSA-N 1 1 242.366 3.573 20 0 BHADMO CC1(C)C[N@H+]([C@@H]2C=CCCC2)[C@@H]1c1cccnc1 ZINC000664826708 412026879 /nfs/dbraw/zinc/02/68/79/412026879.db2.gz 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ZINC000664828848 412029152 /nfs/dbraw/zinc/02/91/52/412029152.db2.gz IRNGHQIEZXNEKB-HNNXBMFYSA-N 1 1 242.366 3.575 20 0 BHADMO CC1(C)C[N@@H+](CC2=CCCC2)[C@@H]1c1ccncc1 ZINC000664828849 412029138 /nfs/dbraw/zinc/02/91/38/412029138.db2.gz IRNGHQIEZXNEKB-OAHLLOKOSA-N 1 1 242.366 3.575 20 0 BHADMO CCCCC[N@H+]1CC(C)(C)[C@@H]1c1ccncc1 ZINC000664829715 412029121 /nfs/dbraw/zinc/02/91/21/412029121.db2.gz QCNCRAZAXFPQGN-AWEZNQCLSA-N 1 1 232.371 3.655 20 0 BHADMO CCCCC[N@H+]1CC(C)(C)[C@H]1c1ccncc1 ZINC000664829717 412028899 /nfs/dbraw/zinc/02/88/99/412028899.db2.gz QCNCRAZAXFPQGN-CQSZACIVSA-N 1 1 232.371 3.655 20 0 BHADMO CC1(C)C[N@@H+](CCC2CCC2)[C@H]1c1ccncc1 ZINC000664831196 412030094 /nfs/dbraw/zinc/03/00/94/412030094.db2.gz ZVZLCBJUBMXAIN-HNNXBMFYSA-N 1 1 244.382 3.655 20 0 BHADMO CC1(C)C[N@@H+](CCC2CCC2)[C@@H]1c1ccncc1 ZINC000664831198 412028427 /nfs/dbraw/zinc/02/84/27/412028427.db2.gz ZVZLCBJUBMXAIN-OAHLLOKOSA-N 1 1 244.382 3.655 20 0 BHADMO CC1(C)C[N@H+]([C@@H]2C=CCCC2)[C@H]1c1ccncc1 ZINC000664832110 412028978 /nfs/dbraw/zinc/02/89/78/412028978.db2.gz CJVSKKMTGINQPB-CABCVRRESA-N 1 1 242.366 3.573 20 0 BHADMO CC1(C)C[N@H+]([C@H]2C=CCCC2)[C@H]1c1ccncc1 ZINC000664832112 412028609 /nfs/dbraw/zinc/02/86/09/412028609.db2.gz CJVSKKMTGINQPB-GJZGRUSLSA-N 1 1 242.366 3.573 20 0 BHADMO CC1(C)C[N@H+]([C@@H]2C=CCCC2)[C@@H]1c1ccncc1 ZINC000664832114 412029417 /nfs/dbraw/zinc/02/94/17/412029417.db2.gz CJVSKKMTGINQPB-HUUCEWRRSA-N 1 1 242.366 3.573 20 0 BHADMO CC1(C)C[N@H+]([C@H]2C=CCCC2)[C@@H]1c1ccncc1 ZINC000664832115 412028543 /nfs/dbraw/zinc/02/85/43/412028543.db2.gz CJVSKKMTGINQPB-LSDHHAIUSA-N 1 1 242.366 3.573 20 0 BHADMO CC/C=C\CC[N@H+]1CC(C)(C)[C@H]1c1ccncc1 ZINC000664834599 412029217 /nfs/dbraw/zinc/02/92/17/412029217.db2.gz YBUQQWPAPJRONO-IYKSTZQJSA-N 1 1 244.382 3.821 20 0 BHADMO CC/C=C/CC[N@H+]1CC(C)(C)[C@H]1c1ccncc1 ZINC000664834601 412029546 /nfs/dbraw/zinc/02/95/46/412029546.db2.gz YBUQQWPAPJRONO-LLYBFZRZSA-N 1 1 244.382 3.821 20 0 BHADMO CC/C=C/CC[N@H+]1CC(C)(C)[C@@H]1c1ccncc1 ZINC000664834603 412030102 /nfs/dbraw/zinc/03/01/02/412030102.db2.gz YBUQQWPAPJRONO-NFAHFFEMSA-N 1 1 244.382 3.821 20 0 BHADMO CC/C=C\CC[N@H+]1CC(C)(C)[C@@H]1c1ccncc1 ZINC000664834604 412028647 /nfs/dbraw/zinc/02/86/47/412028647.db2.gz YBUQQWPAPJRONO-YVACAVLKSA-N 1 1 244.382 3.821 20 0 BHADMO CCC(C)(C)[C@H](C)[NH2+][C@H]1C[C@H](N)c2ccccc21 ZINC000665236711 412176898 /nfs/dbraw/zinc/17/68/98/412176898.db2.gz SILBCXWVQITNEF-CQDKDKBSSA-N 1 1 246.398 3.546 20 0 BHADMO CCC(C)(C)[C@H](C)[NH2+][C@H]1C[C@@H](N)c2ccccc21 ZINC000665236712 412175813 /nfs/dbraw/zinc/17/58/13/412175813.db2.gz SILBCXWVQITNEF-GLQYFDAESA-N 1 1 246.398 3.546 20 0 BHADMO CCC(C)(C)[C@H](C)[NH2+][C@@H]1C[C@@H](N)c2ccccc21 ZINC000665236713 412177082 /nfs/dbraw/zinc/17/70/82/412177082.db2.gz SILBCXWVQITNEF-NILFDRSVSA-N 1 1 246.398 3.546 20 0 BHADMO CCC(C)(C)[C@H](C)[NH2+][C@@H]1C[C@H](N)c2ccccc21 ZINC000665236714 412177120 /nfs/dbraw/zinc/17/71/20/412177120.db2.gz SILBCXWVQITNEF-TUKIKUTGSA-N 1 1 246.398 3.546 20 0 BHADMO CC[N@@H+](Cc1occc1C)[C@H](C)c1ccncc1 ZINC000665239507 412180689 /nfs/dbraw/zinc/18/06/89/412180689.db2.gz KKEGHIVKGRNUAT-CYBMUJFWSA-N 1 1 244.338 3.566 20 0 BHADMO CC[N@@H+](Cc1occc1C)[C@@H](C)c1ccncc1 ZINC000665239508 412180336 /nfs/dbraw/zinc/18/03/36/412180336.db2.gz KKEGHIVKGRNUAT-ZDUSSCGKSA-N 1 1 244.338 3.566 20 0 BHADMO FC(F)(F)CCCC[N@H+]1CC[C@@H](C2CCC2)C1 ZINC000665288330 412233747 /nfs/dbraw/zinc/23/37/47/412233747.db2.gz KGUOVRIZDUUNOJ-GFCCVEGCSA-N 1 1 249.320 3.841 20 0 BHADMO FC(F)(F)CCCC[N@H+]1CC[C@H](C2CCC2)C1 ZINC000665288331 412233093 /nfs/dbraw/zinc/23/30/93/412233093.db2.gz KGUOVRIZDUUNOJ-LBPRGKRZSA-N 1 1 249.320 3.841 20 0 BHADMO FC1(F)CC[C@H](C[N@H+]2CC[C@H](C3CCC3)C2)C1 ZINC000665290204 410775635 /nfs/dbraw/zinc/77/56/35/410775635.db2.gz OFUGBTRETIKNQM-AAEUAGOBSA-N 1 1 243.341 3.544 20 0 BHADMO FC1(F)CC[C@@H](C[N@H+]2CC[C@@H](C3CCC3)C2)C1 ZINC000665290205 410776267 /nfs/dbraw/zinc/77/62/67/410776267.db2.gz OFUGBTRETIKNQM-DGCLKSJQSA-N 1 1 243.341 3.544 20 0 BHADMO FC1(F)CC[C@H](C[N@H+]2CC[C@@H](C3CCC3)C2)C1 ZINC000665290206 410776066 /nfs/dbraw/zinc/77/60/66/410776066.db2.gz OFUGBTRETIKNQM-WCQYABFASA-N 1 1 243.341 3.544 20 0 BHADMO FC1(F)CC[C@@H](C[N@H+]2CC[C@H](C3CCC3)C2)C1 ZINC000665290207 410776998 /nfs/dbraw/zinc/77/69/98/410776998.db2.gz OFUGBTRETIKNQM-YPMHNXCESA-N 1 1 243.341 3.544 20 0 BHADMO CCC[C@H]([NH2+][C@H](C)c1cn[nH]c1C)C1CCCC1 ZINC000666181216 487747966 /nfs/dbraw/zinc/74/79/66/487747966.db2.gz YGRMJVAPZTVGKV-ABAIWWIYSA-N 1 1 249.402 3.728 20 0 BHADMO CCC[C@@H]([NH2+][C@H](C)c1cn[nH]c1C)C1CCCC1 ZINC000666181223 487748150 /nfs/dbraw/zinc/74/81/50/487748150.db2.gz YGRMJVAPZTVGKV-IAQYHMDHSA-N 1 1 249.402 3.728 20 0 BHADMO CCC[C@H]([NH2+][C@@H](C)c1cn[nH]c1C)C1CCCC1 ZINC000666181224 487748134 /nfs/dbraw/zinc/74/81/34/487748134.db2.gz YGRMJVAPZTVGKV-NHYWBVRUSA-N 1 1 249.402 3.728 20 0 BHADMO CCC[C@@H]([NH2+][C@@H](C)c1cn[nH]c1C)C1CCCC1 ZINC000666181225 487748260 /nfs/dbraw/zinc/74/82/60/487748260.db2.gz YGRMJVAPZTVGKV-XHDPSFHLSA-N 1 1 249.402 3.728 20 0 BHADMO Cc1[nH]ncc1[C@H](C)[NH2+][C@H]1CCC[C@@H]1C(C)(C)C ZINC000666238367 487822652 /nfs/dbraw/zinc/82/26/52/487822652.db2.gz CGPCGWFXHXZOPC-BPNCWPANSA-N 1 1 249.402 3.584 20 0 BHADMO Cc1[nH]ncc1[C@H](C)[NH2+][C@H]1CCC[C@H]1C(C)(C)C ZINC000666238369 487822534 /nfs/dbraw/zinc/82/25/34/487822534.db2.gz CGPCGWFXHXZOPC-GDLCADMTSA-N 1 1 249.402 3.584 20 0 BHADMO Cc1[nH]ncc1[C@H](C)[NH2+][C@@H]1CCC[C@@H]1C(C)(C)C ZINC000666238372 487822449 /nfs/dbraw/zinc/82/24/49/487822449.db2.gz CGPCGWFXHXZOPC-LEWSCRJBSA-N 1 1 249.402 3.584 20 0 BHADMO Cc1[nH]ncc1[C@H](C)[NH2+][C@@H]1CCC[C@H]1C(C)(C)C ZINC000666238373 487822566 /nfs/dbraw/zinc/82/25/66/487822566.db2.gz CGPCGWFXHXZOPC-ZLKJLUDKSA-N 1 1 249.402 3.584 20 0 BHADMO Cc1ccc(C[N@@H+](Cc2ccoc2C)C2CC2)o1 ZINC000666295069 487780812 /nfs/dbraw/zinc/78/08/12/487780812.db2.gz FSLPNCFLRXKPDE-UHFFFAOYSA-N 1 1 245.322 3.654 20 0 BHADMO 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ZINC000667473263 488018343 /nfs/dbraw/zinc/01/83/43/488018343.db2.gz DQZHUTRQLOVSOW-UHFFFAOYSA-N 1 1 248.395 3.918 20 0 BHADMO C[C@@H]1CCCC[N@H+]1Cc1cc2ccncc2s1 ZINC000667473354 488018468 /nfs/dbraw/zinc/01/84/68/488018468.db2.gz HGIRENYTRVUTMG-LLVKDONJSA-N 1 1 246.379 3.671 20 0 BHADMO C[C@H]1CCCC[N@H+]1Cc1cc2ccncc2s1 ZINC000667473355 488018309 /nfs/dbraw/zinc/01/83/09/488018309.db2.gz HGIRENYTRVUTMG-NSHDSACASA-N 1 1 246.379 3.671 20 0 BHADMO CCCC[N@@H+](CC)Cc1cc(COC)cs1 ZINC000667473666 488019847 /nfs/dbraw/zinc/01/98/47/488019847.db2.gz QXGAVXAQAPSVJJ-UHFFFAOYSA-N 1 1 241.400 3.517 20 0 BHADMO C[N@@H+](Cc1cc2ccncc2s1)C1CCCC1 ZINC000667491776 488025916 /nfs/dbraw/zinc/02/59/16/488025916.db2.gz GYSWTPOGDGRNSO-UHFFFAOYSA-N 1 1 246.379 3.671 20 0 BHADMO Cc1cccc2[nH]c(C[N@H+](C)C3CCCC3)cc21 ZINC000667491886 488025705 /nfs/dbraw/zinc/02/57/05/488025705.db2.gz LGIDNLRFDKUVEI-UHFFFAOYSA-N 1 1 242.366 3.851 20 0 BHADMO Cc1ccc2cc(C[N@H+](C)C3CCCC3)[nH]c2c1 ZINC000667492115 487589261 /nfs/dbraw/zinc/58/92/61/487589261.db2.gz WNDKCQXGWDYBCI-UHFFFAOYSA-N 1 1 242.366 3.851 20 0 BHADMO CC[N@@H+](C)Cc1ccc(-c2scnc2C)cc1 ZINC000667495485 488026805 /nfs/dbraw/zinc/02/68/05/488026805.db2.gz LLPYCDOASNCQJB-UHFFFAOYSA-N 1 1 246.379 3.570 20 0 BHADMO Cc1ccc2cc(C[N@H+](C)CC(C)C)[nH]c2c1 ZINC000667495979 488028350 /nfs/dbraw/zinc/02/83/50/488028350.db2.gz DLHWMDYFJWQZKB-UHFFFAOYSA-N 1 1 230.355 3.564 20 0 BHADMO Cc1cccc2[nH]c(C[N@H+](C)CC(C)C)cc21 ZINC000667496477 488029012 /nfs/dbraw/zinc/02/90/12/488029012.db2.gz WDSPQIIIMAVBPE-UHFFFAOYSA-N 1 1 230.355 3.564 20 0 BHADMO CC(C)CC[N@@H+](C)Cc1cc2ccncc2s1 ZINC000667499539 488030652 /nfs/dbraw/zinc/03/06/52/488030652.db2.gz NNXSKGIOLCQCBC-UHFFFAOYSA-N 1 1 248.395 3.774 20 0 BHADMO CC(C)[C@@H](C)[N@@H+](C)Cc1cc2ccncc2s1 ZINC000667499774 488030256 /nfs/dbraw/zinc/03/02/56/488030256.db2.gz UZZTWWARHLEPRM-LLVKDONJSA-N 1 1 248.395 3.773 20 0 BHADMO CC(C)[C@H](C)[N@@H+](C)Cc1cc2ccncc2s1 ZINC000667499775 488030646 /nfs/dbraw/zinc/03/06/46/488030646.db2.gz UZZTWWARHLEPRM-NSHDSACASA-N 1 1 248.395 3.773 20 0 BHADMO CCC[N@@H+](Cc1cc2ccncc2s1)C1CC1 ZINC000667500260 488030046 /nfs/dbraw/zinc/03/00/46/488030046.db2.gz JMZKZTSPKBZXJJ-UHFFFAOYSA-N 1 1 246.379 3.671 20 0 BHADMO CC[N@H+](Cc1cc2ccncc2s1)CC(C)C ZINC000667503364 488031817 /nfs/dbraw/zinc/03/18/17/488031817.db2.gz JNNOBTJGGYBETE-UHFFFAOYSA-N 1 1 248.395 3.774 20 0 BHADMO CC[C@@H](C)[N@@H+](C)Cc1cc2ccc(C)cc2[nH]1 ZINC000667504988 488032640 /nfs/dbraw/zinc/03/26/40/488032640.db2.gz AYEXKFRWTOBQPD-GFCCVEGCSA-N 1 1 230.355 3.707 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1cc2ccc(C)cc2[nH]1 ZINC000667504989 488033969 /nfs/dbraw/zinc/03/39/69/488033969.db2.gz AYEXKFRWTOBQPD-LBPRGKRZSA-N 1 1 230.355 3.707 20 0 BHADMO CC[C@@H](C)[N@@H+](C)Cc1cc2c(cccc2C)[nH]1 ZINC000667505351 488033729 /nfs/dbraw/zinc/03/37/29/488033729.db2.gz MMJMQQSADBCJFF-GFCCVEGCSA-N 1 1 230.355 3.707 20 0 BHADMO CC[C@H](C)[N@@H+](C)Cc1cc2c(cccc2C)[nH]1 ZINC000667505352 488032853 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CC[N@@H+](CCC(F)(F)F)C[C@@H](C)C(C)(C)C ZINC000670263272 487862192 /nfs/dbraw/zinc/86/21/92/487862192.db2.gz YVHJTCXFZOPYHH-SNVBAGLBSA-N 1 1 239.325 3.943 20 0 BHADMO CC[N@H+](Cc1ccoc1)C[C@@H](C)C(C)(C)C ZINC000670263354 487860816 /nfs/dbraw/zinc/86/08/16/487860816.db2.gz FGWMJSXUOLIDKP-GFCCVEGCSA-N 1 1 223.360 3.784 20 0 BHADMO CC[N@H+](Cc1ccoc1)C[C@H](C)C(C)(C)C ZINC000670263355 487860773 /nfs/dbraw/zinc/86/07/73/487860773.db2.gz FGWMJSXUOLIDKP-LBPRGKRZSA-N 1 1 223.360 3.784 20 0 BHADMO Cc1ncsc1C[N@H+](C)C[C@H](C)C(C)(C)C ZINC000670263590 487863303 /nfs/dbraw/zinc/86/33/03/487863303.db2.gz CHWIKDOLSVQHLI-JTQLQIEISA-N 1 1 240.416 3.566 20 0 BHADMO Cc1ncsc1C[N@H+](C)C[C@@H](C)C(C)(C)C ZINC000670263591 487863548 /nfs/dbraw/zinc/86/35/48/487863548.db2.gz CHWIKDOLSVQHLI-SNVBAGLBSA-N 1 1 240.416 3.566 20 0 BHADMO C[C@@H](C[N@H+]1CCC[C@H]1C1CC1)C(C)(C)C ZINC000670263664 487863485 /nfs/dbraw/zinc/86/34/85/487863485.db2.gz LOOYPERWAVXVNC-AAEUAGOBSA-N 1 1 209.377 3.543 20 0 BHADMO C[C@H](C[N@H+]1CCC[C@@H]1C1CC1)C(C)(C)C ZINC000670263665 487863286 /nfs/dbraw/zinc/86/32/86/487863286.db2.gz LOOYPERWAVXVNC-DGCLKSJQSA-N 1 1 209.377 3.543 20 0 BHADMO C[C@@H](C[N@H+]1CCC[C@@H]1C1CC1)C(C)(C)C ZINC000670263666 487863274 /nfs/dbraw/zinc/86/32/74/487863274.db2.gz LOOYPERWAVXVNC-WCQYABFASA-N 1 1 209.377 3.543 20 0 BHADMO C[C@H](C[N@H+]1CCC[C@H]1C1CC1)C(C)(C)C ZINC000670263667 487863115 /nfs/dbraw/zinc/86/31/15/487863115.db2.gz LOOYPERWAVXVNC-YPMHNXCESA-N 1 1 209.377 3.543 20 0 BHADMO CC[N@H+](Cc1ccccn1)C[C@@H](C)C(C)(C)C ZINC000670264216 487864768 /nfs/dbraw/zinc/86/47/68/487864768.db2.gz AXIRXQHHLJKTHL-CYBMUJFWSA-N 1 1 234.387 3.586 20 0 BHADMO CC[N@H+](Cc1ccccn1)C[C@H](C)C(C)(C)C ZINC000670264217 487864374 /nfs/dbraw/zinc/86/43/74/487864374.db2.gz AXIRXQHHLJKTHL-ZDUSSCGKSA-N 1 1 234.387 3.586 20 0 BHADMO Cc1csc(C[N@H+](C)C[C@H](C)C(C)(C)C)n1 ZINC000670264346 487865726 /nfs/dbraw/zinc/86/57/26/487865726.db2.gz TWMWPWOGESAKAF-JTQLQIEISA-N 1 1 240.416 3.566 20 0 BHADMO Cc1csc(C[N@H+](C)C[C@@H](C)C(C)(C)C)n1 ZINC000670264347 487865486 /nfs/dbraw/zinc/86/54/86/487865486.db2.gz TWMWPWOGESAKAF-SNVBAGLBSA-N 1 1 240.416 3.566 20 0 BHADMO C[C@H](C[N@H+]1CC[C@@H](c2ccco2)C1)C(C)(C)C ZINC000670264356 487865586 /nfs/dbraw/zinc/86/55/86/487865586.db2.gz ULLUKZVADBYOGC-CHWSQXEVSA-N 1 1 235.371 3.751 20 0 BHADMO C[C@H](C[N@H+]1CC[C@H](c2ccco2)C1)C(C)(C)C ZINC000670264357 487865231 /nfs/dbraw/zinc/86/52/31/487865231.db2.gz ULLUKZVADBYOGC-OLZOCXBDSA-N 1 1 235.371 3.751 20 0 BHADMO C[C@@H](C[N@H+]1CC[C@@H](c2ccco2)C1)C(C)(C)C ZINC000670264358 487865219 /nfs/dbraw/zinc/86/52/19/487865219.db2.gz ULLUKZVADBYOGC-QWHCGFSZSA-N 1 1 235.371 3.751 20 0 BHADMO C[C@@H](C[N@H+]1CC[C@H](c2ccco2)C1)C(C)(C)C ZINC000670264359 487865603 /nfs/dbraw/zinc/86/56/03/487865603.db2.gz ULLUKZVADBYOGC-STQMWFEESA-N 1 1 235.371 3.751 20 0 BHADMO COC1CCC([N@@H+](C)C[C@H](C)C(C)(C)C)CC1 ZINC000670264454 487866240 /nfs/dbraw/zinc/86/62/40/487866240.db2.gz HVLRNPDRQVUZGM-HSBZDZAISA-N 1 1 241.419 3.558 20 0 BHADMO COC1CCC([N@@H+](C)C[C@@H](C)C(C)(C)C)CC1 ZINC000670264455 487866254 /nfs/dbraw/zinc/86/62/54/487866254.db2.gz HVLRNPDRQVUZGM-IYXRBSQSSA-N 1 1 241.419 3.558 20 0 BHADMO C[C@H](C[N@H+]1CCc2ccsc2C1)C(C)(C)C ZINC000670264484 487866544 /nfs/dbraw/zinc/86/65/44/487866544.db2.gz LRCMLFRRDGYUGV-LLVKDONJSA-N 1 1 237.412 3.788 20 0 BHADMO C[C@@H](C[N@H+]1CCc2ccsc2C1)C(C)(C)C ZINC000670264485 487866451 /nfs/dbraw/zinc/86/64/51/487866451.db2.gz LRCMLFRRDGYUGV-NSHDSACASA-N 1 1 237.412 3.788 20 0 BHADMO C[C@H](C[N@H+]1CCC2(CCC2)C1)C(C)(C)C ZINC000670264507 487865358 /nfs/dbraw/zinc/86/53/58/487865358.db2.gz OOTLYBDTRRWLCX-GFCCVEGCSA-N 1 1 209.377 3.545 20 0 BHADMO C[C@@H](C[N@H+]1CCC2(CCC2)C1)C(C)(C)C ZINC000670264508 487865741 /nfs/dbraw/zinc/86/57/41/487865741.db2.gz OOTLYBDTRRWLCX-LBPRGKRZSA-N 1 1 209.377 3.545 20 0 BHADMO Cc1cccc(C[N@H+](C)C[C@@H](C)C(C)(C)C)n1 ZINC000670264822 487868038 /nfs/dbraw/zinc/86/80/38/487868038.db2.gz HKHVHAAUXYPXKR-GFCCVEGCSA-N 1 1 234.387 3.504 20 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20 0 BHADMO CC(C)[N@H+](CC(F)F)C[C@@H](C)C(C)(C)C ZINC000670265717 487871224 /nfs/dbraw/zinc/87/12/24/487871224.db2.gz XAYMXBPXJLUEMU-SNVBAGLBSA-N 1 1 221.335 3.644 20 0 BHADMO C[C@H](c1ccccn1)[N@H+](C)C[C@@H](C)C(C)(C)C ZINC000670268514 487878353 /nfs/dbraw/zinc/87/83/53/487878353.db2.gz MVVIUZDXAWAKRU-CHWSQXEVSA-N 1 1 234.387 3.757 20 0 BHADMO C[C@H](C[N@@H+](C)[C@@H](C)c1ccccn1)C(C)(C)C ZINC000670268515 487878050 /nfs/dbraw/zinc/87/80/50/487878050.db2.gz MVVIUZDXAWAKRU-OLZOCXBDSA-N 1 1 234.387 3.757 20 0 BHADMO C[C@@H](C[N@@H+](C)[C@H](C)c1ccccn1)C(C)(C)C ZINC000670268516 487877970 /nfs/dbraw/zinc/87/79/70/487877970.db2.gz MVVIUZDXAWAKRU-QWHCGFSZSA-N 1 1 234.387 3.757 20 0 BHADMO C[C@@H](C[N@@H+](C)[C@@H](C)c1ccccn1)C(C)(C)C ZINC000670268517 487878025 /nfs/dbraw/zinc/87/80/25/487878025.db2.gz MVVIUZDXAWAKRU-STQMWFEESA-N 1 1 234.387 3.757 20 0 BHADMO C[C@H](c1cccnc1)[N@H+](C)C[C@@H](C)C(C)(C)C ZINC000670269090 487880505 /nfs/dbraw/zinc/88/05/05/487880505.db2.gz QGKGHUBUMFYNBR-CHWSQXEVSA-N 1 1 234.387 3.757 20 0 BHADMO C[C@H](C[N@@H+](C)[C@@H](C)c1cccnc1)C(C)(C)C ZINC000670269091 487880146 /nfs/dbraw/zinc/88/01/46/487880146.db2.gz QGKGHUBUMFYNBR-OLZOCXBDSA-N 1 1 234.387 3.757 20 0 BHADMO C[C@@H](C[N@@H+](C)[C@H](C)c1cccnc1)C(C)(C)C ZINC000670269092 487880757 /nfs/dbraw/zinc/88/07/57/487880757.db2.gz QGKGHUBUMFYNBR-QWHCGFSZSA-N 1 1 234.387 3.757 20 0 BHADMO C[C@@H](C[N@@H+](C)[C@@H](C)c1cccnc1)C(C)(C)C ZINC000670269093 487880181 /nfs/dbraw/zinc/88/01/81/487880181.db2.gz QGKGHUBUMFYNBR-STQMWFEESA-N 1 1 234.387 3.757 20 0 BHADMO C[C@H](c1ccncc1)[N@H+](C)C[C@@H](C)C(C)(C)C ZINC000670269155 487880513 /nfs/dbraw/zinc/88/05/13/487880513.db2.gz WZPMQJMGGPLYOW-CHWSQXEVSA-N 1 1 234.387 3.757 20 0 BHADMO C[C@H](C[N@@H+](C)[C@@H](C)c1ccncc1)C(C)(C)C ZINC000670269156 487880250 /nfs/dbraw/zinc/88/02/50/487880250.db2.gz WZPMQJMGGPLYOW-OLZOCXBDSA-N 1 1 234.387 3.757 20 0 BHADMO C[C@@H](C[N@@H+](C)[C@H](C)c1ccncc1)C(C)(C)C ZINC000670269157 487880415 /nfs/dbraw/zinc/88/04/15/487880415.db2.gz WZPMQJMGGPLYOW-QWHCGFSZSA-N 1 1 234.387 3.757 20 0 BHADMO C[C@@H](C[N@@H+](C)[C@@H](C)c1ccncc1)C(C)(C)C ZINC000670269158 487880228 /nfs/dbraw/zinc/88/02/28/487880228.db2.gz WZPMQJMGGPLYOW-STQMWFEESA-N 1 1 234.387 3.757 20 0 BHADMO C[C@H](C[N@H+]1CCCC2(CC2)C1)C(C)(C)C ZINC000670269255 487881345 /nfs/dbraw/zinc/88/13/45/487881345.db2.gz ITPZVPMPXRIZKS-GFCCVEGCSA-N 1 1 209.377 3.545 20 0 BHADMO C[C@@H](C[N@H+]1CCCC2(CC2)C1)C(C)(C)C ZINC000670269256 487881713 /nfs/dbraw/zinc/88/17/13/487881713.db2.gz ITPZVPMPXRIZKS-LBPRGKRZSA-N 1 1 209.377 3.545 20 0 BHADMO C[C@H](C[N@H+]1CC[C@@H]2CCC[C@@H]21)C(C)(C)C ZINC000670269395 487881165 /nfs/dbraw/zinc/88/11/65/487881165.db2.gz ALWNLMMWHCVDBM-AGIUHOORSA-N 1 1 209.377 3.543 20 0 BHADMO C[C@H](C[N@H+]1CC[C@@H]2CCC[C@H]21)C(C)(C)C ZINC000670269396 487881188 /nfs/dbraw/zinc/88/11/88/487881188.db2.gz ALWNLMMWHCVDBM-FRRDWIJNSA-N 1 1 209.377 3.543 20 0 BHADMO C[C@H](C[N@H+]1CC[C@H]2CCC[C@H]21)C(C)(C)C ZINC000670269397 487881660 /nfs/dbraw/zinc/88/16/60/487881660.db2.gz ALWNLMMWHCVDBM-JHJVBQTASA-N 1 1 209.377 3.543 20 0 BHADMO C[C@H](C[N@H+]1CC[C@H]2CCC[C@@H]21)C(C)(C)C ZINC000670269398 487881354 /nfs/dbraw/zinc/88/13/54/487881354.db2.gz ALWNLMMWHCVDBM-UPJWGTAASA-N 1 1 209.377 3.543 20 0 BHADMO CCn1ccc(C[N@@H+](C)C[C@@H](C)C(C)(C)C)c1 ZINC000670270126 487885629 /nfs/dbraw/zinc/88/56/29/487885629.db2.gz XJHLBTKTWQECOB-CYBMUJFWSA-N 1 1 236.403 3.622 20 0 BHADMO CCn1ccc(C[N@@H+](C)C[C@H](C)C(C)(C)C)c1 ZINC000670270127 487885084 /nfs/dbraw/zinc/88/50/84/487885084.db2.gz XJHLBTKTWQECOB-ZDUSSCGKSA-N 1 1 236.403 3.622 20 0 BHADMO CO[C@]1(C)CCC[N@@H+](C[C@H](C)C(C)(C)C)CC1 ZINC000670270721 487888654 /nfs/dbraw/zinc/88/86/54/487888654.db2.gz KMHGJKCJBSQOFO-DZGCQCFKSA-N 1 1 241.419 3.560 20 0 BHADMO CO[C@@]1(C)CCC[N@@H+](C[C@@H](C)C(C)(C)C)CC1 ZINC000670270722 487888643 /nfs/dbraw/zinc/88/86/43/487888643.db2.gz KMHGJKCJBSQOFO-HIFRSBDPSA-N 1 1 241.419 3.560 20 0 BHADMO CO[C@]1(C)CCC[N@@H+](C[C@@H](C)C(C)(C)C)CC1 ZINC000670270723 487889451 /nfs/dbraw/zinc/88/94/51/487889451.db2.gz KMHGJKCJBSQOFO-UKRRQHHQSA-N 1 1 241.419 3.560 20 0 BHADMO CO[C@@]1(C)CCC[N@@H+](C[C@H](C)C(C)(C)C)CC1 ZINC000670270724 487889389 /nfs/dbraw/zinc/88/93/89/487889389.db2.gz KMHGJKCJBSQOFO-ZFWWWQNUSA-N 1 1 241.419 3.560 20 0 BHADMO Cc1ccncc1C[N@H+](C)C[C@@H](C)C(C)(C)C ZINC000670270735 487889036 /nfs/dbraw/zinc/88/90/36/487889036.db2.gz OAIHLSKNBXQEOD-CYBMUJFWSA-N 1 1 234.387 3.504 20 0 BHADMO Cc1ccncc1C[N@H+](C)C[C@H](C)C(C)(C)C ZINC000670270736 487888795 /nfs/dbraw/zinc/88/87/95/487888795.db2.gz OAIHLSKNBXQEOD-ZDUSSCGKSA-N 1 1 234.387 3.504 20 0 BHADMO C[C@H](C1CCCCC1)[N@@H+](C)Cc1ccc(O)cc1 ZINC000670272438 487894982 /nfs/dbraw/zinc/89/49/82/487894982.db2.gz NJPVIKAHSANFES-CYBMUJFWSA-N 1 1 247.382 3.793 20 0 BHADMO C[C@@H](C1CCCCC1)[N@@H+](C)Cc1ccc(O)cc1 ZINC000670272439 487894660 /nfs/dbraw/zinc/89/46/60/487894660.db2.gz NJPVIKAHSANFES-ZDUSSCGKSA-N 1 1 247.382 3.793 20 0 BHADMO FCCCCC[N@@H+](C1CC1)C1CCCCC1 ZINC000671240169 487872662 /nfs/dbraw/zinc/87/26/62/487872662.db2.gz HYPHMGCGDZMQAH-UHFFFAOYSA-N 1 1 227.367 3.923 20 0 BHADMO Cc1ccc(C[N@@H+](CCCCCF)C2CC2)o1 ZINC000671240281 487872452 /nfs/dbraw/zinc/87/24/52/487872452.db2.gz XIKDPFSTHMWYIX-UHFFFAOYSA-N 1 1 239.334 3.692 20 0 BHADMO FCCCCC[N@H+]1CCCc2ccccc2C1 ZINC000671241428 487873351 /nfs/dbraw/zinc/87/33/51/487873351.db2.gz TXHGHTQBHRYVBY-UHFFFAOYSA-N 1 1 235.346 3.575 20 0 BHADMO FCCCCC[N@H+]1CCCc2sccc2C1 ZINC000671241435 487873473 /nfs/dbraw/zinc/87/34/73/487873473.db2.gz TYMUKZJLHDDRRQ-UHFFFAOYSA-N 1 1 241.375 3.636 20 0 BHADMO FCCCCC[N@H+]1CC[C@H]1c1cccc(F)c1 ZINC000671241880 487874359 /nfs/dbraw/zinc/87/43/59/487874359.db2.gz NSQYHFYXKHBPOV-AWEZNQCLSA-N 1 1 239.309 3.712 20 0 BHADMO FCCCCC[N@H+]1CC[C@@H]1c1cccc(F)c1 ZINC000671241881 487874855 /nfs/dbraw/zinc/87/48/55/487874855.db2.gz NSQYHFYXKHBPOV-CQSZACIVSA-N 1 1 239.309 3.712 20 0 BHADMO COCCCCC[N@@H+](C)C(C)(C)c1ccccc1 ZINC000671245432 487888908 /nfs/dbraw/zinc/88/89/08/487888908.db2.gz BMYNKEXUANTHGA-UHFFFAOYSA-N 1 1 249.398 3.670 20 0 BHADMO C[N@@H+](CCOC(C)(C)C)C(C)(C)c1ccccc1 ZINC000671245437 487888690 /nfs/dbraw/zinc/88/86/90/487888690.db2.gz DQGOUXYKSRYXEX-UHFFFAOYSA-N 1 1 249.398 3.669 20 0 BHADMO C[N@@H+](Cc1nccs1)C(C)(C)c1ccccc1 ZINC000671245477 487888701 /nfs/dbraw/zinc/88/87/01/487888701.db2.gz FKNCSCZZOXKILC-UHFFFAOYSA-N 1 1 246.379 3.510 20 0 BHADMO C[N@H+](Cc1nccs1)C(C)(C)c1ccccc1 ZINC000671245477 487888698 /nfs/dbraw/zinc/88/86/98/487888698.db2.gz FKNCSCZZOXKILC-UHFFFAOYSA-N 1 1 246.379 3.510 20 0 BHADMO CCCCOCC[N@@H+](C)C(C)(C)c1ccccc1 ZINC000671245509 487888898 /nfs/dbraw/zinc/88/88/98/487888898.db2.gz DMNCFCYDTMMSCP-UHFFFAOYSA-N 1 1 249.398 3.670 20 0 BHADMO CCCC[N@@H+](C)C(C)(C)c1ccccc1 ZINC000671245548 487888663 /nfs/dbraw/zinc/88/86/63/487888663.db2.gz DUOAXOKFDOEIHE-UHFFFAOYSA-N 1 1 205.345 3.654 20 0 BHADMO C[N@@H+](CCC1CC1)C(C)(C)c1ccccc1 ZINC000671245635 487888517 /nfs/dbraw/zinc/88/85/17/487888517.db2.gz IPSRPUBNGAWAKA-UHFFFAOYSA-N 1 1 217.356 3.654 20 0 BHADMO C[N@@H+](CCC(F)(F)F)C(C)(C)c1ccccc1 ZINC000671245710 487888588 /nfs/dbraw/zinc/88/85/88/487888588.db2.gz KZSKZZZAKCIGTR-UHFFFAOYSA-N 1 1 245.288 3.806 20 0 BHADMO CC(C)COCC[N@@H+](C)C(C)(C)c1ccccc1 ZINC000671245730 487888793 /nfs/dbraw/zinc/88/87/93/487888793.db2.gz LTMYAKAGZLTVLW-UHFFFAOYSA-N 1 1 249.398 3.526 20 0 BHADMO CC(C)C[N@@H+](C)C(C)(C)c1ccccc1 ZINC000671245861 487889522 /nfs/dbraw/zinc/88/95/22/487889522.db2.gz JYNLVPVJWSCYJD-UHFFFAOYSA-N 1 1 205.345 3.510 20 0 BHADMO CC(C)OCCC[N@@H+](C)C(C)(C)c1ccccc1 ZINC000671245898 487889731 /nfs/dbraw/zinc/88/97/31/487889731.db2.gz KVFPCUDBFRCJEY-UHFFFAOYSA-N 1 1 249.398 3.669 20 0 BHADMO C[N@@H+](CCCCCF)C(C)(C)c1ccccc1 ZINC000671246018 487890324 /nfs/dbraw/zinc/89/03/24/487890324.db2.gz NCGHXACUJNACIQ-UHFFFAOYSA-N 1 1 237.362 3.993 20 0 BHADMO C[N@@H+]([C@H]1C=CCCC1)C(C)(C)c1ccccc1 ZINC000671246282 487890256 /nfs/dbraw/zinc/89/02/56/487890256.db2.gz FMIDEYULYFXVGN-HNNXBMFYSA-N 1 1 229.367 3.962 20 0 BHADMO C[N@@H+]([C@@H]1C=CCCC1)C(C)(C)c1ccccc1 ZINC000671246283 487890789 /nfs/dbraw/zinc/89/07/89/487890789.db2.gz FMIDEYULYFXVGN-OAHLLOKOSA-N 1 1 229.367 3.962 20 0 BHADMO C[N@@H+](CC1CCC1)C(C)(C)c1ccccc1 ZINC000671246299 487890158 /nfs/dbraw/zinc/89/01/58/487890158.db2.gz QLRMFEGQGBWMCV-UHFFFAOYSA-N 1 1 217.356 3.654 20 0 BHADMO COC(C)(C)CC[N@@H+](C)C(C)(C)c1ccccc1 ZINC000671246589 487891470 /nfs/dbraw/zinc/89/14/70/487891470.db2.gz LMQBZBBWBAGIGS-UHFFFAOYSA-N 1 1 249.398 3.669 20 0 BHADMO C[N@@H+](Cc1cscn1)C(C)(C)c1ccccc1 ZINC000671246799 487892705 /nfs/dbraw/zinc/89/27/05/487892705.db2.gz ZBASHOXGKDZGPE-UHFFFAOYSA-N 1 1 246.379 3.510 20 0 BHADMO C[N@H+](Cc1cscn1)C(C)(C)c1ccccc1 ZINC000671246799 487892702 /nfs/dbraw/zinc/89/27/02/487892702.db2.gz ZBASHOXGKDZGPE-UHFFFAOYSA-N 1 1 246.379 3.510 20 0 BHADMO c1ccc(C2=CCC[N@H+](C3CCCC3)C2)cc1 ZINC000671253960 487909308 /nfs/dbraw/zinc/90/93/08/487909308.db2.gz ZGYZKQREFGJLPE-UHFFFAOYSA-N 1 1 227.351 3.718 20 0 BHADMO CC(C)C[N@@H+](C)Cc1ccc(C(C)C)cc1 ZINC000671280694 488032043 /nfs/dbraw/zinc/03/20/43/488032043.db2.gz FPERKHJYNWGYSN-UHFFFAOYSA-N 1 1 219.372 3.898 20 0 BHADMO CC(C)C[N@@H+](Cc1ccco1)Cc1ccccc1 ZINC000671282381 488047997 /nfs/dbraw/zinc/04/79/97/488047997.db2.gz PKDYMXIFUAPDHC-UHFFFAOYSA-N 1 1 243.350 3.938 20 0 BHADMO CC(C)C[N@@H+](C)Cc1ccc2ccccc2c1 ZINC000671290339 488119341 /nfs/dbraw/zinc/11/93/41/488119341.db2.gz UWBOZCIAURZGGZ-UHFFFAOYSA-N 1 1 227.351 3.928 20 0 BHADMO CCC1CC([NH2+]CC(F)(F)c2ccccc2)C1 ZINC000671300059 487521365 /nfs/dbraw/zinc/52/13/65/487521365.db2.gz IEQOSFMSLHKCFE-UHFFFAOYSA-N 1 1 239.309 3.557 20 0 BHADMO CCOc1ccc([C@@H]2CCC[N@H+]2CC(C)C)cc1 ZINC000671300993 487550950 /nfs/dbraw/zinc/55/09/50/487550950.db2.gz AORDFSQBFBQLAR-INIZCTEOSA-N 1 1 247.382 3.878 20 0 BHADMO CCOc1ccc([C@H]2CCC[N@H+]2CC(C)C)cc1 ZINC000671300994 487551004 /nfs/dbraw/zinc/55/10/04/487551004.db2.gz AORDFSQBFBQLAR-MRXNPFEDSA-N 1 1 247.382 3.878 20 0 BHADMO Cc1ccc(C[N@H+](C)CC(C(C)C)C(C)C)nc1 ZINC000671307728 487622521 /nfs/dbraw/zinc/62/25/21/487622521.db2.gz KCAMGZQGANESLD-UHFFFAOYSA-N 1 1 248.414 3.750 20 0 BHADMO C[N@@H+](Cc1cccc(F)c1)C1CCCCCC1 ZINC000671308522 487623638 /nfs/dbraw/zinc/62/36/38/487623638.db2.gz HQWYEWJKYFMWRF-UHFFFAOYSA-N 1 1 235.346 3.980 20 0 BHADMO C[N@@H+](Cc1ccc(F)cc1)C1CCCCCC1 ZINC000671308536 487623673 /nfs/dbraw/zinc/62/36/73/487623673.db2.gz KUPKIKDSSJUNEX-UHFFFAOYSA-N 1 1 235.346 3.980 20 0 BHADMO C[N@@H+](Cc1ccco1)C(C)(C)c1ccccc1 ZINC000671309170 487625452 /nfs/dbraw/zinc/62/54/52/487625452.db2.gz FMKYAWQPPJSDSV-UHFFFAOYSA-N 1 1 229.323 3.647 20 0 BHADMO C[C@@H]1C[C@@H]1C[N@@H+](C)C(C)(C)c1ccccc1 ZINC000671309180 487625338 /nfs/dbraw/zinc/62/53/38/487625338.db2.gz GUOSHLNMEMLVMU-CHWSQXEVSA-N 1 1 217.356 3.510 20 0 BHADMO C[C@@H]1C[C@H]1C[N@@H+](C)C(C)(C)c1ccccc1 ZINC000671309181 487625023 /nfs/dbraw/zinc/62/50/23/487625023.db2.gz GUOSHLNMEMLVMU-OLZOCXBDSA-N 1 1 217.356 3.510 20 0 BHADMO C[C@H]1C[C@@H]1C[N@@H+](C)C(C)(C)c1ccccc1 ZINC000671309182 487625414 /nfs/dbraw/zinc/62/54/14/487625414.db2.gz GUOSHLNMEMLVMU-QWHCGFSZSA-N 1 1 217.356 3.510 20 0 BHADMO C[C@H]1C[C@H]1C[N@@H+](C)C(C)(C)c1ccccc1 ZINC000671309183 487625275 /nfs/dbraw/zinc/62/52/75/487625275.db2.gz GUOSHLNMEMLVMU-STQMWFEESA-N 1 1 217.356 3.510 20 0 BHADMO C[N@@H+](Cc1cncs1)C(C)(C)c1ccccc1 ZINC000671309215 487624989 /nfs/dbraw/zinc/62/49/89/487624989.db2.gz KQIFEZQKPJRCEY-UHFFFAOYSA-N 1 1 246.379 3.510 20 0 BHADMO C[N@@H+](C[C@H]1CCSC1)C(C)(C)c1ccccc1 ZINC000671309312 487625307 /nfs/dbraw/zinc/62/53/07/487625307.db2.gz SYWPKJGGARMTDA-CYBMUJFWSA-N 1 1 249.423 3.607 20 0 BHADMO C[N@@H+](C[C@@H]1CCSC1)C(C)(C)c1ccccc1 ZINC000671309313 487624847 /nfs/dbraw/zinc/62/48/47/487624847.db2.gz SYWPKJGGARMTDA-ZDUSSCGKSA-N 1 1 249.423 3.607 20 0 BHADMO Cc1ccc(C[N@H+](C)C(C)(C)c2ccccc2)o1 ZINC000671309339 487624811 /nfs/dbraw/zinc/62/48/11/487624811.db2.gz VVVGIZPNPKGRFQ-UHFFFAOYSA-N 1 1 243.350 3.955 20 0 BHADMO Cc1ccoc1C[N@H+](C)C(C)(C)c1ccccc1 ZINC000671309558 487625138 /nfs/dbraw/zinc/62/51/38/487625138.db2.gz PVOBRUONQSVILX-UHFFFAOYSA-N 1 1 243.350 3.955 20 0 BHADMO FCCCC[N@@H+](C1CC1)C1CCCCC1 ZINC000671677575 487684879 /nfs/dbraw/zinc/68/48/79/487684879.db2.gz MFBHMTKRYLGSEL-UHFFFAOYSA-N 1 1 213.340 3.533 20 0 BHADMO CCC[N@@H+](CCCCF)Cc1ccccc1F ZINC000671678824 487685589 /nfs/dbraw/zinc/68/55/89/487685589.db2.gz PUISFMWIFIUGOS-UHFFFAOYSA-N 1 1 241.325 3.787 20 0 BHADMO CC[C@H]1c2ccccc2CC[N@@H+]1CCCCF ZINC000671681917 487688628 /nfs/dbraw/zinc/68/86/28/487688628.db2.gz NRYDRQQESGHDID-HNNXBMFYSA-N 1 1 235.346 3.746 20 0 BHADMO CC[C@@H]1c2ccccc2CC[N@@H+]1CCCCF ZINC000671681918 487688620 /nfs/dbraw/zinc/68/86/20/487688620.db2.gz NRYDRQQESGHDID-OAHLLOKOSA-N 1 1 235.346 3.746 20 0 BHADMO CC(C)[C@H]1c2ccccc2CC[N@@H+]1CCCCF ZINC000671683609 487689653 /nfs/dbraw/zinc/68/96/53/487689653.db2.gz JUJFOVPWEAYCER-INIZCTEOSA-N 1 1 249.373 3.992 20 0 BHADMO CC(C)[C@@H]1c2ccccc2CC[N@@H+]1CCCCF ZINC000671683610 487689810 /nfs/dbraw/zinc/68/98/10/487689810.db2.gz JUJFOVPWEAYCER-MRXNPFEDSA-N 1 1 249.373 3.992 20 0 BHADMO C[N@@H+](CCCCF)C(C)(C)c1ccccc1 ZINC000671692858 487694405 /nfs/dbraw/zinc/69/44/05/487694405.db2.gz ZVNRAIUBJMHNHJ-UHFFFAOYSA-N 1 1 223.335 3.603 20 0 BHADMO Clc1c[nH+]ccc1N1CCC2(CCC2)CC1 ZINC000672329985 488252008 /nfs/dbraw/zinc/25/20/08/488252008.db2.gz YEOLSJHLMWWXRU-UHFFFAOYSA-N 1 1 236.746 3.506 20 0 BHADMO CC(C)C[N@@H+]1CC=C(c2ccc(F)cc2)CC1 ZINC000672779972 488266281 /nfs/dbraw/zinc/26/62/81/488266281.db2.gz VDHAEAQAFGHZOL-UHFFFAOYSA-N 1 1 233.330 3.571 20 0 BHADMO Cc1ccsc1C[N@H+](C)CCC(C)C ZINC000673084484 488276222 /nfs/dbraw/zinc/27/62/22/488276222.db2.gz JSKSAYJLEUJKBS-UHFFFAOYSA-N 1 1 211.374 3.534 20 0 BHADMO CC[N@@H+](CCC(C)C)Cc1cccc(F)c1 ZINC000673085201 488276318 /nfs/dbraw/zinc/27/63/18/488276318.db2.gz UIBILVYXGNNHJQ-UHFFFAOYSA-N 1 1 223.335 3.694 20 0 BHADMO Cc1ccc(C[N@H+](C)CCC(C)C)c(C)c1 ZINC000673085511 488276015 /nfs/dbraw/zinc/27/60/15/488276015.db2.gz SLDLBYLXIGWTJW-UHFFFAOYSA-N 1 1 219.372 3.781 20 0 BHADMO CC(C)CC[N@H+]1CCc2sccc2[C@H]1C ZINC000673091731 488276809 /nfs/dbraw/zinc/27/68/09/488276809.db2.gz VIAIQUMCONUADO-LLVKDONJSA-N 1 1 223.385 3.713 20 0 BHADMO CC(C)CC[N@H+]1CCc2sccc2[C@@H]1C ZINC000673091732 488276645 /nfs/dbraw/zinc/27/66/45/488276645.db2.gz VIAIQUMCONUADO-NSHDSACASA-N 1 1 223.385 3.713 20 0 BHADMO CC(C)CC[N@@H+](C)[C@H](C)c1ccc(F)cc1 ZINC000673092646 488276617 /nfs/dbraw/zinc/27/66/17/488276617.db2.gz WNRFALBKMZJRNF-GFCCVEGCSA-N 1 1 223.335 3.865 20 0 BHADMO CC(C)CC[N@@H+](C)[C@@H](C)c1ccc(F)cc1 ZINC000673092647 488276831 /nfs/dbraw/zinc/27/68/31/488276831.db2.gz WNRFALBKMZJRNF-LBPRGKRZSA-N 1 1 223.335 3.865 20 0 BHADMO CC(C)CC[N@@H+]1CC=C(c2ccc(F)cc2)CC1 ZINC000673258920 488280603 /nfs/dbraw/zinc/28/06/03/488280603.db2.gz UVXUPCOMXUSOEB-UHFFFAOYSA-N 1 1 247.357 3.961 20 0 BHADMO Cc1ccc(-c2ccc(C[NH2+][C@H](C)CF)o2)cc1 ZINC000673619499 488298169 /nfs/dbraw/zinc/29/81/69/488298169.db2.gz SJEOTECFKWFUPS-GFCCVEGCSA-N 1 1 247.313 3.703 20 0 BHADMO CC(C)c1cc(C[NH2+][C@H](C)c2ccccc2)on1 ZINC000673627750 488298394 /nfs/dbraw/zinc/29/83/94/488298394.db2.gz RYACIAJTWIXOGZ-GFCCVEGCSA-N 1 1 244.338 3.649 20 0 BHADMO CC(C)c1cc(C[NH2+][C@@H](C)c2ccccc2)on1 ZINC000673627752 488298067 /nfs/dbraw/zinc/29/80/67/488298067.db2.gz RYACIAJTWIXOGZ-LBPRGKRZSA-N 1 1 244.338 3.649 20 0 BHADMO CCCc1ccc(C[N@@H+](C)Cc2ccc[nH]2)cc1 ZINC000673857070 488310260 /nfs/dbraw/zinc/31/02/60/488310260.db2.gz BAFTUNXAFQKTPQ-UHFFFAOYSA-N 1 1 242.366 3.599 20 0 BHADMO CC(C)C[N@@H+](C)[C@H](C)c1ncc(C(C)(C)C)o1 ZINC000673893462 488311782 /nfs/dbraw/zinc/31/17/82/488311782.db2.gz GNIRICZWWCNYLM-LLVKDONJSA-N 1 1 238.375 3.621 20 0 BHADMO CC(C)C[N@@H+](C)[C@@H](C)c1ncc(C(C)(C)C)o1 ZINC000673893463 488311797 /nfs/dbraw/zinc/31/17/97/488311797.db2.gz GNIRICZWWCNYLM-NSHDSACASA-N 1 1 238.375 3.621 20 0 BHADMO Fc1cccc([C@H]2CC[N@H+]2CCC(F)(F)F)c1 ZINC000674008862 487498231 /nfs/dbraw/zinc/49/82/31/487498231.db2.gz DKOYJMYIXPVNTK-LLVKDONJSA-N 1 1 247.235 3.525 20 0 BHADMO Fc1cccc([C@H]2CC[N@@H+]2CCC(F)(F)F)c1 ZINC000674008862 487498224 /nfs/dbraw/zinc/49/82/24/487498224.db2.gz DKOYJMYIXPVNTK-LLVKDONJSA-N 1 1 247.235 3.525 20 0 BHADMO Fc1cccc([C@@H]2CC[N@H+]2CCC(F)(F)F)c1 ZINC000674008863 487498461 /nfs/dbraw/zinc/49/84/61/487498461.db2.gz DKOYJMYIXPVNTK-NSHDSACASA-N 1 1 247.235 3.525 20 0 BHADMO Fc1cccc([C@@H]2CC[N@@H+]2CCC(F)(F)F)c1 ZINC000674008863 487498455 /nfs/dbraw/zinc/49/84/55/487498455.db2.gz DKOYJMYIXPVNTK-NSHDSACASA-N 1 1 247.235 3.525 20 0 BHADMO CC(C)=CC[N@H+]1CC[C@H]1c1cccc(F)c1 ZINC000674009055 487498074 /nfs/dbraw/zinc/49/80/74/487498074.db2.gz FAGXWCMUBOSVOF-AWEZNQCLSA-N 1 1 219.303 3.539 20 0 BHADMO CC(C)=CC[N@H+]1CC[C@@H]1c1cccc(F)c1 ZINC000674009056 487497787 /nfs/dbraw/zinc/49/77/87/487497787.db2.gz FAGXWCMUBOSVOF-CQSZACIVSA-N 1 1 219.303 3.539 20 0 BHADMO Fc1cccc([C@@H]2CC[N@H+]2CC2CCCC2)c1 ZINC000674009300 487497849 /nfs/dbraw/zinc/49/78/49/487497849.db2.gz GRMNSNCWYDXKQZ-HNNXBMFYSA-N 1 1 233.330 3.763 20 0 BHADMO Fc1cccc([C@H]2CC[N@H+]2CC2CCCC2)c1 ZINC000674009301 487498436 /nfs/dbraw/zinc/49/84/36/487498436.db2.gz GRMNSNCWYDXKQZ-OAHLLOKOSA-N 1 1 233.330 3.763 20 0 BHADMO Fc1cccc([C@@H]2CC[N@H+]2Cc2ccccc2)c1 ZINC000674009546 487497767 /nfs/dbraw/zinc/49/77/67/487497767.db2.gz JKOWDWNVRFWXNI-INIZCTEOSA-N 1 1 241.309 3.773 20 0 BHADMO Fc1cccc([C@H]2CC[N@H+]2Cc2ccccc2)c1 ZINC000674009547 487497818 /nfs/dbraw/zinc/49/78/18/487497818.db2.gz JKOWDWNVRFWXNI-MRXNPFEDSA-N 1 1 241.309 3.773 20 0 BHADMO Fc1cccc([C@@H]2CC[N@H+]2[C@@H]2C=CCCC2)c1 ZINC000674009620 487497720 /nfs/dbraw/zinc/49/77/20/487497720.db2.gz KSWLBBCBCSIVNH-CABCVRRESA-N 1 1 231.314 3.681 20 0 BHADMO Fc1cccc([C@@H]2CC[N@H+]2[C@H]2C=CCCC2)c1 ZINC000674009621 487498627 /nfs/dbraw/zinc/49/86/27/487498627.db2.gz KSWLBBCBCSIVNH-GJZGRUSLSA-N 1 1 231.314 3.681 20 0 BHADMO Fc1cccc([C@H]2CC[N@H+]2[C@@H]2C=CCCC2)c1 ZINC000674009622 487498689 /nfs/dbraw/zinc/49/86/89/487498689.db2.gz KSWLBBCBCSIVNH-HUUCEWRRSA-N 1 1 231.314 3.681 20 0 BHADMO Fc1cccc([C@H]2CC[N@H+]2[C@H]2C=CCCC2)c1 ZINC000674009623 487497690 /nfs/dbraw/zinc/49/76/90/487497690.db2.gz KSWLBBCBCSIVNH-LSDHHAIUSA-N 1 1 231.314 3.681 20 0 BHADMO CC(C)C[N@H+]1CC(C)(C)[C@@H]1c1ccccc1 ZINC000674010031 487498518 /nfs/dbraw/zinc/49/85/18/487498518.db2.gz NQILBDHKBTUCQO-AWEZNQCLSA-N 1 1 217.356 3.726 20 0 BHADMO CC(C)C[N@H+]1CC(C)(C)[C@H]1c1ccccc1 ZINC000674010037 487498419 /nfs/dbraw/zinc/49/84/19/487498419.db2.gz NQILBDHKBTUCQO-CQSZACIVSA-N 1 1 217.356 3.726 20 0 BHADMO CCCCC[N@H+]1CC[C@H]1c1cccc(F)c1 ZINC000674011046 487497956 /nfs/dbraw/zinc/49/79/56/487497956.db2.gz UGRMDHVUCWICST-AWEZNQCLSA-N 1 1 221.319 3.763 20 0 BHADMO CCCCC[N@H+]1CC[C@@H]1c1cccc(F)c1 ZINC000674011050 487498548 /nfs/dbraw/zinc/49/85/48/487498548.db2.gz UGRMDHVUCWICST-CQSZACIVSA-N 1 1 221.319 3.763 20 0 BHADMO CC(C)CC[N@H+]1CC[C@H]1c1cccc(F)c1 ZINC000674013264 487501167 /nfs/dbraw/zinc/50/11/67/487501167.db2.gz MSSBWHZHTGNFRE-AWEZNQCLSA-N 1 1 221.319 3.619 20 0 BHADMO CC(C)CC[N@H+]1CC[C@@H]1c1cccc(F)c1 ZINC000674013265 487501417 /nfs/dbraw/zinc/50/14/17/487501417.db2.gz MSSBWHZHTGNFRE-CQSZACIVSA-N 1 1 221.319 3.619 20 0 BHADMO C[C@@H](c1ccncc1)[N@H+]1CC[C@H]1c1ccccc1 ZINC000674047239 487503472 /nfs/dbraw/zinc/50/34/72/487503472.db2.gz IBOMEAXPKJUYMR-BBRMVZONSA-N 1 1 238.334 3.590 20 0 BHADMO C[C@H](c1ccncc1)[N@H+]1CC[C@H]1c1ccccc1 ZINC000674047240 487504167 /nfs/dbraw/zinc/50/41/67/487504167.db2.gz IBOMEAXPKJUYMR-CJNGLKHVSA-N 1 1 238.334 3.590 20 0 BHADMO C[C@H](c1ccncc1)[N@H+]1CC[C@@H]1c1ccccc1 ZINC000674047241 487503493 /nfs/dbraw/zinc/50/34/93/487503493.db2.gz IBOMEAXPKJUYMR-CZUORRHYSA-N 1 1 238.334 3.590 20 0 BHADMO C[C@@H](c1ccncc1)[N@H+]1CC[C@@H]1c1ccccc1 ZINC000674047242 487504083 /nfs/dbraw/zinc/50/40/83/487504083.db2.gz IBOMEAXPKJUYMR-XJKSGUPXSA-N 1 1 238.334 3.590 20 0 BHADMO CC[C@@H](C)C[N@@H+](CC)[C@H](C)c1ccncc1 ZINC000674047518 487504052 /nfs/dbraw/zinc/50/40/52/487504052.db2.gz KSSQVHNXSAQGQX-CHWSQXEVSA-N 1 1 220.360 3.511 20 0 BHADMO CC[C@@H](C)C[N@@H+](CC)[C@@H](C)c1ccncc1 ZINC000674047519 487503796 /nfs/dbraw/zinc/50/37/96/487503796.db2.gz KSSQVHNXSAQGQX-OLZOCXBDSA-N 1 1 220.360 3.511 20 0 BHADMO CC[C@H](C)C[N@@H+](CC)[C@H](C)c1ccncc1 ZINC000674047520 487503922 /nfs/dbraw/zinc/50/39/22/487503922.db2.gz KSSQVHNXSAQGQX-QWHCGFSZSA-N 1 1 220.360 3.511 20 0 BHADMO CC[C@H](C)C[N@@H+](CC)[C@@H](C)c1ccncc1 ZINC000674047521 487504072 /nfs/dbraw/zinc/50/40/72/487504072.db2.gz KSSQVHNXSAQGQX-STQMWFEESA-N 1 1 220.360 3.511 20 0 BHADMO C[C@H](c1ccccc1)[N@@H+](C)Cc1ccc(O)cc1 ZINC000674284737 487545633 /nfs/dbraw/zinc/54/56/33/487545633.db2.gz YQUONBIWPKFCLW-CYBMUJFWSA-N 1 1 241.334 3.585 20 0 BHADMO C[C@@H](c1ccccc1)[N@@H+](C)Cc1ccc(O)cc1 ZINC000674284738 487545797 /nfs/dbraw/zinc/54/57/97/487545797.db2.gz YQUONBIWPKFCLW-ZDUSSCGKSA-N 1 1 241.334 3.585 20 0 BHADMO 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ZINC000674766607 488153123 /nfs/dbraw/zinc/15/31/23/488153123.db2.gz DJUDOEDYKCGHPY-AWEZNQCLSA-N 1 1 247.382 3.502 20 0 BHADMO CCc1cccc(OCC[N@H+]2CCCC[C@H]2C)c1 ZINC000674766608 488152659 /nfs/dbraw/zinc/15/26/59/488152659.db2.gz DJUDOEDYKCGHPY-CQSZACIVSA-N 1 1 247.382 3.502 20 0 BHADMO CC(C)=CC[N@@H+](Cc1ccccc1)C(C)C ZINC000674767000 488153368 /nfs/dbraw/zinc/15/33/68/488153368.db2.gz ZLTJECDQBYUJNQ-UHFFFAOYSA-N 1 1 217.356 3.863 20 0 BHADMO CCCC[N@@H+](CC)Cc1cc(C)ccc1OC ZINC000674767079 487615943 /nfs/dbraw/zinc/61/59/43/487615943.db2.gz YKTKQCYNDIPCEV-UHFFFAOYSA-N 1 1 235.371 3.626 20 0 BHADMO CC(C)=CC[N@H+](C)[C@H]1CCCc2ccccc21 ZINC000674771288 487616079 /nfs/dbraw/zinc/61/60/79/487616079.db2.gz IUVNGNJPJRKMNE-INIZCTEOSA-N 1 1 229.367 3.962 20 0 BHADMO CC(C)=CC[N@H+](C)[C@@H]1CCCc2ccccc21 ZINC000674771289 487615901 /nfs/dbraw/zinc/61/59/01/487615901.db2.gz IUVNGNJPJRKMNE-MRXNPFEDSA-N 1 1 229.367 3.962 20 0 BHADMO CCC[N@H+](Cc1cc(C)ccc1OC)CC1CC1 ZINC000674786982 487618494 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487648729 /nfs/dbraw/zinc/64/87/29/487648729.db2.gz DETNVKMUZUWYPJ-UHFFFAOYSA-N 1 1 241.419 3.845 20 0 BHADMO CC(C)C[C@@H]1CCC[N@H+]1CCCOC(C)(C)C ZINC000674906301 487648753 /nfs/dbraw/zinc/64/87/53/487648753.db2.gz ZRLXXWWVVRFQQL-AWEZNQCLSA-N 1 1 241.419 3.702 20 0 BHADMO CC(C)C[C@H]1CCC[N@H+]1CCCOC(C)(C)C ZINC000674906302 487648884 /nfs/dbraw/zinc/64/88/84/487648884.db2.gz ZRLXXWWVVRFQQL-CQSZACIVSA-N 1 1 241.419 3.702 20 0 BHADMO CC(C)(C)OCCC[N@H+]1CCC[C@@H]1C(C)(C)C ZINC000674907236 487649201 /nfs/dbraw/zinc/64/92/01/487649201.db2.gz RTWPPTMORGFUJH-CYBMUJFWSA-N 1 1 241.419 3.702 20 0 BHADMO CC(C)(C)OCCC[N@H+]1CCC[C@H]1C(C)(C)C ZINC000674907237 487645277 /nfs/dbraw/zinc/64/52/77/487645277.db2.gz RTWPPTMORGFUJH-ZDUSSCGKSA-N 1 1 241.419 3.702 20 0 BHADMO CCC[N@@H+](CCCOC(C)(C)C)CC(C)C ZINC000674907800 487650189 /nfs/dbraw/zinc/65/01/89/487650189.db2.gz YWRHABXRSMNLFS-UHFFFAOYSA-N 1 1 229.408 3.560 20 0 BHADMO CC[N@@H+](CCCOC(C)(C)C)[C@H](C)C(C)C ZINC000674907822 487645193 /nfs/dbraw/zinc/64/51/93/487645193.db2.gz FNTILPCTYSPNRU-CYBMUJFWSA-N 1 1 229.408 3.558 20 0 BHADMO CC[N@@H+](CCCOC(C)(C)C)[C@@H](C)C(C)C ZINC000674907824 487644712 /nfs/dbraw/zinc/64/47/12/487644712.db2.gz FNTILPCTYSPNRU-ZDUSSCGKSA-N 1 1 229.408 3.558 20 0 BHADMO CC(C)[C@@H]1CCCC[N@H+]1CCCOC(C)(C)C ZINC000674908301 487649973 /nfs/dbraw/zinc/64/99/73/487649973.db2.gz LXYBBJWZBZWHSW-AWEZNQCLSA-N 1 1 241.419 3.702 20 0 BHADMO CC(C)[C@H]1CCCC[N@H+]1CCCOC(C)(C)C ZINC000674908302 487650969 /nfs/dbraw/zinc/65/09/69/487650969.db2.gz LXYBBJWZBZWHSW-CQSZACIVSA-N 1 1 241.419 3.702 20 0 BHADMO CC(C)(C)OCCC[N@H+]1CCCC(C)(C)CC1 ZINC000674908463 487724008 /nfs/dbraw/zinc/72/40/08/487724008.db2.gz CZUJCFKWWGATIY-UHFFFAOYSA-N 1 1 241.419 3.704 20 0 BHADMO CC[C@H]1CCCCC[N@H+]1CCCOC(C)(C)C ZINC000674908660 487650229 /nfs/dbraw/zinc/65/02/29/487650229.db2.gz HFOAPVPMTCIJCQ-AWEZNQCLSA-N 1 1 241.419 3.846 20 0 BHADMO CC[C@@H]1CCCCC[N@H+]1CCCOC(C)(C)C ZINC000674908661 487650955 /nfs/dbraw/zinc/65/09/55/487650955.db2.gz HFOAPVPMTCIJCQ-CQSZACIVSA-N 1 1 241.419 3.846 20 0 BHADMO CC[C@H]1CCC[N@@H+](CCCOC(C)(C)C)CC1 ZINC000674909031 487652307 /nfs/dbraw/zinc/65/23/07/487652307.db2.gz WFQVEOFQDZARFJ-AWEZNQCLSA-N 1 1 241.419 3.704 20 0 BHADMO CC[C@@H]1CCC[N@@H+](CCCOC(C)(C)C)CC1 ZINC000674909032 487652441 /nfs/dbraw/zinc/65/24/41/487652441.db2.gz WFQVEOFQDZARFJ-CQSZACIVSA-N 1 1 241.419 3.704 20 0 BHADMO C[C@H]1CCC[C@H](C)[N@@H+](CCCOC(C)(C)C)C1 ZINC000674909282 487649650 /nfs/dbraw/zinc/64/96/50/487649650.db2.gz NXCCIADSKWYHDI-KBPBESRZSA-N 1 1 241.419 3.702 20 0 BHADMO C[C@@H]1CCC[C@H](C)[N@@H+](CCCOC(C)(C)C)C1 ZINC000674909283 487649538 /nfs/dbraw/zinc/64/95/38/487649538.db2.gz NXCCIADSKWYHDI-KGLIPLIRSA-N 1 1 241.419 3.702 20 0 BHADMO C[C@@H]1CCC[C@H](C)C[N@@H+]1CCCOC(C)(C)C ZINC000674909284 487649006 /nfs/dbraw/zinc/64/90/06/487649006.db2.gz NXCCIADSKWYHDI-UONOGXRCSA-N 1 1 241.419 3.702 20 0 BHADMO C[C@@H]1CCC[C@@H](C)[N@@H+](CCCOC(C)(C)C)C1 ZINC000674909285 487649576 /nfs/dbraw/zinc/64/95/76/487649576.db2.gz NXCCIADSKWYHDI-ZIAGYGMSSA-N 1 1 241.419 3.702 20 0 BHADMO CC(C)C[C@@H]1CC[N@@H+](CCCOC(C)(C)C)C1 ZINC000674909341 487651693 /nfs/dbraw/zinc/65/16/93/487651693.db2.gz JUYZHAIYFHAWGK-AWEZNQCLSA-N 1 1 241.419 3.560 20 0 BHADMO CC(C)C[C@H]1CC[N@@H+](CCCOC(C)(C)C)C1 ZINC000674909342 487652052 /nfs/dbraw/zinc/65/20/52/487652052.db2.gz JUYZHAIYFHAWGK-CQSZACIVSA-N 1 1 241.419 3.560 20 0 BHADMO CC[C@@]1(C)CCC[N@@H+](CCCOC(C)(C)C)C1 ZINC000674909432 487652413 /nfs/dbraw/zinc/65/24/13/487652413.db2.gz PEKZMIHJSGZDCE-HNNXBMFYSA-N 1 1 241.419 3.704 20 0 BHADMO CC[C@]1(C)CCC[N@@H+](CCCOC(C)(C)C)C1 ZINC000674909434 487651597 /nfs/dbraw/zinc/65/15/97/487651597.db2.gz PEKZMIHJSGZDCE-OAHLLOKOSA-N 1 1 241.419 3.704 20 0 BHADMO CC[C@@H](C)C[N@@H+](CC)CCCOC(C)(C)C ZINC000674909856 487652383 /nfs/dbraw/zinc/65/23/83/487652383.db2.gz WBEFRPSPGSAMRW-CYBMUJFWSA-N 1 1 229.408 3.560 20 0 BHADMO CC[C@H](C)C[N@@H+](CC)CCCOC(C)(C)C ZINC000674909858 487651789 /nfs/dbraw/zinc/65/17/89/487651789.db2.gz WBEFRPSPGSAMRW-ZDUSSCGKSA-N 1 1 229.408 3.560 20 0 BHADMO CC(C)(C)OCCC[N@H+]1CC[C@H]1c1ccccc1 ZINC000674910065 487730012 /nfs/dbraw/zinc/73/00/12/487730012.db2.gz ZDKCYWGMMPYYKL-HNNXBMFYSA-N 1 1 247.382 3.639 20 0 BHADMO CC(C)(C)OCCC[N@H+]1CC[C@@H]1c1ccccc1 ZINC000674910066 487730347 /nfs/dbraw/zinc/73/03/47/487730347.db2.gz ZDKCYWGMMPYYKL-OAHLLOKOSA-N 1 1 247.382 3.639 20 0 BHADMO CCC1(CC)CC[N@@H+](CCCOC(C)(C)C)C1 ZINC000674911087 487653996 /nfs/dbraw/zinc/65/39/96/487653996.db2.gz WHIHDXDBGRIVQX-UHFFFAOYSA-N 1 1 241.419 3.704 20 0 BHADMO COc1ccccc1C[N@@H+](C)CCC(C)(C)C ZINC000674995719 487663300 /nfs/dbraw/zinc/66/33/00/487663300.db2.gz CZKXCYRCBJUPIH-UHFFFAOYSA-N 1 1 235.371 3.563 20 0 BHADMO CCc1ccc(C[N@@H+](C)CCC(C)C)cc1 ZINC000675002544 487664279 /nfs/dbraw/zinc/66/42/79/487664279.db2.gz HOBDHFQLPBDNNU-UHFFFAOYSA-N 1 1 219.372 3.727 20 0 BHADMO CCc1ccc(C[N@@H+](C)CC=C(C)C)cc1 ZINC000675004067 487664269 /nfs/dbraw/zinc/66/42/69/487664269.db2.gz SXQLKARUDVBWER-UHFFFAOYSA-N 1 1 217.356 3.647 20 0 BHADMO CSc1ccc(C[N@@H+](C)CCC(C)C)cc1 ZINC000675052081 487860058 /nfs/dbraw/zinc/86/00/58/487860058.db2.gz ALFWKIMONDDTMJ-UHFFFAOYSA-N 1 1 237.412 3.886 20 0 BHADMO CC(C)CC[N@@H+](C)Cc1c(F)cccc1Cl ZINC000675052449 490339082 /nfs/dbraw/zinc/33/90/82/490339082.db2.gz YPOOYUQMXITJSU-UHFFFAOYSA-N 1 1 243.753 3.957 20 0 BHADMO CC(C)CC[N@H+](C)Cc1c(F)cccc1Cl ZINC000675052449 490339075 /nfs/dbraw/zinc/33/90/75/490339075.db2.gz YPOOYUQMXITJSU-UHFFFAOYSA-N 1 1 243.753 3.957 20 0 BHADMO Cc1ccc(C[N@@H+](C)CCC(C)(C)C)cc1 ZINC000675056627 487666275 /nfs/dbraw/zinc/66/62/75/487666275.db2.gz CLWCAHXRSYDSOA-UHFFFAOYSA-N 1 1 219.372 3.863 20 0 BHADMO COCC[N@@H+](CCC(C)(C)C)Cc1ccccc1 ZINC000675056802 487665889 /nfs/dbraw/zinc/66/58/89/487665889.db2.gz JDBVXMNEWNCQTB-UHFFFAOYSA-N 1 1 249.398 3.571 20 0 BHADMO C[N@@H+](CCC(C)(C)C)Cc1ccccc1F ZINC000675057287 487665801 /nfs/dbraw/zinc/66/58/01/487665801.db2.gz YRNLYKGHEXWGAA-UHFFFAOYSA-N 1 1 223.335 3.694 20 0 BHADMO CCC[C@H]1CCC[N@H+]([C@@H](C)c2ccncc2)C1 ZINC000675125719 487672463 /nfs/dbraw/zinc/67/24/63/487672463.db2.gz WZHHUOCCLAZXNA-KBPBESRZSA-N 1 1 232.371 3.655 20 0 BHADMO CCC[C@H]1CCC[N@H+]([C@H](C)c2ccncc2)C1 ZINC000675125720 487673003 /nfs/dbraw/zinc/67/30/03/487673003.db2.gz WZHHUOCCLAZXNA-KGLIPLIRSA-N 1 1 232.371 3.655 20 0 BHADMO CCC[C@@H]1CCC[N@H+]([C@@H](C)c2ccncc2)C1 ZINC000675125721 487672758 /nfs/dbraw/zinc/67/27/58/487672758.db2.gz WZHHUOCCLAZXNA-UONOGXRCSA-N 1 1 232.371 3.655 20 0 BHADMO CCC[C@@H]1CCC[N@H+]([C@H](C)c2ccncc2)C1 ZINC000675125722 487672860 /nfs/dbraw/zinc/67/28/60/487672860.db2.gz WZHHUOCCLAZXNA-ZIAGYGMSSA-N 1 1 232.371 3.655 20 0 BHADMO CCC[C@H]1CCC[N@@H+](CCCOC(C)(C)C)C1 ZINC000675125783 487673038 /nfs/dbraw/zinc/67/30/38/487673038.db2.gz ZVBJSVGLERDJJU-AWEZNQCLSA-N 1 1 241.419 3.704 20 0 BHADMO CCC[C@@H]1CCC[N@@H+](CCCOC(C)(C)C)C1 ZINC000675125784 487672967 /nfs/dbraw/zinc/67/29/67/487672967.db2.gz ZVBJSVGLERDJJU-CQSZACIVSA-N 1 1 241.419 3.704 20 0 BHADMO CC(C)C[C@@H]1CCC[N@H+]([C@H](C)c2ccncc2)C1 ZINC000675250728 487684245 /nfs/dbraw/zinc/68/42/45/487684245.db2.gz TYFPUKYEAKJBCV-CABCVRRESA-N 1 1 246.398 3.901 20 0 BHADMO CC(C)C[C@@H]1CCC[N@H+]([C@@H](C)c2ccncc2)C1 ZINC000675250733 487684491 /nfs/dbraw/zinc/68/44/91/487684491.db2.gz TYFPUKYEAKJBCV-GJZGRUSLSA-N 1 1 246.398 3.901 20 0 BHADMO CC(C)C[C@H]1CCC[N@H+]([C@H](C)c2ccncc2)C1 ZINC000675250736 487684453 /nfs/dbraw/zinc/68/44/53/487684453.db2.gz TYFPUKYEAKJBCV-HUUCEWRRSA-N 1 1 246.398 3.901 20 0 BHADMO CC(C)C[C@H]1CCC[N@H+]([C@@H](C)c2ccncc2)C1 ZINC000675250737 487684351 /nfs/dbraw/zinc/68/43/51/487684351.db2.gz TYFPUKYEAKJBCV-LSDHHAIUSA-N 1 1 246.398 3.901 20 0 BHADMO Cc1cc[nH+]c(N[C@@H]2C[C@]2(C)c2ccccc2)c1 ZINC000675287791 487689368 /nfs/dbraw/zinc/68/93/68/487689368.db2.gz NNBBJXAXHNRNFQ-GDBMZVCRSA-N 1 1 238.334 3.532 20 0 BHADMO Cc1cc[nH+]c(N[C@H]2C[C@]2(C)c2ccccc2)c1 ZINC000675287792 487689671 /nfs/dbraw/zinc/68/96/71/487689671.db2.gz NNBBJXAXHNRNFQ-GOEBONIOSA-N 1 1 238.334 3.532 20 0 BHADMO Cc1cc[nH+]c(N[C@H]2C[C@@]2(C)c2ccccc2)c1 ZINC000675287793 487688870 /nfs/dbraw/zinc/68/88/70/487688870.db2.gz NNBBJXAXHNRNFQ-HOCLYGCPSA-N 1 1 238.334 3.532 20 0 BHADMO Cc1cc[nH+]c(N[C@@H]2C[C@@]2(C)c2ccccc2)c1 ZINC000675287794 487689594 /nfs/dbraw/zinc/68/95/94/487689594.db2.gz NNBBJXAXHNRNFQ-ZBFHGGJFSA-N 1 1 238.334 3.532 20 0 BHADMO CC(C)CC[C@H]1CCCC[N@H+]1CC(F)F ZINC000675509587 487743698 /nfs/dbraw/zinc/74/36/98/487743698.db2.gz VOBPEGVVQPCKRC-LLVKDONJSA-N 1 1 219.319 3.542 20 0 BHADMO CC(C)CC[C@H]1CCCC[N@@H+]1CC(F)F ZINC000675509587 487743693 /nfs/dbraw/zinc/74/36/93/487743693.db2.gz VOBPEGVVQPCKRC-LLVKDONJSA-N 1 1 219.319 3.542 20 0 BHADMO CC(C)CC[C@@H]1CCCC[N@H+]1CC(F)F ZINC000675509592 487743562 /nfs/dbraw/zinc/74/35/62/487743562.db2.gz VOBPEGVVQPCKRC-NSHDSACASA-N 1 1 219.319 3.542 20 0 BHADMO CC(C)CC[C@@H]1CCCC[N@@H+]1CC(F)F ZINC000675509592 487743558 /nfs/dbraw/zinc/74/35/58/487743558.db2.gz VOBPEGVVQPCKRC-NSHDSACASA-N 1 1 219.319 3.542 20 0 BHADMO Cc1ccc(C[N@H+](C(C)C)C2CCCC2)cn1 ZINC000675515637 487744463 /nfs/dbraw/zinc/74/44/63/487744463.db2.gz HSFFWQFKSPZUHH-UHFFFAOYSA-N 1 1 232.371 3.543 20 0 BHADMO COc1ccccc1[C@@H]1CCCC[N@H+]1CC1CC1 ZINC000675639551 487757256 /nfs/dbraw/zinc/75/72/56/487757256.db2.gz NXXIPOMOXWOGJR-HNNXBMFYSA-N 1 1 245.366 3.632 20 0 BHADMO COc1ccccc1[C@H]1CCCC[N@H+]1CC1CC1 ZINC000675639552 487757332 /nfs/dbraw/zinc/75/73/32/487757332.db2.gz NXXIPOMOXWOGJR-OAHLLOKOSA-N 1 1 245.366 3.632 20 0 BHADMO COc1cccc(C[N@@H+](CC(C)C)CC2CC2)c1 ZINC000675640415 487758028 /nfs/dbraw/zinc/75/80/28/487758028.db2.gz YWFBBVYMJZLCKU-UHFFFAOYSA-N 1 1 247.382 3.563 20 0 BHADMO CCO[C@H]1CCC[N@H+]([C@H](C)c2ccccc2C)C1 ZINC000675730640 487771904 /nfs/dbraw/zinc/77/19/04/487771904.db2.gz HFSFYXREJIIHHN-CABCVRRESA-N 1 1 247.382 3.557 20 0 BHADMO CCO[C@@H]1CCC[N@H+]([C@H](C)c2ccccc2C)C1 ZINC000675730643 487771995 /nfs/dbraw/zinc/77/19/95/487771995.db2.gz HFSFYXREJIIHHN-HUUCEWRRSA-N 1 1 247.382 3.557 20 0 BHADMO CCc1ccc([C@H](C)[NH2+]Cc2ccoc2C)o1 ZINC000675778893 487777979 /nfs/dbraw/zinc/77/79/79/487777979.db2.gz AMMYMMVHECJQOT-JTQLQIEISA-N 1 1 233.311 3.594 20 0 BHADMO CCc1ccc([C@@H](C)[NH2+]Cc2ccoc2C)o1 ZINC000675778894 487778069 /nfs/dbraw/zinc/77/80/69/487778069.db2.gz AMMYMMVHECJQOT-SNVBAGLBSA-N 1 1 233.311 3.594 20 0 BHADMO CC(C)OCC[N@@H+](C)Cc1ccc(C(C)C)cc1 ZINC000675795598 487780528 /nfs/dbraw/zinc/78/05/28/487780528.db2.gz ZZRHNENIKPIVEH-UHFFFAOYSA-N 1 1 249.398 3.667 20 0 BHADMO CCC[C@@H]([NH2+][C@@H](C)c1ccco1)c1ccccn1 ZINC000675816012 487782277 /nfs/dbraw/zinc/78/22/77/487782277.db2.gz JDTCYAYATVJYFF-GXTWGEPZSA-N 1 1 244.338 3.867 20 0 BHADMO CCC[C@H]([NH2+][C@@H](C)c1ccco1)c1ccccn1 ZINC000675816013 487782074 /nfs/dbraw/zinc/78/20/74/487782074.db2.gz JDTCYAYATVJYFF-JSGCOSHPSA-N 1 1 244.338 3.867 20 0 BHADMO CCC[C@H]([NH2+][C@H](C)c1ccco1)c1ccccn1 ZINC000675816014 488128092 /nfs/dbraw/zinc/12/80/92/488128092.db2.gz JDTCYAYATVJYFF-OCCSQVGLSA-N 1 1 244.338 3.867 20 0 BHADMO CCC[C@@H]([NH2+][C@H](C)c1ccco1)c1ccccn1 ZINC000675816015 488127919 /nfs/dbraw/zinc/12/79/19/488127919.db2.gz JDTCYAYATVJYFF-TZMCWYRMSA-N 1 1 244.338 3.867 20 0 BHADMO CC(C)=CC[N@H+](C)Cc1cccc(Cl)c1 ZINC000675838716 487784061 /nfs/dbraw/zinc/78/40/61/487784061.db2.gz MIGKWCDWGZSDRC-UHFFFAOYSA-N 1 1 223.747 3.738 20 0 BHADMO CCC[N@@H+](CC=C(C)C)Cc1ccccc1 ZINC000675838778 487783841 /nfs/dbraw/zinc/78/38/41/487783841.db2.gz NJANQNCQQVQJMT-UHFFFAOYSA-N 1 1 217.356 3.865 20 0 BHADMO CC(C)[C@H]1c2ccccc2CC[N@@H+]1CCCF ZINC000675893637 487788928 /nfs/dbraw/zinc/78/89/28/487788928.db2.gz NUCBYACBFMOCJO-HNNXBMFYSA-N 1 1 235.346 3.601 20 0 BHADMO CC(C)[C@@H]1c2ccccc2CC[N@@H+]1CCCF ZINC000675893638 487788432 /nfs/dbraw/zinc/78/84/32/487788432.db2.gz NUCBYACBFMOCJO-OAHLLOKOSA-N 1 1 235.346 3.601 20 0 BHADMO Cc1ccccc1[C@H](C)[N@H+]1CCCOC(C)(C)C1 ZINC000675965071 487796427 /nfs/dbraw/zinc/79/64/27/487796427.db2.gz MCGBRTVRRGJTNX-AWEZNQCLSA-N 1 1 247.382 3.557 20 0 BHADMO Cc1ccccc1[C@@H](C)[N@H+]1CCCOC(C)(C)C1 ZINC000675965072 487796893 /nfs/dbraw/zinc/79/68/93/487796893.db2.gz MCGBRTVRRGJTNX-CQSZACIVSA-N 1 1 247.382 3.557 20 0 BHADMO c1c2ccccc2oc1C[N@H+]1CCC[C@H]1C1CC1 ZINC000676040107 487802686 /nfs/dbraw/zinc/80/26/86/487802686.db2.gz RVULYJDZTKCTPK-HNNXBMFYSA-N 1 1 241.334 3.807 20 0 BHADMO c1c2ccccc2oc1C[N@H+]1CCC[C@@H]1C1CC1 ZINC000676040108 487803145 /nfs/dbraw/zinc/80/31/45/487803145.db2.gz RVULYJDZTKCTPK-OAHLLOKOSA-N 1 1 241.334 3.807 20 0 BHADMO Cc1cccc([C@H](C)[N@@H+](C)CCOC(C)(C)C)c1 ZINC000676042086 487804647 /nfs/dbraw/zinc/80/46/47/487804647.db2.gz FGPVOSLTQCIIIK-AWEZNQCLSA-N 1 1 249.398 3.803 20 0 BHADMO Cc1cccc([C@@H](C)[N@@H+](C)CCOC(C)(C)C)c1 ZINC000676042089 487804660 /nfs/dbraw/zinc/80/46/60/487804660.db2.gz FGPVOSLTQCIIIK-CQSZACIVSA-N 1 1 249.398 3.803 20 0 BHADMO CCC(C)(C)CC[N@@H+](C)CCOC(C)(C)C ZINC000676042252 487804194 /nfs/dbraw/zinc/80/41/94/487804194.db2.gz HKKONAFPUFKUNE-UHFFFAOYSA-N 1 1 229.408 3.560 20 0 BHADMO Cc1cccc(C)c1C[N@@H+](C)CCOC(C)(C)C ZINC000676043059 487804562 /nfs/dbraw/zinc/80/45/62/487804562.db2.gz JURNCDDORGRGQK-UHFFFAOYSA-N 1 1 249.398 3.550 20 0 BHADMO CC(C)CC[N@@H+](C)[C@H]1C[C@@H]1c1ccccc1 ZINC000676043540 487802014 /nfs/dbraw/zinc/80/20/14/487802014.db2.gz GQVLDUREAYYYRY-CABCVRRESA-N 1 1 217.356 3.520 20 0 BHADMO CC(C)CC[N@@H+](C)[C@H]1C[C@H]1c1ccccc1 ZINC000676043541 487802056 /nfs/dbraw/zinc/80/20/56/487802056.db2.gz GQVLDUREAYYYRY-GJZGRUSLSA-N 1 1 217.356 3.520 20 0 BHADMO CC(C)CC[N@@H+](C)[C@@H]1C[C@@H]1c1ccccc1 ZINC000676043542 487802023 /nfs/dbraw/zinc/80/20/23/487802023.db2.gz GQVLDUREAYYYRY-HUUCEWRRSA-N 1 1 217.356 3.520 20 0 BHADMO CC(C)CC[N@@H+](C)[C@@H]1C[C@H]1c1ccccc1 ZINC000676043543 487801979 /nfs/dbraw/zinc/80/19/79/487801979.db2.gz GQVLDUREAYYYRY-LSDHHAIUSA-N 1 1 217.356 3.520 20 0 BHADMO C[N@@H+](CC1CCCC1)[C@H]1C[C@@H]1c1ccccc1 ZINC000676043867 488157134 /nfs/dbraw/zinc/15/71/34/488157134.db2.gz QXLHWYMCJCRJJY-CVEARBPZSA-N 1 1 229.367 3.665 20 0 BHADMO C[N@@H+](CC1CCCC1)[C@H]1C[C@H]1c1ccccc1 ZINC000676043872 488157040 /nfs/dbraw/zinc/15/70/40/488157040.db2.gz QXLHWYMCJCRJJY-HOTGVXAUSA-N 1 1 229.367 3.665 20 0 BHADMO C[N@@H+](CC1CCCC1)[C@@H]1C[C@@H]1c1ccccc1 ZINC000676043878 488157301 /nfs/dbraw/zinc/15/73/01/488157301.db2.gz QXLHWYMCJCRJJY-HZPDHXFCSA-N 1 1 229.367 3.665 20 0 BHADMO C[N@@H+](CC1CCCC1)[C@@H]1C[C@H]1c1ccccc1 ZINC000676043880 488157172 /nfs/dbraw/zinc/15/71/72/488157172.db2.gz QXLHWYMCJCRJJY-JKSUJKDBSA-N 1 1 229.367 3.665 20 0 BHADMO CC(C)=CC[N@H+]1CCC[C@H](Nc2ccccc2)C1 ZINC000676085336 487812966 /nfs/dbraw/zinc/81/29/66/487812966.db2.gz CFCFDBJZLTVZKV-INIZCTEOSA-N 1 1 244.382 3.529 20 0 BHADMO CC(C)=CC[N@H+]1CCC[C@@H](Nc2ccccc2)C1 ZINC000676085341 487812407 /nfs/dbraw/zinc/81/24/07/487812407.db2.gz CFCFDBJZLTVZKV-MRXNPFEDSA-N 1 1 244.382 3.529 20 0 BHADMO Cc1cc[nH+]c(NCc2ccc3cccnc3c2)c1 ZINC000676198503 487820372 /nfs/dbraw/zinc/82/03/72/487820372.db2.gz HNUFLVJEVHMAQB-UHFFFAOYSA-N 1 1 249.317 3.550 20 0 BHADMO Cc1ccc[nH+]c1NCc1ccccc1C1CC1 ZINC000676198992 487819920 /nfs/dbraw/zinc/81/99/20/487819920.db2.gz RDVYTXOTJSJPSL-UHFFFAOYSA-N 1 1 238.334 3.880 20 0 BHADMO Cc1cccc(NCc2ccc3cccnc3c2)[nH+]1 ZINC000676199159 487820129 /nfs/dbraw/zinc/82/01/29/487820129.db2.gz NZVDEHCNKGNXSS-UHFFFAOYSA-N 1 1 249.317 3.550 20 0 BHADMO Cc1cn(Cc2ccc(C(C)(C)C)cc2)c(C)[nH+]1 ZINC000676199322 487819869 /nfs/dbraw/zinc/81/98/69/487819869.db2.gz QVRCKRQUQWOCDO-UHFFFAOYSA-N 1 1 242.366 3.846 20 0 BHADMO CC[C@@H](c1ccccc1)[N@@H+](CC)C(C)C ZINC000676409602 487849006 /nfs/dbraw/zinc/84/90/06/487849006.db2.gz OUVJSGBCDGQIJU-AWEZNQCLSA-N 1 1 205.345 3.868 20 0 BHADMO CC[C@H](c1ccccc1)[N@@H+](CC)C(C)C ZINC000676409603 487848585 /nfs/dbraw/zinc/84/85/85/487848585.db2.gz OUVJSGBCDGQIJU-CQSZACIVSA-N 1 1 205.345 3.868 20 0 BHADMO Cc1cc(F)ccc1C[N@@H+](C)Cc1ccccc1 ZINC000676412458 487848973 /nfs/dbraw/zinc/84/89/73/487848973.db2.gz JZPCYWPFATYIGD-UHFFFAOYSA-N 1 1 243.325 3.766 20 0 BHADMO CCC[N@@H+](CC)Cc1ccccc1C1CC1 ZINC000676413324 487848342 /nfs/dbraw/zinc/84/83/42/487848342.db2.gz BSZZBIIQXCSTAL-UHFFFAOYSA-N 1 1 217.356 3.796 20 0 BHADMO Cc1ccncc1C[N@@H+](C1CC1)C1CCCCC1 ZINC000676556229 487871745 /nfs/dbraw/zinc/87/17/45/487871745.db2.gz PFCGYMDVKVFCDS-UHFFFAOYSA-N 1 1 244.382 3.687 20 0 BHADMO Cc1ccc(C[N@@H+](C2CC2)C2CCCCC2)nc1 ZINC000676556551 487871663 /nfs/dbraw/zinc/87/16/63/487871663.db2.gz UOMKRIBYWQDMNR-UHFFFAOYSA-N 1 1 244.382 3.687 20 0 BHADMO Cc1ccc(C[N@H+](C)CC2CCC(C)CC2)nc1 ZINC000676625041 487880890 /nfs/dbraw/zinc/88/08/90/487880890.db2.gz SHQGGPISIIMEBJ-UHFFFAOYSA-N 1 1 246.398 3.648 20 0 BHADMO Cc1ccc(C[N@@H+]2CCCC[C@H]2CC(C)C)nc1 ZINC000676706714 487897546 /nfs/dbraw/zinc/89/75/46/487897546.db2.gz CTQZTONEWYPNJF-INIZCTEOSA-N 1 1 246.398 3.791 20 0 BHADMO Cc1ccc(C[N@@H+]2CCCC[C@@H]2CC(C)C)nc1 ZINC000676706715 487897348 /nfs/dbraw/zinc/89/73/48/487897348.db2.gz CTQZTONEWYPNJF-MRXNPFEDSA-N 1 1 246.398 3.791 20 0 BHADMO Cc1cc[nH+]c(NC2CCC(OC(C)C)CC2)c1 ZINC000676879713 487940595 /nfs/dbraw/zinc/94/05/95/487940595.db2.gz OPPWFSQEENUZDY-UHFFFAOYSA-N 1 1 248.370 3.538 20 0 BHADMO C[C@H]1CC[N@@H+](CCCOC(C)(C)C)C[C@@H](C)C1 ZINC000676905049 487945057 /nfs/dbraw/zinc/94/50/57/487945057.db2.gz QENKYBDHAVTTCT-KBPBESRZSA-N 1 1 241.419 3.560 20 0 BHADMO C[C@@H]1CC[N@@H+](CCCOC(C)(C)C)C[C@@H](C)C1 ZINC000676905050 487943399 /nfs/dbraw/zinc/94/33/99/487943399.db2.gz QENKYBDHAVTTCT-KGLIPLIRSA-N 1 1 241.419 3.560 20 0 BHADMO C[C@H]1CC[N@@H+](CCCOC(C)(C)C)C[C@H](C)C1 ZINC000676905051 487943445 /nfs/dbraw/zinc/94/34/45/487943445.db2.gz QENKYBDHAVTTCT-UONOGXRCSA-N 1 1 241.419 3.560 20 0 BHADMO C[C@@H]1C[C@H](C)CC[N@@H+](CCCOC(C)(C)C)C1 ZINC000676905052 487943459 /nfs/dbraw/zinc/94/34/59/487943459.db2.gz QENKYBDHAVTTCT-ZIAGYGMSSA-N 1 1 241.419 3.560 20 0 BHADMO C[C@H](c1ccncc1)[N@H+]1CC[C@@H](C)C[C@H](C)C1 ZINC000676905349 487945454 /nfs/dbraw/zinc/94/54/54/487945454.db2.gz YQDSQBWWURDFSR-HZSPNIEDSA-N 1 1 232.371 3.511 20 0 BHADMO C[C@@H](c1ccncc1)[N@H+]1CC[C@@H](C)C[C@@H](C)C1 ZINC000676905350 487945124 /nfs/dbraw/zinc/94/51/24/487945124.db2.gz YQDSQBWWURDFSR-MCIONIFRSA-N 1 1 232.371 3.511 20 0 BHADMO C[C@H](c1ccncc1)[N@H+]1CC[C@@H](C)C[C@@H](C)C1 ZINC000676905351 487945241 /nfs/dbraw/zinc/94/52/41/487945241.db2.gz YQDSQBWWURDFSR-MGPQQGTHSA-N 1 1 232.371 3.511 20 0 BHADMO C[C@@H](c1ccncc1)[N@H+]1CC[C@@H](C)C[C@H](C)C1 ZINC000676905352 487945115 /nfs/dbraw/zinc/94/51/15/487945115.db2.gz YQDSQBWWURDFSR-RDBSUJKOSA-N 1 1 232.371 3.511 20 0 BHADMO c1ccc(SCC[N@@H+]2[C@H]3C=CC[C@@H]2CC3)cc1 ZINC000676906390 487945262 /nfs/dbraw/zinc/94/52/62/487945262.db2.gz WPJXURIDAPJMQO-UONOGXRCSA-N 1 1 245.391 3.572 20 0 BHADMO c1ccc2c(c1)CCC[C@@H]2[N@H+]1[C@H]2C=CC[C@@H]1CC2 ZINC000676906442 487945407 /nfs/dbraw/zinc/94/54/07/487945407.db2.gz ZEXFCWDYQXBLBF-UXLLHSPISA-N 1 1 239.362 3.857 20 0 BHADMO c1ccc2c(c1)CCC[C@H]2[N@H+]1[C@H]2C=CC[C@@H]1CC2 ZINC000676906443 487945235 /nfs/dbraw/zinc/94/52/35/487945235.db2.gz ZEXFCWDYQXBLBF-ZMSDIMECSA-N 1 1 239.362 3.857 20 0 BHADMO c1c2ccccc2oc1C[N@@H+]1[C@H]2C=CC[C@@H]1CC2 ZINC000676907661 491121606 /nfs/dbraw/zinc/12/16/06/491121606.db2.gz JUWVDNJFPCKXME-UONOGXRCSA-N 1 1 239.318 3.726 20 0 BHADMO c1cc(CCC[N@H+]2CCC[C@H](C3CC3)C2)cs1 ZINC000677008816 487955841 /nfs/dbraw/zinc/95/58/41/487955841.db2.gz HWDBATNGULKVKN-HNNXBMFYSA-N 1 1 249.423 3.803 20 0 BHADMO c1cc(CCC[N@H+]2CCC[C@@H](C3CC3)C2)cs1 ZINC000677008821 487955624 /nfs/dbraw/zinc/95/56/24/487955624.db2.gz HWDBATNGULKVKN-OAHLLOKOSA-N 1 1 249.423 3.803 20 0 BHADMO C[C@@H](c1ccccc1)[N@H+]1CCC[C@H](C2CC2)C1 ZINC000677018584 487955609 /nfs/dbraw/zinc/95/56/09/487955609.db2.gz JYHKEDFCRUEGJO-BBRMVZONSA-N 1 1 229.367 3.870 20 0 BHADMO C[C@H](c1ccccc1)[N@H+]1CCC[C@H](C2CC2)C1 ZINC000677018586 487955460 /nfs/dbraw/zinc/95/54/60/487955460.db2.gz JYHKEDFCRUEGJO-CJNGLKHVSA-N 1 1 229.367 3.870 20 0 BHADMO C[C@H](c1ccccc1)[N@H+]1CCC[C@@H](C2CC2)C1 ZINC000677018587 487955565 /nfs/dbraw/zinc/95/55/65/487955565.db2.gz JYHKEDFCRUEGJO-CZUORRHYSA-N 1 1 229.367 3.870 20 0 BHADMO C[C@@H](c1ccccc1)[N@H+]1CCC[C@@H](C2CC2)C1 ZINC000677018588 487955688 /nfs/dbraw/zinc/95/56/88/487955688.db2.gz JYHKEDFCRUEGJO-XJKSGUPXSA-N 1 1 229.367 3.870 20 0 BHADMO C(=C/c1ccccc1)\C[N@H+]1CCC[C@H](C2CC2)C1 ZINC000677029568 487956414 /nfs/dbraw/zinc/95/64/14/487956414.db2.gz PCANTIAUABQKPB-AUNFYEFLSA-N 1 1 241.378 3.822 20 0 BHADMO C(=C/c1ccccc1)\C[N@H+]1CCC[C@@H](C2CC2)C1 ZINC000677029569 487956410 /nfs/dbraw/zinc/95/64/10/487956410.db2.gz PCANTIAUABQKPB-IOMDMTNGSA-N 1 1 241.378 3.822 20 0 BHADMO C(=C\c1ccccc1)\C[N@H+]1CCC[C@H](C2CC2)C1 ZINC000677029571 487956440 /nfs/dbraw/zinc/95/64/40/487956440.db2.gz PCANTIAUABQKPB-LYLYKKCESA-N 1 1 241.378 3.822 20 0 BHADMO C(=C\c1ccccc1)\C[N@H+]1CCC[C@@H](C2CC2)C1 ZINC000677029572 487956378 /nfs/dbraw/zinc/95/63/78/487956378.db2.gz PCANTIAUABQKPB-RLXIPRIJSA-N 1 1 241.378 3.822 20 0 BHADMO c1ccc2c(c1)CC[C@H]2[N@H+]1CCC[C@H](C2CC2)C1 ZINC000677046920 487957450 /nfs/dbraw/zinc/95/74/50/487957450.db2.gz IMWCRJSWSWPKMS-DOTOQJQBSA-N 1 1 241.378 3.796 20 0 BHADMO c1ccc2c(c1)CC[C@H]2[N@H+]1CCC[C@@H](C2CC2)C1 ZINC000677046921 487957899 /nfs/dbraw/zinc/95/78/99/487957899.db2.gz IMWCRJSWSWPKMS-NVXWUHKLSA-N 1 1 241.378 3.796 20 0 BHADMO c1ccc2c(c1)CC[C@@H]2[N@H+]1CCC[C@H](C2CC2)C1 ZINC000677046922 487957972 /nfs/dbraw/zinc/95/79/72/487957972.db2.gz IMWCRJSWSWPKMS-RDJZCZTQSA-N 1 1 241.378 3.796 20 0 BHADMO c1ccc2c(c1)CC[C@@H]2[N@H+]1CCC[C@@H](C2CC2)C1 ZINC000677046923 491125414 /nfs/dbraw/zinc/12/54/14/491125414.db2.gz IMWCRJSWSWPKMS-WBVHZDCISA-N 1 1 241.378 3.796 20 0 BHADMO FC(F)(F)CCCC[N@H+]1CCC[C@@H](C2CC2)C1 ZINC000677056814 487962336 /nfs/dbraw/zinc/96/23/36/487962336.db2.gz CGUOSKOMTNBULM-GFCCVEGCSA-N 1 1 249.320 3.841 20 0 BHADMO FC(F)(F)CCCC[N@H+]1CCC[C@H](C2CC2)C1 ZINC000677056815 487962105 /nfs/dbraw/zinc/96/21/05/487962105.db2.gz CGUOSKOMTNBULM-LBPRGKRZSA-N 1 1 249.320 3.841 20 0 BHADMO Cc1ccccc1C[N@H+]1CCC[C@H](C2CC2)C1 ZINC000677056903 487962315 /nfs/dbraw/zinc/96/23/15/487962315.db2.gz LVUAANOIXLPPFY-INIZCTEOSA-N 1 1 229.367 3.617 20 0 BHADMO Cc1ccccc1C[N@H+]1CCC[C@@H](C2CC2)C1 ZINC000677056904 487962114 /nfs/dbraw/zinc/96/21/14/487962114.db2.gz LVUAANOIXLPPFY-MRXNPFEDSA-N 1 1 229.367 3.617 20 0 BHADMO CCC(CC)[N@@H+](CC)CCCOC(C)(C)C ZINC000677235295 488003089 /nfs/dbraw/zinc/00/30/89/488003089.db2.gz SVHLRHLYBGOBHG-UHFFFAOYSA-N 1 1 229.408 3.702 20 0 BHADMO CCCc1[nH+]ccn1Cc1ccc(SC)cc1 ZINC000677418792 488032415 /nfs/dbraw/zinc/03/24/15/488032415.db2.gz KFBPWNBIPRJIBA-UHFFFAOYSA-N 1 1 246.379 3.606 20 0 BHADMO CC1(C)C[N@H+](C2CCCC2)Cc2ccccc2O1 ZINC000677510201 488059930 /nfs/dbraw/zinc/05/99/30/488059930.db2.gz KDPAKMQRMGCUPW-UHFFFAOYSA-N 1 1 245.366 3.602 20 0 BHADMO C[C@H](c1ccncc1)[N@@H+]1CC=C(C(C)(C)C)CC1 ZINC000677561182 488074065 /nfs/dbraw/zinc/07/40/65/488074065.db2.gz JFSNHNRDYXYKKK-CYBMUJFWSA-N 1 1 244.382 3.821 20 0 BHADMO C[C@@H](c1ccncc1)[N@@H+]1CC=C(C(C)(C)C)CC1 ZINC000677561183 488074195 /nfs/dbraw/zinc/07/41/95/488074195.db2.gz JFSNHNRDYXYKKK-ZDUSSCGKSA-N 1 1 244.382 3.821 20 0 BHADMO Cc1cn(Cc2cccc3ccccc32)c(C)[nH+]1 ZINC000677645642 488086698 /nfs/dbraw/zinc/08/66/98/488086698.db2.gz LFCWRPWICNONAC-UHFFFAOYSA-N 1 1 236.318 3.701 20 0 BHADMO FC(F)(F)[C@@H]1CC[N@@H+](CCCC2CCCC2)C1 ZINC000677713154 488096449 /nfs/dbraw/zinc/09/64/49/488096449.db2.gz CCKFWLPDHMAONN-GFCCVEGCSA-N 1 1 249.320 3.841 20 0 BHADMO FC(F)(F)[C@H]1CC[N@@H+](CCCC2CCCC2)C1 ZINC000677713155 488096471 /nfs/dbraw/zinc/09/64/71/488096471.db2.gz CCKFWLPDHMAONN-LBPRGKRZSA-N 1 1 249.320 3.841 20 0 BHADMO FC(F)(F)[C@@H]1CC[N@@H+](CCC2CCCCC2)C1 ZINC000677716087 488098752 /nfs/dbraw/zinc/09/87/52/488098752.db2.gz LUWNYTWJVUZGKY-GFCCVEGCSA-N 1 1 249.320 3.841 20 0 BHADMO FC(F)(F)[C@H]1CC[N@@H+](CCC2CCCCC2)C1 ZINC000677716088 488098677 /nfs/dbraw/zinc/09/86/77/488098677.db2.gz LUWNYTWJVUZGKY-LBPRGKRZSA-N 1 1 249.320 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XGELRVRDKOGEEF-UONOGXRCSA-N 1 1 244.382 3.655 20 0 BHADMO C[C@H](c1ccncc1)[N@H+]1CC[C@@H](C)C2(CCC2)C1 ZINC000678469436 488258331 /nfs/dbraw/zinc/25/83/31/488258331.db2.gz XGELRVRDKOGEEF-ZIAGYGMSSA-N 1 1 244.382 3.655 20 0 BHADMO Cc1cccnc1C[N@@H+](C1CC1)C1CCCCC1 ZINC000678514903 488263813 /nfs/dbraw/zinc/26/38/13/488263813.db2.gz VLZLOVQEWMAEHD-UHFFFAOYSA-N 1 1 244.382 3.687 20 0 BHADMO CCC(C)(C)CC[N@@H+](Cc1ccncc1)C1CC1 ZINC000678527219 488264178 /nfs/dbraw/zinc/26/41/78/488264178.db2.gz GCLKGQMKBSYIHP-UHFFFAOYSA-N 1 1 246.398 3.872 20 0 BHADMO CC[C@@H]1CC[C@H](C)[N@H+]1Cc1cccc(N(C)C)c1 ZINC000678535321 488264754 /nfs/dbraw/zinc/26/47/54/488264754.db2.gz PJPDRRMZIARUCK-DZGCQCFKSA-N 1 1 246.398 3.516 20 0 BHADMO CC[C@H]1CC[C@@H](C)[N@H+]1Cc1cccc(N(C)C)c1 ZINC000678535323 488264782 /nfs/dbraw/zinc/26/47/82/488264782.db2.gz PJPDRRMZIARUCK-HIFRSBDPSA-N 1 1 246.398 3.516 20 0 BHADMO CC[C@@H]1CC[C@@H](C)[N@H+]1Cc1cccc(N(C)C)c1 ZINC000678535324 488264813 /nfs/dbraw/zinc/26/48/13/488264813.db2.gz PJPDRRMZIARUCK-UKRRQHHQSA-N 1 1 246.398 3.516 20 0 BHADMO CC[C@H]1CC[C@H](C)[N@H+]1Cc1cccc(N(C)C)c1 ZINC000678535326 488265079 /nfs/dbraw/zinc/26/50/79/488265079.db2.gz PJPDRRMZIARUCK-ZFWWWQNUSA-N 1 1 246.398 3.516 20 0 BHADMO CC(C)(C)C[NH+](CC(F)F)CC(C)(C)C ZINC000678797285 488284384 /nfs/dbraw/zinc/28/43/84/488284384.db2.gz CCPQZCBWXWYMFT-UHFFFAOYSA-N 1 1 221.335 3.646 20 0 BHADMO CCC[C@@H](C)C[N@@H+](C)Cc1ccsc1 ZINC000678812022 487648324 /nfs/dbraw/zinc/64/83/24/487648324.db2.gz NSJCMTUBFXCFHC-LLVKDONJSA-N 1 1 211.374 3.616 20 0 BHADMO CCC[C@H](C)C[N@@H+](C)Cc1ccsc1 ZINC000678812027 487648380 /nfs/dbraw/zinc/64/83/80/487648380.db2.gz NSJCMTUBFXCFHC-NSHDSACASA-N 1 1 211.374 3.616 20 0 BHADMO C[N@@H+](CC(C)(C)c1ccccc1)C1CCCC1 ZINC000678812134 488286130 /nfs/dbraw/zinc/28/61/30/488286130.db2.gz VUJVOMXMCAYCPU-UHFFFAOYSA-N 1 1 231.383 3.839 20 0 BHADMO CC(C)C[N@@H+](C)CC(C)(C)c1ccccc1 ZINC000678812757 488286003 /nfs/dbraw/zinc/28/60/03/488286003.db2.gz VWUQDNIVODGKQP-UHFFFAOYSA-N 1 1 219.372 3.552 20 0 BHADMO C[N@@H+](Cc1ccco1)CC(C)(C)c1ccccc1 ZINC000678813189 488285912 /nfs/dbraw/zinc/28/59/12/488285912.db2.gz VZKYJRHCCRDDDK-UHFFFAOYSA-N 1 1 243.350 3.689 20 0 BHADMO COc1ccc([C@@H](C)C[N@@H+](C)CCC(C)C)cc1 ZINC000678813534 488286229 /nfs/dbraw/zinc/28/62/29/488286229.db2.gz CJHFEUISUFOUGD-AWEZNQCLSA-N 1 1 249.398 3.777 20 0 BHADMO COc1ccc([C@H](C)C[N@@H+](C)CCC(C)C)cc1 ZINC000678813535 488285840 /nfs/dbraw/zinc/28/58/40/488285840.db2.gz CJHFEUISUFOUGD-CQSZACIVSA-N 1 1 249.398 3.777 20 0 BHADMO C[C@H](C1CC1)[N@@H+](C)CC(C)(C)c1ccccc1 ZINC000678814209 487648218 /nfs/dbraw/zinc/64/82/18/487648218.db2.gz DMBNIUDTVJEARW-CYBMUJFWSA-N 1 1 231.383 3.695 20 0 BHADMO C[C@@H](C1CC1)[N@@H+](C)CC(C)(C)c1ccccc1 ZINC000678814210 487648259 /nfs/dbraw/zinc/64/82/59/487648259.db2.gz DMBNIUDTVJEARW-ZDUSSCGKSA-N 1 1 231.383 3.695 20 0 BHADMO CC[C@@H](C)[N@@H+](C)CC(C)(C)c1ccccc1 ZINC000678814539 488286428 /nfs/dbraw/zinc/28/64/28/488286428.db2.gz FKLIEBDDOZBVJV-CYBMUJFWSA-N 1 1 219.372 3.695 20 0 BHADMO CC[C@H](C)[N@@H+](C)CC(C)(C)c1ccccc1 ZINC000678814540 488286770 /nfs/dbraw/zinc/28/67/70/488286770.db2.gz FKLIEBDDOZBVJV-ZDUSSCGKSA-N 1 1 219.372 3.695 20 0 BHADMO C[N@@H+](Cc1ccoc1)CC(C)(C)c1ccccc1 ZINC000678817873 487651502 /nfs/dbraw/zinc/65/15/02/487651502.db2.gz ABYNWXDCJFVJEJ-UHFFFAOYSA-N 1 1 243.350 3.689 20 0 BHADMO CCC[C@H](C)C[N@H+]1CCC[C@H]1c1ccc(O)cc1 ZINC000678819951 488286994 /nfs/dbraw/zinc/28/69/94/488286994.db2.gz YRZNLZBMPOAYAG-BBRMVZONSA-N 1 1 247.382 3.965 20 0 BHADMO CCC[C@@H](C)C[N@H+]1CCC[C@H]1c1ccc(O)cc1 ZINC000678819954 488287303 /nfs/dbraw/zinc/28/73/03/488287303.db2.gz YRZNLZBMPOAYAG-CJNGLKHVSA-N 1 1 247.382 3.965 20 0 BHADMO CCC[C@@H](C)C[N@H+]1CCC[C@@H]1c1ccc(O)cc1 ZINC000678819956 488287038 /nfs/dbraw/zinc/28/70/38/488287038.db2.gz YRZNLZBMPOAYAG-CZUORRHYSA-N 1 1 247.382 3.965 20 0 BHADMO CCC[C@H](C)C[N@H+]1CCC[C@@H]1c1ccc(O)cc1 ZINC000678819959 488287257 /nfs/dbraw/zinc/28/72/57/488287257.db2.gz YRZNLZBMPOAYAG-XJKSGUPXSA-N 1 1 247.382 3.965 20 0 BHADMO CCC[C@H](C)C[N@@H+](CC)CCC(F)(F)F ZINC000678821388 488287243 /nfs/dbraw/zinc/28/72/43/488287243.db2.gz PEKUGOAQNGJXAY-JTQLQIEISA-N 1 1 225.298 3.697 20 0 BHADMO CCC[C@@H](C)C[N@@H+](CC)CCC(F)(F)F ZINC000678821389 488287352 /nfs/dbraw/zinc/28/73/52/488287352.db2.gz PEKUGOAQNGJXAY-SNVBAGLBSA-N 1 1 225.298 3.697 20 0 BHADMO CCC[C@@H](C)C[N@@H+](CC)Cc1ccoc1 ZINC000678822532 488287763 /nfs/dbraw/zinc/28/77/63/488287763.db2.gz HCRIJELBUJSIHA-GFCCVEGCSA-N 1 1 209.333 3.538 20 0 BHADMO CCC[C@H](C)C[N@@H+](CC)Cc1ccoc1 ZINC000678822533 488287749 /nfs/dbraw/zinc/28/77/49/488287749.db2.gz HCRIJELBUJSIHA-LBPRGKRZSA-N 1 1 209.333 3.538 20 0 BHADMO CCCC[N@@H+](C)CC(C)(C)c1ccccc1 ZINC000678826584 488288331 /nfs/dbraw/zinc/28/83/31/488288331.db2.gz FBJWLBWGOUDIDS-UHFFFAOYSA-N 1 1 219.372 3.696 20 0 BHADMO COc1ccc([C@@H](C)C[N@H+]2CCC[C@H](C)C2)cc1 ZINC000678826744 488288179 /nfs/dbraw/zinc/28/81/79/488288179.db2.gz JBEVRTMXHOUCNB-KBPBESRZSA-N 1 1 247.382 3.531 20 0 BHADMO COc1ccc([C@@H](C)C[N@H+]2CCC[C@@H](C)C2)cc1 ZINC000678826745 488288365 /nfs/dbraw/zinc/28/83/65/488288365.db2.gz JBEVRTMXHOUCNB-KGLIPLIRSA-N 1 1 247.382 3.531 20 0 BHADMO COc1ccc([C@H](C)C[N@H+]2CCC[C@H](C)C2)cc1 ZINC000678826746 488288235 /nfs/dbraw/zinc/28/82/35/488288235.db2.gz JBEVRTMXHOUCNB-UONOGXRCSA-N 1 1 247.382 3.531 20 0 BHADMO COc1ccc([C@H](C)C[N@H+]2CCC[C@@H](C)C2)cc1 ZINC000678826747 488288495 /nfs/dbraw/zinc/28/84/95/488288495.db2.gz JBEVRTMXHOUCNB-ZIAGYGMSSA-N 1 1 247.382 3.531 20 0 BHADMO CCC[C@@H](C)C[N@H+]1CC[C@@H](c2ccco2)C1 ZINC000678828279 488288172 /nfs/dbraw/zinc/28/81/72/488288172.db2.gz DKZGUJCEFQYPDZ-CHWSQXEVSA-N 1 1 221.344 3.505 20 0 BHADMO CCC[C@@H](C)C[N@H+]1CC[C@H](c2ccco2)C1 ZINC000678828281 488288135 /nfs/dbraw/zinc/28/81/35/488288135.db2.gz DKZGUJCEFQYPDZ-OLZOCXBDSA-N 1 1 221.344 3.505 20 0 BHADMO CCC[C@H](C)C[N@H+]1CC[C@@H](c2ccco2)C1 ZINC000678828283 488288491 /nfs/dbraw/zinc/28/84/91/488288491.db2.gz DKZGUJCEFQYPDZ-QWHCGFSZSA-N 1 1 221.344 3.505 20 0 BHADMO CCC[C@H](C)C[N@H+]1CC[C@H](c2ccco2)C1 ZINC000678828285 487658611 /nfs/dbraw/zinc/65/86/11/487658611.db2.gz DKZGUJCEFQYPDZ-STQMWFEESA-N 1 1 221.344 3.505 20 0 BHADMO CC[N@@H+](CC1CC1)CC(C)(C)c1ccccc1 ZINC000678829486 488289185 /nfs/dbraw/zinc/28/91/85/488289185.db2.gz FADORRVHVQZYAX-UHFFFAOYSA-N 1 1 231.383 3.696 20 0 BHADMO CC1=CC[N@@H+](CC(C)(C)c2ccccc2)CC1 ZINC000678831707 488288733 /nfs/dbraw/zinc/28/87/33/488288733.db2.gz PKFGPGVXVITPEU-UHFFFAOYSA-N 1 1 229.367 3.616 20 0 BHADMO CC[N@@H+](CC(C)(C)c1ccccc1)C1CCC1 ZINC000678833491 488289379 /nfs/dbraw/zinc/28/93/79/488289379.db2.gz CNHGGRVXNRRDOW-UHFFFAOYSA-N 1 1 231.383 3.839 20 0 BHADMO C[N@@H+](CCC1CC1)CC(C)(C)c1ccccc1 ZINC000678842736 488290073 /nfs/dbraw/zinc/29/00/73/488290073.db2.gz YSGXXEGGDISKEW-UHFFFAOYSA-N 1 1 231.383 3.696 20 0 BHADMO CC(C)[C@H]1CC[N@H+]1Cc1cscc1Cl ZINC000678850730 488290975 /nfs/dbraw/zinc/29/09/75/488290975.db2.gz HSPVFWQDGLFWTI-LLVKDONJSA-N 1 1 229.776 3.632 20 0 BHADMO CC(C)[C@@H]1CC[N@H+]1Cc1cscc1Cl ZINC000678850731 488287454 /nfs/dbraw/zinc/28/74/54/488287454.db2.gz HSPVFWQDGLFWTI-NSHDSACASA-N 1 1 229.776 3.632 20 0 BHADMO CC(C)[C@@H]1CC[N@H+]1CC(C)(C)c1ccccc1 ZINC000678851573 488290897 /nfs/dbraw/zinc/29/08/97/488290897.db2.gz QXEWVAKNCGQOEZ-HNNXBMFYSA-N 1 1 231.383 3.695 20 0 BHADMO CC(C)[C@H]1CC[N@H+]1CC(C)(C)c1ccccc1 ZINC000678851574 488290755 /nfs/dbraw/zinc/29/07/55/488290755.db2.gz QXEWVAKNCGQOEZ-OAHLLOKOSA-N 1 1 231.383 3.695 20 0 BHADMO CC(C)[C@@H]1CC[N@H+]1Cc1ccccc1C1CC1 ZINC000678852011 488290841 /nfs/dbraw/zinc/29/08/41/488290841.db2.gz VDGBXHXHJQWKOF-INIZCTEOSA-N 1 1 229.367 3.794 20 0 BHADMO CC(C)[C@H]1CC[N@H+]1Cc1ccccc1C1CC1 ZINC000678852012 488291001 /nfs/dbraw/zinc/29/10/01/488291001.db2.gz VDGBXHXHJQWKOF-MRXNPFEDSA-N 1 1 229.367 3.794 20 0 BHADMO CC1(C)CCC(C[N@H+]2CC[C@@H](C(F)F)C2)CC1 ZINC000678891416 488294088 /nfs/dbraw/zinc/29/40/88/488294088.db2.gz FTOVKYFVJMRTEE-GFCCVEGCSA-N 1 1 245.357 3.790 20 0 BHADMO CC1(C)CCC(C[N@H+]2CC[C@H](C(F)F)C2)CC1 ZINC000678891420 488294155 /nfs/dbraw/zinc/29/41/55/488294155.db2.gz FTOVKYFVJMRTEE-LBPRGKRZSA-N 1 1 245.357 3.790 20 0 BHADMO Cc1nc([C@@H](C)Nc2cc(C)cc[nH+]2)c(C)s1 ZINC000678903045 488295187 /nfs/dbraw/zinc/29/51/87/488295187.db2.gz OVNGLTHHKWEPEX-SECBINFHSA-N 1 1 247.367 3.636 20 0 BHADMO Cc1nc([C@H](C)Nc2cc(C)cc[nH+]2)c(C)s1 ZINC000678903046 488294969 /nfs/dbraw/zinc/29/49/69/488294969.db2.gz OVNGLTHHKWEPEX-VIFPVBQESA-N 1 1 247.367 3.636 20 0 BHADMO Cc1cc[nH+]c(N[C@H](C)c2ccc(C)nc2C)c1 ZINC000678999323 488301600 /nfs/dbraw/zinc/30/16/00/488301600.db2.gz OHOXEKVAQUFCKG-CYBMUJFWSA-N 1 1 241.338 3.575 20 0 BHADMO Cc1cc[nH+]c(N[C@@H](C)c2ccc(C)nc2C)c1 ZINC000678999324 488301865 /nfs/dbraw/zinc/30/18/65/488301865.db2.gz OHOXEKVAQUFCKG-ZDUSSCGKSA-N 1 1 241.338 3.575 20 0 BHADMO Cc1ccc2c(c1)[C@@H](Nc1cccc(C)[nH+]1)CC2 ZINC000679001069 488302407 /nfs/dbraw/zinc/30/24/07/488302407.db2.gz BTVWQDFYQOEARP-HNNXBMFYSA-N 1 1 238.334 3.798 20 0 BHADMO Cc1ccc2c(c1)[C@H](Nc1cccc(C)[nH+]1)CC2 ZINC000679001070 488302251 /nfs/dbraw/zinc/30/22/51/488302251.db2.gz BTVWQDFYQOEARP-OAHLLOKOSA-N 1 1 238.334 3.798 20 0 BHADMO CCC(O)(CC)C[N@@H+](C)[C@@H](C)c1ccccc1C ZINC000679020829 488303221 /nfs/dbraw/zinc/30/32/21/488303221.db2.gz CNBHBYVWNPEDBB-AWEZNQCLSA-N 1 1 249.398 3.539 20 0 BHADMO CCC(O)(CC)C[N@@H+](C)[C@H](C)c1ccccc1C ZINC000679020830 488303357 /nfs/dbraw/zinc/30/33/57/488303357.db2.gz CNBHBYVWNPEDBB-CQSZACIVSA-N 1 1 249.398 3.539 20 0 BHADMO C[C@H](c1ccc(F)cc1)[N@H+]1CC[C@@H](C)[C@@H](F)C1 ZINC000679217583 487781519 /nfs/dbraw/zinc/78/15/19/487781519.db2.gz AAFSRSSZSNOBGM-GYSYKLTISA-N 1 1 239.309 3.567 20 0 BHADMO C[C@H](c1ccc(F)cc1)[N@@H+]1CC[C@@H](C)[C@@H](F)C1 ZINC000679217583 487781515 /nfs/dbraw/zinc/78/15/15/487781515.db2.gz AAFSRSSZSNOBGM-GYSYKLTISA-N 1 1 239.309 3.567 20 0 BHADMO C[C@H](c1ccc(F)cc1)[N@H+]1CC[C@@H](C)[C@H](F)C1 ZINC000679217587 487781542 /nfs/dbraw/zinc/78/15/42/487781542.db2.gz AAFSRSSZSNOBGM-JTNHKYCSSA-N 1 1 239.309 3.567 20 0 BHADMO C[C@H](c1ccc(F)cc1)[N@@H+]1CC[C@@H](C)[C@H](F)C1 ZINC000679217587 487781539 /nfs/dbraw/zinc/78/15/39/487781539.db2.gz AAFSRSSZSNOBGM-JTNHKYCSSA-N 1 1 239.309 3.567 20 0 BHADMO C[C@@H](c1ccc(F)cc1)[N@H+]1CC[C@@H](C)[C@@H](F)C1 ZINC000679217588 487781573 /nfs/dbraw/zinc/78/15/73/487781573.db2.gz AAFSRSSZSNOBGM-SUNKGSAMSA-N 1 1 239.309 3.567 20 0 BHADMO C[C@@H](c1ccc(F)cc1)[N@@H+]1CC[C@@H](C)[C@@H](F)C1 ZINC000679217588 487781569 /nfs/dbraw/zinc/78/15/69/487781569.db2.gz AAFSRSSZSNOBGM-SUNKGSAMSA-N 1 1 239.309 3.567 20 0 BHADMO C[C@@H](c1ccc(F)cc1)[N@H+]1CC[C@@H](C)[C@H](F)C1 ZINC000679217590 487781469 /nfs/dbraw/zinc/78/14/69/487781469.db2.gz AAFSRSSZSNOBGM-UHIISALHSA-N 1 1 239.309 3.567 20 0 BHADMO C[C@@H](c1ccc(F)cc1)[N@@H+]1CC[C@@H](C)[C@H](F)C1 ZINC000679217590 487781465 /nfs/dbraw/zinc/78/14/65/487781465.db2.gz AAFSRSSZSNOBGM-UHIISALHSA-N 1 1 239.309 3.567 20 0 BHADMO Cc1cc(C[N@@H+]2CC[C@@H](C)[C@H](F)C2)c(C)s1 ZINC000679218087 488317829 /nfs/dbraw/zinc/31/78/29/488317829.db2.gz CFCOEOFHZIJAJE-NOZJJQNGSA-N 1 1 241.375 3.545 20 0 BHADMO Cc1cc(C[N@@H+]2CC[C@@H](C)[C@@H](F)C2)c(C)s1 ZINC000679218090 488317875 /nfs/dbraw/zinc/31/78/75/488317875.db2.gz CFCOEOFHZIJAJE-RNCFNFMXSA-N 1 1 241.375 3.545 20 0 BHADMO Cc1cc(C[N@@H+]2CC[C@H](C)[C@H](F)C2)c(C)s1 ZINC000679218094 488317852 /nfs/dbraw/zinc/31/78/52/488317852.db2.gz CFCOEOFHZIJAJE-TVQRCGJNSA-N 1 1 241.375 3.545 20 0 BHADMO Cc1cc(C[N@@H+]2CC[C@H](C)[C@@H](F)C2)c(C)s1 ZINC000679218096 488317978 /nfs/dbraw/zinc/31/79/78/488317978.db2.gz CFCOEOFHZIJAJE-ZANVPECISA-N 1 1 241.375 3.545 20 0 BHADMO Cc1cccc([C@H](C)[N@H+]2CC[C@@H](C)[C@@H](F)C2)c1 ZINC000679218908 488317896 /nfs/dbraw/zinc/31/78/96/488317896.db2.gz DXZUFBJOEOBIHT-IPYPFGDCSA-N 1 1 235.346 3.736 20 0 BHADMO Cc1cccc([C@H](C)[N@H+]2CC[C@H](C)[C@H](F)C2)c1 ZINC000679218911 488318729 /nfs/dbraw/zinc/31/87/29/488318729.db2.gz 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1 1 247.357 3.744 20 0 BHADMO C[C@@H]1CC[N@@H+](Cc2ccccc2C2CC2)C[C@H]1F ZINC000679362498 487942989 /nfs/dbraw/zinc/94/29/89/487942989.db2.gz YIBLZNYSVSAOFG-MLGOLLRUSA-N 1 1 247.357 3.744 20 0 BHADMO C[C@@H]1CC[N@@H+](Cc2ccccc2C2CC2)C[C@@H]1F ZINC000679362499 487943023 /nfs/dbraw/zinc/94/30/23/487943023.db2.gz YIBLZNYSVSAOFG-WBMJQRKESA-N 1 1 247.357 3.744 20 0 BHADMO C[C@@H]1CC[N@@H+](Cc2coc3ccccc23)C[C@H]1F ZINC000679362523 488346548 /nfs/dbraw/zinc/34/65/48/488346548.db2.gz YSLCLRDBDDRSMC-BXUZGUMPSA-N 1 1 247.313 3.613 20 0 BHADMO C[C@H]1CC[N@@H+](Cc2coc3ccccc23)C[C@@H]1F ZINC000679362524 488346752 /nfs/dbraw/zinc/34/67/52/488346752.db2.gz YSLCLRDBDDRSMC-FZMZJTMJSA-N 1 1 247.313 3.613 20 0 BHADMO C[C@@H]1CC[N@@H+](Cc2coc3ccccc23)C[C@@H]1F ZINC000679362525 488346541 /nfs/dbraw/zinc/34/65/41/488346541.db2.gz YSLCLRDBDDRSMC-RISCZKNCSA-N 1 1 247.313 3.613 20 0 BHADMO C[C@H]1CC[N@@H+](Cc2coc3ccccc23)C[C@H]1F ZINC000679362526 487943159 /nfs/dbraw/zinc/94/31/59/487943159.db2.gz YSLCLRDBDDRSMC-SMDDNHRTSA-N 1 1 247.313 3.613 20 0 BHADMO CC(C)CC[C@@H]1CCC[N@H+]1Cc1ccc(O)cc1 ZINC000679391900 487976611 /nfs/dbraw/zinc/97/66/11/487976611.db2.gz ANEJIJYMPOZFKB-HNNXBMFYSA-N 1 1 247.382 3.793 20 0 BHADMO CC(C)CC[C@H]1CCC[N@H+]1Cc1ccc(O)cc1 ZINC000679391902 487976728 /nfs/dbraw/zinc/97/67/28/487976728.db2.gz ANEJIJYMPOZFKB-OAHLLOKOSA-N 1 1 247.382 3.793 20 0 BHADMO CC[C@@H](C)[C@@H](C)[N@@H+](Cc1ccc(O)cc1)C1CC1 ZINC000679392404 488349935 /nfs/dbraw/zinc/34/99/35/488349935.db2.gz KSEQYTFTPGIAIC-CHWSQXEVSA-N 1 1 247.382 3.791 20 0 BHADMO CC[C@@H](C)[C@H](C)[N@@H+](Cc1ccc(O)cc1)C1CC1 ZINC000679392405 488349700 /nfs/dbraw/zinc/34/97/00/488349700.db2.gz KSEQYTFTPGIAIC-OLZOCXBDSA-N 1 1 247.382 3.791 20 0 BHADMO CC[C@H](C)[C@@H](C)[N@@H+](Cc1ccc(O)cc1)C1CC1 ZINC000679392406 488349893 /nfs/dbraw/zinc/34/98/93/488349893.db2.gz KSEQYTFTPGIAIC-QWHCGFSZSA-N 1 1 247.382 3.791 20 0 BHADMO CC[C@H](C)[C@H](C)[N@@H+](Cc1ccc(O)cc1)C1CC1 ZINC000679392407 488349992 /nfs/dbraw/zinc/34/99/92/488349992.db2.gz KSEQYTFTPGIAIC-STQMWFEESA-N 1 1 247.382 3.791 20 0 BHADMO CCC[C@H](C)[C@@H]1CCC[N@H+]1Cc1ccc(O)cc1 ZINC000679393255 488349820 /nfs/dbraw/zinc/34/98/20/488349820.db2.gz ULYMXUFJMKUWEW-BBRMVZONSA-N 1 1 247.382 3.793 20 0 BHADMO CCC[C@@H](C)[C@@H]1CCC[N@H+]1Cc1ccc(O)cc1 ZINC000679393256 488350216 /nfs/dbraw/zinc/35/02/16/488350216.db2.gz ULYMXUFJMKUWEW-CJNGLKHVSA-N 1 1 247.382 3.793 20 0 BHADMO CCC[C@@H](C)[C@H]1CCC[N@H+]1Cc1ccc(O)cc1 ZINC000679393258 488350131 /nfs/dbraw/zinc/35/01/31/488350131.db2.gz ULYMXUFJMKUWEW-CZUORRHYSA-N 1 1 247.382 3.793 20 0 BHADMO CCC[C@H](C)[C@H]1CCC[N@H+]1Cc1ccc(O)cc1 ZINC000679393260 488350182 /nfs/dbraw/zinc/35/01/82/488350182.db2.gz ULYMXUFJMKUWEW-XJKSGUPXSA-N 1 1 247.382 3.793 20 0 BHADMO CC(C)C[C@@H]1CCCC[N@H+]1Cc1ccc(O)cc1 ZINC000679393321 488350439 /nfs/dbraw/zinc/35/04/39/488350439.db2.gz VZFLUZRGWKTVEE-HNNXBMFYSA-N 1 1 247.382 3.793 20 0 BHADMO CC(C)C[C@H]1CCCC[N@H+]1Cc1ccc(O)cc1 ZINC000679393322 487978598 /nfs/dbraw/zinc/97/85/98/487978598.db2.gz VZFLUZRGWKTVEE-OAHLLOKOSA-N 1 1 247.382 3.793 20 0 BHADMO CC(C)C[C@@H]1CCC[N@@H+](Cc2ccc(O)cc2)C1 ZINC000679393381 487978618 /nfs/dbraw/zinc/97/86/18/487978618.db2.gz WZGFXZZIDPOLTQ-HNNXBMFYSA-N 1 1 247.382 3.650 20 0 BHADMO CC(C)C[C@H]1CCC[N@@H+](Cc2ccc(O)cc2)C1 ZINC000679393388 487978766 /nfs/dbraw/zinc/97/87/66/487978766.db2.gz WZGFXZZIDPOLTQ-OAHLLOKOSA-N 1 1 247.382 3.650 20 0 BHADMO CC[C@H](C)[C@@H]1CCCC[N@H+]1Cc1ccc(O)cc1 ZINC000679393926 488350325 /nfs/dbraw/zinc/35/03/25/488350325.db2.gz XXBKSEWSPLAGET-BBRMVZONSA-N 1 1 247.382 3.793 20 0 BHADMO CC[C@@H](C)[C@@H]1CCCC[N@H+]1Cc1ccc(O)cc1 ZINC000679393928 488350243 /nfs/dbraw/zinc/35/02/43/488350243.db2.gz XXBKSEWSPLAGET-CJNGLKHVSA-N 1 1 247.382 3.793 20 0 BHADMO CC[C@@H](C)[C@H]1CCCC[N@H+]1Cc1ccc(O)cc1 ZINC000679393930 488350397 /nfs/dbraw/zinc/35/03/97/488350397.db2.gz XXBKSEWSPLAGET-CZUORRHYSA-N 1 1 247.382 3.793 20 0 BHADMO CC[C@H](C)[C@H]1CCCC[N@H+]1Cc1ccc(O)cc1 ZINC000679393932 488350258 /nfs/dbraw/zinc/35/02/58/488350258.db2.gz XXBKSEWSPLAGET-XJKSGUPXSA-N 1 1 247.382 3.793 20 0 BHADMO CC(C)(C)C[C@@H]1CCC[N@H+]1Cc1ccc(O)cc1 ZINC000679396607 488350802 /nfs/dbraw/zinc/35/08/02/488350802.db2.gz UUNWHGXEVWMARC-AWEZNQCLSA-N 1 1 247.382 3.793 20 0 BHADMO CC(C)(C)C[C@H]1CCC[N@H+]1Cc1ccc(O)cc1 ZINC000679396608 488350733 /nfs/dbraw/zinc/35/07/33/488350733.db2.gz UUNWHGXEVWMARC-CQSZACIVSA-N 1 1 247.382 3.793 20 0 BHADMO CC(C)[N@@H+](Cc1ccc(O)cc1)C1CCCCC1 ZINC000679396974 488350784 /nfs/dbraw/zinc/35/07/84/488350784.db2.gz WWRCBLJLPYYKNL-UHFFFAOYSA-N 1 1 247.382 3.935 20 0 BHADMO C[C@H](c1cccs1)[N@@H+](C)Cc1ccc(O)cc1 ZINC000679397018 488350771 /nfs/dbraw/zinc/35/07/71/488350771.db2.gz YYQKTFBFEDJHOP-LLVKDONJSA-N 1 1 247.363 3.647 20 0 BHADMO C[C@@H](c1cccs1)[N@@H+](C)Cc1ccc(O)cc1 ZINC000679397019 488350618 /nfs/dbraw/zinc/35/06/18/488350618.db2.gz YYQKTFBFEDJHOP-NSHDSACASA-N 1 1 247.363 3.647 20 0 BHADMO CSc1ccc(Cn2cc[nH+]c2C(C)C)cc1 ZINC000679460356 488352287 /nfs/dbraw/zinc/35/22/87/488352287.db2.gz AFTLRIARVIYSKJ-UHFFFAOYSA-N 1 1 246.379 3.777 20 0 BHADMO C[N@@H+](C[C@@H]1CCc2ccccc21)C1CCCC1 ZINC000679533564 487587440 /nfs/dbraw/zinc/58/74/40/487587440.db2.gz SYGZPBMGJPVULZ-AWEZNQCLSA-N 1 1 229.367 3.591 20 0 BHADMO C[N@@H+](C[C@H]1CCc2ccccc21)C1CCCC1 ZINC000679533565 487587325 /nfs/dbraw/zinc/58/73/25/487587325.db2.gz SYGZPBMGJPVULZ-CQSZACIVSA-N 1 1 229.367 3.591 20 0 BHADMO CC(C)[C@H](C)[N@@H+](C)C[C@H]1CCc2ccccc21 ZINC000679533578 488356730 /nfs/dbraw/zinc/35/67/30/488356730.db2.gz UOZJTHSKXJQFCB-DZGCQCFKSA-N 1 1 231.383 3.693 20 0 BHADMO CC(C)[C@@H](C)[N@@H+](C)C[C@@H]1CCc2ccccc21 ZINC000679533579 488356668 /nfs/dbraw/zinc/35/66/68/488356668.db2.gz UOZJTHSKXJQFCB-HIFRSBDPSA-N 1 1 231.383 3.693 20 0 BHADMO CC(C)[C@@H](C)[N@@H+](C)C[C@H]1CCc2ccccc21 ZINC000679533580 488356860 /nfs/dbraw/zinc/35/68/60/488356860.db2.gz UOZJTHSKXJQFCB-UKRRQHHQSA-N 1 1 231.383 3.693 20 0 BHADMO CC(C)[C@H](C)[N@@H+](C)C[C@@H]1CCc2ccccc21 ZINC000679533581 488356894 /nfs/dbraw/zinc/35/68/94/488356894.db2.gz UOZJTHSKXJQFCB-ZFWWWQNUSA-N 1 1 231.383 3.693 20 0 BHADMO COc1ccccc1CCC[N@@H+](C)CCC(C)C ZINC000679534092 488356886 /nfs/dbraw/zinc/35/68/86/488356886.db2.gz CHIRUISYKJWIKM-UHFFFAOYSA-N 1 1 249.398 3.606 20 0 BHADMO CC[C@H](C)C[N@H+]1C[C@@H](C(F)(F)F)CC[C@H]1C ZINC000679540143 488357352 /nfs/dbraw/zinc/35/73/52/488357352.db2.gz DRMZZVOJEIPWJV-AXFHLTTASA-N 1 1 237.309 3.695 20 0 BHADMO CC[C@H](C)C[N@H+]1C[C@@H](C(F)(F)F)CC[C@@H]1C ZINC000679540144 488357367 /nfs/dbraw/zinc/35/73/67/488357367.db2.gz DRMZZVOJEIPWJV-DCAQKATOSA-N 1 1 237.309 3.695 20 0 BHADMO CC[C@H](C)C[N@H+]1C[C@H](C(F)(F)F)CC[C@@H]1C ZINC000679540145 488357499 /nfs/dbraw/zinc/35/74/99/488357499.db2.gz DRMZZVOJEIPWJV-GARJFASQSA-N 1 1 237.309 3.695 20 0 BHADMO CC[C@H](C)C[N@H+]1C[C@H](C(F)(F)F)CC[C@H]1C ZINC000679540146 488356125 /nfs/dbraw/zinc/35/61/25/488356125.db2.gz DRMZZVOJEIPWJV-HBNTYKKESA-N 1 1 237.309 3.695 20 0 BHADMO C[C@H]1CC[C@@H](C(F)(F)F)C[N@H+]1CC1CCCC1 ZINC000679541808 488357507 /nfs/dbraw/zinc/35/75/07/488357507.db2.gz MARDLBDPHSYAJJ-CMPLNLGQSA-N 1 1 249.320 3.839 20 0 BHADMO C[C@H]1CC[C@H](C(F)(F)F)C[N@H+]1CC1CCCC1 ZINC000679541809 488357358 /nfs/dbraw/zinc/35/73/58/488357358.db2.gz MARDLBDPHSYAJJ-JQWIXIFHSA-N 1 1 249.320 3.839 20 0 BHADMO C[C@@H]1CC[C@H](C(F)(F)F)C[N@H+]1CC1CCCC1 ZINC000679541810 488356492 /nfs/dbraw/zinc/35/64/92/488356492.db2.gz MARDLBDPHSYAJJ-PWSUYJOCSA-N 1 1 249.320 3.839 20 0 BHADMO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@H+]1CC1CCCC1 ZINC000679541811 488356527 /nfs/dbraw/zinc/35/65/27/488356527.db2.gz MARDLBDPHSYAJJ-ZYHUDNBSSA-N 1 1 249.320 3.839 20 0 BHADMO CC(C)=CC[N@@H+]1C[C@H](C(F)(F)F)CC[C@H]1C ZINC000679542121 488357826 /nfs/dbraw/zinc/35/78/26/488357826.db2.gz NLCUWLJDVOSMGA-GHMZBOCLSA-N 1 1 235.293 3.615 20 0 BHADMO CC(C)=CC[N@@H+]1C[C@@H](C(F)(F)F)CC[C@H]1C ZINC000679542128 488357727 /nfs/dbraw/zinc/35/77/27/488357727.db2.gz NLCUWLJDVOSMGA-MNOVXSKESA-N 1 1 235.293 3.615 20 0 BHADMO CC(C)=CC[N@@H+]1C[C@@H](C(F)(F)F)CC[C@@H]1C ZINC000679542129 488357904 /nfs/dbraw/zinc/35/79/04/488357904.db2.gz NLCUWLJDVOSMGA-QWRGUYRKSA-N 1 1 235.293 3.615 20 0 BHADMO CC(C)=CC[N@@H+]1C[C@H](C(F)(F)F)CC[C@@H]1C ZINC000679542131 488357872 /nfs/dbraw/zinc/35/78/72/488357872.db2.gz NLCUWLJDVOSMGA-WDEREUQCSA-N 1 1 235.293 3.615 20 0 BHADMO CC(C)CC[N@H+]1C[C@H](C(F)(F)F)CC[C@H]1C ZINC000679547754 488358046 /nfs/dbraw/zinc/35/80/46/488358046.db2.gz QDBXAABUGPJRNQ-GHMZBOCLSA-N 1 1 237.309 3.695 20 0 BHADMO CC(C)CC[N@H+]1C[C@@H](C(F)(F)F)CC[C@H]1C ZINC000679547755 488358120 /nfs/dbraw/zinc/35/81/20/488358120.db2.gz QDBXAABUGPJRNQ-MNOVXSKESA-N 1 1 237.309 3.695 20 0 BHADMO CC(C)CC[N@H+]1C[C@@H](C(F)(F)F)CC[C@@H]1C ZINC000679547756 488358013 /nfs/dbraw/zinc/35/80/13/488358013.db2.gz QDBXAABUGPJRNQ-QWRGUYRKSA-N 1 1 237.309 3.695 20 0 BHADMO CC(C)CC[N@H+]1C[C@H](C(F)(F)F)CC[C@@H]1C ZINC000679547757 488358064 /nfs/dbraw/zinc/35/80/64/488358064.db2.gz QDBXAABUGPJRNQ-WDEREUQCSA-N 1 1 237.309 3.695 20 0 BHADMO C[C@@H]1CC[C@H](C(F)(F)F)C[N@H+]1[C@@H]1C=CCCC1 ZINC000679548893 488358105 /nfs/dbraw/zinc/35/81/05/488358105.db2.gz WHNCBGJWWSQTAS-GRYCIOLGSA-N 1 1 247.304 3.758 20 0 BHADMO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@H+]1[C@@H]1C=CCCC1 ZINC000679548894 488358085 /nfs/dbraw/zinc/35/80/85/488358085.db2.gz WHNCBGJWWSQTAS-IJLUTSLNSA-N 1 1 247.304 3.758 20 0 BHADMO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@H+]1[C@H]1C=CCCC1 ZINC000679548895 488358098 /nfs/dbraw/zinc/35/80/98/488358098.db2.gz WHNCBGJWWSQTAS-UTUOFQBUSA-N 1 1 247.304 3.758 20 0 BHADMO C[C@@H]1CC[C@H](C(F)(F)F)C[N@H+]1[C@H]1C=CCCC1 ZINC000679548896 488358128 /nfs/dbraw/zinc/35/81/28/488358128.db2.gz WHNCBGJWWSQTAS-WOPDTQHZSA-N 1 1 247.304 3.758 20 0 BHADMO CCCCC[N@H+]1C[C@H](C(F)(F)F)CC[C@H]1C ZINC000679549882 488358017 /nfs/dbraw/zinc/35/80/17/488358017.db2.gz ZCVSZFUAKLSWJC-GHMZBOCLSA-N 1 1 237.309 3.839 20 0 BHADMO CCCCC[N@H+]1C[C@@H](C(F)(F)F)CC[C@H]1C ZINC000679549883 488358004 /nfs/dbraw/zinc/35/80/04/488358004.db2.gz ZCVSZFUAKLSWJC-MNOVXSKESA-N 1 1 237.309 3.839 20 0 BHADMO CCCCC[N@H+]1C[C@@H](C(F)(F)F)CC[C@@H]1C ZINC000679549885 488358055 /nfs/dbraw/zinc/35/80/55/488358055.db2.gz ZCVSZFUAKLSWJC-QWRGUYRKSA-N 1 1 237.309 3.839 20 0 BHADMO CCCCC[N@H+]1C[C@H](C(F)(F)F)CC[C@@H]1C ZINC000679549886 488358025 /nfs/dbraw/zinc/35/80/25/488358025.db2.gz ZCVSZFUAKLSWJC-WDEREUQCSA-N 1 1 237.309 3.839 20 0 BHADMO CC1CCC([N@@H+](C)CCC(C)(C)C)CC1 ZINC000679581671 488359140 /nfs/dbraw/zinc/35/91/40/488359140.db2.gz VTULYBFKQWWCNW-UHFFFAOYSA-N 1 1 211.393 3.933 20 0 BHADMO CCC[N@@H+](CCOC(C)C)Cc1ccc(C)cc1 ZINC000679636575 488361206 /nfs/dbraw/zinc/36/12/06/488361206.db2.gz XAUZTLUBLHZPSJ-UHFFFAOYSA-N 1 1 249.398 3.632 20 0 BHADMO CCCCC[N@@H+](CC)Cc1cccc(F)c1 ZINC000679642789 488361758 /nfs/dbraw/zinc/36/17/58/488361758.db2.gz CRMXKSWOMYNOAV-UHFFFAOYSA-N 1 1 223.335 3.838 20 0 BHADMO C[N@@H+](CCC(C)(C)C)Cc1ccsc1 ZINC000679652481 487779841 /nfs/dbraw/zinc/77/98/41/487779841.db2.gz GKLWLRVCISOGDH-UHFFFAOYSA-N 1 1 211.374 3.616 20 0 BHADMO CSc1ccccc1C[N@H+]1CCC[C@H]1C1CC1 ZINC000679671041 488363316 /nfs/dbraw/zinc/36/33/16/488363316.db2.gz NZHKTBUQNPUTMS-AWEZNQCLSA-N 1 1 247.407 3.783 20 0 BHADMO CSc1ccccc1C[N@H+]1CCC[C@@H]1C1CC1 ZINC000679671042 488363325 /nfs/dbraw/zinc/36/33/25/488363325.db2.gz NZHKTBUQNPUTMS-CQSZACIVSA-N 1 1 247.407 3.783 20 0 BHADMO CSc1ccccc1C[N@@H+](C)[C@H](C)C1CC1 ZINC000679671189 488363273 /nfs/dbraw/zinc/36/32/73/488363273.db2.gz QFHRHNSMVBWULQ-LLVKDONJSA-N 1 1 235.396 3.639 20 0 BHADMO CSc1ccccc1C[N@@H+](C)[C@@H](C)C1CC1 ZINC000679671190 488363235 /nfs/dbraw/zinc/36/32/35/488363235.db2.gz QFHRHNSMVBWULQ-NSHDSACASA-N 1 1 235.396 3.639 20 0 BHADMO CCC(C)(C)CC[N@H+]1CCC[C@@H](OC(F)F)C1 ZINC000679684435 488364743 /nfs/dbraw/zinc/36/47/43/488364743.db2.gz SFKHJBZYMYCDAF-LLVKDONJSA-N 1 1 249.345 3.516 20 0 BHADMO CCC(C)(C)CC[N@H+]1CCC[C@H](OC(F)F)C1 ZINC000679684436 488364673 /nfs/dbraw/zinc/36/46/73/488364673.db2.gz SFKHJBZYMYCDAF-NSHDSACASA-N 1 1 249.345 3.516 20 0 BHADMO C[C@H](c1ccncc1)[N@H+]1CC[C@]2(CC[C@@H](C)C2)C1 ZINC000679834178 488367180 /nfs/dbraw/zinc/36/71/80/488367180.db2.gz VGZUBQWPFJWKOL-FMKPAKJESA-N 1 1 244.382 3.655 20 0 BHADMO C[C@H](c1ccncc1)[N@H+]1CC[C@@]2(CC[C@@H](C)C2)C1 ZINC000679834179 488367399 /nfs/dbraw/zinc/36/73/99/488367399.db2.gz VGZUBQWPFJWKOL-IIAWOOMASA-N 1 1 244.382 3.655 20 0 BHADMO C[C@@H](c1ccncc1)[N@H+]1CC[C@@]2(CC[C@@H](C)C2)C1 ZINC000679834180 488367204 /nfs/dbraw/zinc/36/72/04/488367204.db2.gz VGZUBQWPFJWKOL-IJEWVQPXSA-N 1 1 244.382 3.655 20 0 BHADMO C[C@@H](c1ccncc1)[N@H+]1CC[C@]2(CC[C@@H](C)C2)C1 ZINC000679834181 488367158 /nfs/dbraw/zinc/36/71/58/488367158.db2.gz VGZUBQWPFJWKOL-YCPHGPKFSA-N 1 1 244.382 3.655 20 0 BHADMO COc1ccc(C)cc1C[N@@H+](C)CCC(C)(C)C ZINC000679890908 487481351 /nfs/dbraw/zinc/48/13/51/487481351.db2.gz BQXXWKHWVUQKJZ-UHFFFAOYSA-N 1 1 249.398 3.872 20 0 BHADMO CC(C)CC[N@@H+](C)CCCc1ccsc1 ZINC000679924612 487489711 /nfs/dbraw/zinc/48/97/11/487489711.db2.gz PSFVPLOIZXGMFJ-UHFFFAOYSA-N 1 1 225.401 3.659 20 0 BHADMO CC[N@@H+](CCCc1ccsc1)Cc1ccoc1 ZINC000679925111 487489378 /nfs/dbraw/zinc/48/93/78/487489378.db2.gz AYAIUHVCHFDFEW-UHFFFAOYSA-N 1 1 249.379 3.796 20 0 BHADMO c1cc(CCC[N@H+]2CCC[C@H]2C2CC2)cs1 ZINC000679925199 487489361 /nfs/dbraw/zinc/48/93/61/487489361.db2.gz DAINEPZHKAOMIG-AWEZNQCLSA-N 1 1 235.396 3.555 20 0 BHADMO c1cc(CCC[N@H+]2CCC[C@@H]2C2CC2)cs1 ZINC000679925200 487489496 /nfs/dbraw/zinc/48/94/96/487489496.db2.gz DAINEPZHKAOMIG-CQSZACIVSA-N 1 1 235.396 3.555 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)Cc1cccc2cnccc21 ZINC000679982245 487508088 /nfs/dbraw/zinc/50/80/88/487508088.db2.gz LEIBVHUOBKKXAT-CYBMUJFWSA-N 1 1 242.366 3.855 20 0 BHADMO CCC[C@H](C)[N@@H+](C)Cc1cccc2cnccc21 ZINC000679982250 487508065 /nfs/dbraw/zinc/50/80/65/487508065.db2.gz LEIBVHUOBKKXAT-ZDUSSCGKSA-N 1 1 242.366 3.855 20 0 BHADMO CC(C)[C@@H](C)[N@@H+](C)Cc1cccc2cnccc21 ZINC000679982422 487507882 /nfs/dbraw/zinc/50/78/82/487507882.db2.gz UDUJHUWDJOEBDU-CYBMUJFWSA-N 1 1 242.366 3.711 20 0 BHADMO CC(C)[C@H](C)[N@@H+](C)Cc1cccc2cnccc21 ZINC000679982423 487508075 /nfs/dbraw/zinc/50/80/75/487508075.db2.gz UDUJHUWDJOEBDU-ZDUSSCGKSA-N 1 1 242.366 3.711 20 0 BHADMO C[N@@H+](Cc1cccc2cnccc21)CC(C)(C)C ZINC000679983906 487508896 /nfs/dbraw/zinc/50/88/96/487508896.db2.gz QYXIQMOBBOZSNT-UHFFFAOYSA-N 1 1 242.366 3.713 20 0 BHADMO CC[C@H]1CCC[N@H+]1Cc1cccc2cnccc21 ZINC000679984678 487508944 /nfs/dbraw/zinc/50/89/44/487508944.db2.gz QCHPLYPVZFIKIY-HNNXBMFYSA-N 1 1 240.350 3.609 20 0 BHADMO CC[C@@H]1CCC[N@H+]1Cc1cccc2cnccc21 ZINC000679984683 487509036 /nfs/dbraw/zinc/50/90/36/487509036.db2.gz QCHPLYPVZFIKIY-OAHLLOKOSA-N 1 1 240.350 3.609 20 0 BHADMO C[C@H](Cc1ccsc1)[N@H+]1CCC[C@@H]1C1CC1 ZINC000679986017 487509956 /nfs/dbraw/zinc/50/99/56/487509956.db2.gz NPCZJGRUQQWIOY-BXUZGUMPSA-N 1 1 235.396 3.554 20 0 BHADMO C[C@@H](Cc1ccsc1)[N@H+]1CCC[C@H]1C1CC1 ZINC000679986018 487510065 /nfs/dbraw/zinc/51/00/65/487510065.db2.gz NPCZJGRUQQWIOY-FZMZJTMJSA-N 1 1 235.396 3.554 20 0 BHADMO C[C@H](Cc1ccsc1)[N@H+]1CCC[C@H]1C1CC1 ZINC000679986021 487510046 /nfs/dbraw/zinc/51/00/46/487510046.db2.gz NPCZJGRUQQWIOY-RISCZKNCSA-N 1 1 235.396 3.554 20 0 BHADMO C[C@@H](Cc1ccsc1)[N@H+]1CCC[C@@H]1C1CC1 ZINC000679986022 487510410 /nfs/dbraw/zinc/51/04/10/487510410.db2.gz NPCZJGRUQQWIOY-SMDDNHRTSA-N 1 1 235.396 3.554 20 0 BHADMO CC[N@@H+](Cc1ccoc1)[C@H](C)Cc1ccsc1 ZINC000679986078 487508819 /nfs/dbraw/zinc/50/88/19/487508819.db2.gz PBCQRCGHXPTQRT-GFCCVEGCSA-N 1 1 249.379 3.794 20 0 BHADMO CC[N@@H+](Cc1ccoc1)[C@@H](C)Cc1ccsc1 ZINC000679986079 487509853 /nfs/dbraw/zinc/50/98/53/487509853.db2.gz PBCQRCGHXPTQRT-LBPRGKRZSA-N 1 1 249.379 3.794 20 0 BHADMO CC[N@@H+](Cc1cccc2cnccc21)C1CCC1 ZINC000679990264 487511553 /nfs/dbraw/zinc/51/15/53/487511553.db2.gz TWMNKNUWXDIUEL-UHFFFAOYSA-N 1 1 240.350 3.609 20 0 BHADMO CC[C@H](C)[N@H+]1CCS[C@@H](c2ccccc2)C1 ZINC000680011431 487517788 /nfs/dbraw/zinc/51/77/88/487517788.db2.gz ZXEPTQKEECCCLA-GXTWGEPZSA-N 1 1 235.396 3.575 20 0 BHADMO CC[C@H](C)[N@H+]1CCS[C@H](c2ccccc2)C1 ZINC000680011433 487517888 /nfs/dbraw/zinc/51/78/88/487517888.db2.gz ZXEPTQKEECCCLA-JSGCOSHPSA-N 1 1 235.396 3.575 20 0 BHADMO CC[C@@H](C)[N@H+]1CCS[C@H](c2ccccc2)C1 ZINC000680011435 487518129 /nfs/dbraw/zinc/51/81/29/487518129.db2.gz ZXEPTQKEECCCLA-OCCSQVGLSA-N 1 1 235.396 3.575 20 0 BHADMO CC[C@@H](C)[N@H+]1CCS[C@@H](c2ccccc2)C1 ZINC000680011436 487517858 /nfs/dbraw/zinc/51/78/58/487517858.db2.gz ZXEPTQKEECCCLA-TZMCWYRMSA-N 1 1 235.396 3.575 20 0 BHADMO Clc1ccccc1CCC[N@@H+]1CC=CCC1 ZINC000680078039 487533943 /nfs/dbraw/zinc/53/39/43/487533943.db2.gz VCHVQUAFKAHCGC-UHFFFAOYSA-N 1 1 235.758 3.535 20 0 BHADMO C[C@H]1C[N@@H+](CCCOC(C)(C)C)CC(C)(C)C1 ZINC000680089618 487535122 /nfs/dbraw/zinc/53/51/22/487535122.db2.gz IFSUXFMWHIJVKX-CYBMUJFWSA-N 1 1 241.419 3.560 20 0 BHADMO C[C@@H]1C[N@@H+](CCCOC(C)(C)C)CC(C)(C)C1 ZINC000680089619 487534859 /nfs/dbraw/zinc/53/48/59/487534859.db2.gz IFSUXFMWHIJVKX-ZDUSSCGKSA-N 1 1 241.419 3.560 20 0 BHADMO C[C@H](c1ccncc1)[N@H+]1C[C@H](C)CC(C)(C)C1 ZINC000680090111 487534893 /nfs/dbraw/zinc/53/48/93/487534893.db2.gz AWMQYOOWNBXWCI-CHWSQXEVSA-N 1 1 232.371 3.511 20 0 BHADMO C[C@@H](c1ccncc1)[N@H+]1C[C@H](C)CC(C)(C)C1 ZINC000680090114 487534575 /nfs/dbraw/zinc/53/45/75/487534575.db2.gz AWMQYOOWNBXWCI-OLZOCXBDSA-N 1 1 232.371 3.511 20 0 BHADMO C[C@H](c1ccncc1)[N@H+]1C[C@@H](C)CC(C)(C)C1 ZINC000680090118 487534745 /nfs/dbraw/zinc/53/47/45/487534745.db2.gz AWMQYOOWNBXWCI-QWHCGFSZSA-N 1 1 232.371 3.511 20 0 BHADMO C[C@@H](c1ccncc1)[N@H+]1C[C@@H](C)CC(C)(C)C1 ZINC000680090121 487535211 /nfs/dbraw/zinc/53/52/11/487535211.db2.gz AWMQYOOWNBXWCI-STQMWFEESA-N 1 1 232.371 3.511 20 0 BHADMO CC(C)(C)OCCC[N@H+]1CC[C@@H](C(C)(C)C)C1 ZINC000680111607 487536778 /nfs/dbraw/zinc/53/67/78/487536778.db2.gz KBWUSLFZLHKMDG-CYBMUJFWSA-N 1 1 241.419 3.560 20 0 BHADMO CC(C)(C)OCCC[N@H+]1CC[C@H](C(C)(C)C)C1 ZINC000680111608 487536602 /nfs/dbraw/zinc/53/66/02/487536602.db2.gz KBWUSLFZLHKMDG-ZDUSSCGKSA-N 1 1 241.419 3.560 20 0 BHADMO C[C@@H](c1ccncc1)[N@H+]1CC[C@@H](C(C)(C)C)C1 ZINC000680112082 487537134 /nfs/dbraw/zinc/53/71/34/487537134.db2.gz PWUYLULVOPMRSZ-GXTWGEPZSA-N 1 1 232.371 3.511 20 0 BHADMO C[C@@H](c1ccncc1)[N@H+]1CC[C@H](C(C)(C)C)C1 ZINC000680112084 487537495 /nfs/dbraw/zinc/53/74/95/487537495.db2.gz PWUYLULVOPMRSZ-JSGCOSHPSA-N 1 1 232.371 3.511 20 0 BHADMO C[C@H](c1ccncc1)[N@H+]1CC[C@H](C(C)(C)C)C1 ZINC000680112086 487537090 /nfs/dbraw/zinc/53/70/90/487537090.db2.gz PWUYLULVOPMRSZ-OCCSQVGLSA-N 1 1 232.371 3.511 20 0 BHADMO C[C@H](c1ccncc1)[N@H+]1CC[C@@H](C(C)(C)C)C1 ZINC000680112087 487536997 /nfs/dbraw/zinc/53/69/97/487536997.db2.gz PWUYLULVOPMRSZ-TZMCWYRMSA-N 1 1 232.371 3.511 20 0 BHADMO CCC[C@H]1CCCC[N@H+]1CCCOC(C)(C)C ZINC000680434279 487592411 /nfs/dbraw/zinc/59/24/11/487592411.db2.gz NPIPATSTPJCAIC-AWEZNQCLSA-N 1 1 241.419 3.846 20 0 BHADMO CCC[C@@H]1CCCC[N@H+]1CCCOC(C)(C)C ZINC000680434280 487593174 /nfs/dbraw/zinc/59/31/74/487593174.db2.gz NPIPATSTPJCAIC-CQSZACIVSA-N 1 1 241.419 3.846 20 0 BHADMO c1ccc(C2CC2)c(C[N@H+]2CCCSCC2)c1 ZINC000680475848 487602707 /nfs/dbraw/zinc/60/27/07/487602707.db2.gz ORBWGLJZLQTKBD-UHFFFAOYSA-N 1 1 247.407 3.503 20 0 BHADMO Cc1ccc[nH+]c1NCc1nccc2ccccc21 ZINC000680536223 487613918 /nfs/dbraw/zinc/61/39/18/487613918.db2.gz MDACIGGHSSNAKK-UHFFFAOYSA-N 1 1 249.317 3.550 20 0 BHADMO C[C@@H]1CC[N@@H+](CCCOC(C)(C)C)CC1(C)C ZINC000680586021 487618272 /nfs/dbraw/zinc/61/82/72/487618272.db2.gz MKLXLGRVRPJAGR-CYBMUJFWSA-N 1 1 241.419 3.560 20 0 BHADMO C[C@H]1CC[N@@H+](CCCOC(C)(C)C)CC1(C)C ZINC000680586022 487615221 /nfs/dbraw/zinc/61/52/21/487615221.db2.gz MKLXLGRVRPJAGR-ZDUSSCGKSA-N 1 1 241.419 3.560 20 0 BHADMO C[C@H](c1ccncc1)[N@H+]1CC[C@@H](C)C(C)(C)C1 ZINC000680586779 487619490 /nfs/dbraw/zinc/61/94/90/487619490.db2.gz ZDUBMTMFGLUFFI-CHWSQXEVSA-N 1 1 232.371 3.511 20 0 BHADMO C[C@@H](c1ccncc1)[N@H+]1CC[C@@H](C)C(C)(C)C1 ZINC000680586780 487619121 /nfs/dbraw/zinc/61/91/21/487619121.db2.gz ZDUBMTMFGLUFFI-OLZOCXBDSA-N 1 1 232.371 3.511 20 0 BHADMO C[C@H](c1ccncc1)[N@H+]1CC[C@H](C)C(C)(C)C1 ZINC000680586781 487619002 /nfs/dbraw/zinc/61/90/02/487619002.db2.gz ZDUBMTMFGLUFFI-QWHCGFSZSA-N 1 1 232.371 3.511 20 0 BHADMO C[C@@H](c1ccncc1)[N@H+]1CC[C@H](C)C(C)(C)C1 ZINC000680586782 487619505 /nfs/dbraw/zinc/61/95/05/487619505.db2.gz ZDUBMTMFGLUFFI-STQMWFEESA-N 1 1 232.371 3.511 20 0 BHADMO CCCC[C@@H](CC)C[N@@H+](CC)C[C@@H]1CCOC1 ZINC000680634795 487626362 /nfs/dbraw/zinc/62/63/62/487626362.db2.gz RNUFQDSMTOOJOF-CABCVRRESA-N 1 1 241.419 3.561 20 0 BHADMO CCCC[C@H](CC)C[N@@H+](CC)C[C@@H]1CCOC1 ZINC000680634796 487626445 /nfs/dbraw/zinc/62/64/45/487626445.db2.gz RNUFQDSMTOOJOF-GJZGRUSLSA-N 1 1 241.419 3.561 20 0 BHADMO CCCC[C@@H](CC)C[N@@H+](CC)C[C@H]1CCOC1 ZINC000680634797 487626195 /nfs/dbraw/zinc/62/61/95/487626195.db2.gz RNUFQDSMTOOJOF-HUUCEWRRSA-N 1 1 241.419 3.561 20 0 BHADMO CCCC[C@H](CC)C[N@@H+](CC)C[C@H]1CCOC1 ZINC000680634798 487625675 /nfs/dbraw/zinc/62/56/75/487625675.db2.gz RNUFQDSMTOOJOF-LSDHHAIUSA-N 1 1 241.419 3.561 20 0 BHADMO CCCC[C@@H](CC)C[N@H+]1CC[C@H](C(F)F)C1 ZINC000680634838 487626123 /nfs/dbraw/zinc/62/61/23/487626123.db2.gz TXEBCPYEOLFXGJ-NEPJUHHUSA-N 1 1 233.346 3.790 20 0 BHADMO CCCC[C@H](CC)C[N@H+]1CC[C@@H](C(F)F)C1 ZINC000680634842 487625738 /nfs/dbraw/zinc/62/57/38/487625738.db2.gz TXEBCPYEOLFXGJ-NWDGAFQWSA-N 1 1 233.346 3.790 20 0 BHADMO CCCC[C@H](CC)C[N@H+]1CC[C@H](C(F)F)C1 ZINC000680634843 487625957 /nfs/dbraw/zinc/62/59/57/487625957.db2.gz TXEBCPYEOLFXGJ-RYUDHWBXSA-N 1 1 233.346 3.790 20 0 BHADMO CCCC[C@@H](CC)C[N@H+]1CC[C@@H](C(F)F)C1 ZINC000680634845 487625768 /nfs/dbraw/zinc/62/57/68/487625768.db2.gz TXEBCPYEOLFXGJ-VXGBXAGGSA-N 1 1 233.346 3.790 20 0 BHADMO CCCC[C@@H](CC)C[N@H+]1CCC[C@H](OC)CC1 ZINC000680636662 487626603 /nfs/dbraw/zinc/62/66/03/487626603.db2.gz ODNUGWWCKWMARG-CABCVRRESA-N 1 1 241.419 3.704 20 0 BHADMO CCCC[C@H](CC)C[N@H+]1CCC[C@H](OC)CC1 ZINC000680636663 487625620 /nfs/dbraw/zinc/62/56/20/487625620.db2.gz ODNUGWWCKWMARG-GJZGRUSLSA-N 1 1 241.419 3.704 20 0 BHADMO CCCC[C@@H](CC)C[N@H+]1CCC[C@@H](OC)CC1 ZINC000680636664 487625891 /nfs/dbraw/zinc/62/58/91/487625891.db2.gz ODNUGWWCKWMARG-HUUCEWRRSA-N 1 1 241.419 3.704 20 0 BHADMO CCCC[C@H](CC)C[N@H+]1CCC[C@@H](OC)CC1 ZINC000680636665 487626532 /nfs/dbraw/zinc/62/65/32/487626532.db2.gz ODNUGWWCKWMARG-LSDHHAIUSA-N 1 1 241.419 3.704 20 0 BHADMO FC(F)[C@@H]1CCC[N@H+]1CC1CCCCCC1 ZINC000680817993 487651180 /nfs/dbraw/zinc/65/11/80/487651180.db2.gz JPSJDCOXBOGRLM-LBPRGKRZSA-N 1 1 231.330 3.686 20 0 BHADMO FC(F)[C@@H]1CC[N@@H+](CC2CCCCCC2)C1 ZINC000680818327 487651057 /nfs/dbraw/zinc/65/10/57/487651057.db2.gz UUTAFIDTBYLKNA-GFCCVEGCSA-N 1 1 231.330 3.544 20 0 BHADMO FC(F)[C@H]1CC[N@@H+](CC2CCCCCC2)C1 ZINC000680818328 487651068 /nfs/dbraw/zinc/65/10/68/487651068.db2.gz UUTAFIDTBYLKNA-LBPRGKRZSA-N 1 1 231.330 3.544 20 0 BHADMO CCC1(C[NH2+][C@H](C)c2cn[nH]c2C)CCCCC1 ZINC000680827078 487653099 /nfs/dbraw/zinc/65/30/99/487653099.db2.gz DDUMGRBDTUOWIM-GFCCVEGCSA-N 1 1 249.402 3.729 20 0 BHADMO CCC1(C[NH2+][C@@H](C)c2cn[nH]c2C)CCCCC1 ZINC000680827079 487653272 /nfs/dbraw/zinc/65/32/72/487653272.db2.gz DDUMGRBDTUOWIM-LBPRGKRZSA-N 1 1 249.402 3.729 20 0 BHADMO Cc1ccc2c(C)cc(NC3CC=CC3)[nH+]c2c1 ZINC000680856140 487659143 /nfs/dbraw/zinc/65/91/43/487659143.db2.gz UWEOSJGIBMUWSE-UHFFFAOYSA-N 1 1 238.334 3.982 20 0 BHADMO Cc1ccc2c(C)cc(N3CC=CCC3)[nH+]c2c1 ZINC000680857797 487633269 /nfs/dbraw/zinc/63/32/69/487633269.db2.gz UBBKRSDNHQWROI-UHFFFAOYSA-N 1 1 238.334 3.618 20 0 BHADMO C[C@@H]1CC[N@@H+](CC(F)F)CC12CCCCC2 ZINC000680901082 487669522 /nfs/dbraw/zinc/66/95/22/487669522.db2.gz DHCGPFOXYIYPEV-LLVKDONJSA-N 1 1 231.330 3.544 20 0 BHADMO C[C@@H]1CC[N@H+](CC(F)F)CC12CCCCC2 ZINC000680901082 487669514 /nfs/dbraw/zinc/66/95/14/487669514.db2.gz DHCGPFOXYIYPEV-LLVKDONJSA-N 1 1 231.330 3.544 20 0 BHADMO C[C@H]1CC[N@@H+](CC(F)F)CC12CCCCC2 ZINC000680901095 487669972 /nfs/dbraw/zinc/66/99/72/487669972.db2.gz DHCGPFOXYIYPEV-NSHDSACASA-N 1 1 231.330 3.544 20 0 BHADMO C[C@H]1CC[N@H+](CC(F)F)CC12CCCCC2 ZINC000680901095 487669965 /nfs/dbraw/zinc/66/99/65/487669965.db2.gz DHCGPFOXYIYPEV-NSHDSACASA-N 1 1 231.330 3.544 20 0 BHADMO Cc1ccc(C[N@@H+](C2CC2)C2CCCCC2)cn1 ZINC000680931547 487673476 /nfs/dbraw/zinc/67/34/76/487673476.db2.gz VBDOCMOFZKAHEH-UHFFFAOYSA-N 1 1 244.382 3.687 20 0 BHADMO Cc1cc(C)cc(OCC[N@H+](C)C2CCCC2)c1 ZINC000680941615 487675603 /nfs/dbraw/zinc/67/56/03/487675603.db2.gz SKBHXHVTGJJTJC-UHFFFAOYSA-N 1 1 247.382 3.557 20 0 BHADMO CC/C=C\CC[N@@H+](C)Cc1ccsc1 ZINC000681019673 487697490 /nfs/dbraw/zinc/69/74/90/487697490.db2.gz ZPZKZOUFKYOUJK-PLNGDYQASA-N 1 1 209.358 3.536 20 0 BHADMO CC/C=C/CC[N@@H+](C)Cc1ccsc1 ZINC000681019680 487697560 /nfs/dbraw/zinc/69/75/60/487697560.db2.gz ZPZKZOUFKYOUJK-SNAWJCMRSA-N 1 1 209.358 3.536 20 0 BHADMO CC/C=C\CC[N@@H+](Cc1ccc(C)o1)C1CC1 ZINC000681020415 487697307 /nfs/dbraw/zinc/69/73/07/487697307.db2.gz YLTJUWDAHGOKAG-PLNGDYQASA-N 1 1 233.355 3.909 20 0 BHADMO CC/C=C/CC[N@@H+](Cc1ccc(C)o1)C1CC1 ZINC000681020416 487697174 /nfs/dbraw/zinc/69/71/74/487697174.db2.gz YLTJUWDAHGOKAG-SNAWJCMRSA-N 1 1 233.355 3.909 20 0 BHADMO CC/C=C/CC[N@@H+](CC)CCC(F)(F)F ZINC000681021129 487697077 /nfs/dbraw/zinc/69/70/77/487697077.db2.gz IVKHWGQWQBEUMO-AATRIKPKSA-N 1 1 223.282 3.617 20 0 BHADMO CC/C=C\CC[N@@H+](CC)CCC(F)(F)F ZINC000681021130 487697448 /nfs/dbraw/zinc/69/74/48/487697448.db2.gz IVKHWGQWQBEUMO-WAYWQWQTSA-N 1 1 223.282 3.617 20 0 BHADMO CC/C=C\CC[N@H+]1CCCc2sccc2C1 ZINC000681021603 487698721 /nfs/dbraw/zinc/69/87/21/487698721.db2.gz PEROHEDFHZLANR-ARJAWSKDSA-N 1 1 235.396 3.853 20 0 BHADMO CC/C=C/CC[N@H+]1CCCc2sccc2C1 ZINC000681021604 487699045 /nfs/dbraw/zinc/69/90/45/487699045.db2.gz PEROHEDFHZLANR-ONEGZZNKSA-N 1 1 235.396 3.853 20 0 BHADMO CC/C=C/CC[N@H+]1CCC[C@H]1c1ccc(O)cc1 ZINC000681022302 487698821 /nfs/dbraw/zinc/69/88/21/487698821.db2.gz AYJHRQVNDVXFQS-CWDCEQMOSA-N 1 1 245.366 3.885 20 0 BHADMO CC/C=C\CC[N@H+]1CCC[C@@H]1c1ccc(O)cc1 ZINC000681022303 487698488 /nfs/dbraw/zinc/69/84/88/487698488.db2.gz AYJHRQVNDVXFQS-MJSXRHKHSA-N 1 1 245.366 3.885 20 0 BHADMO CC/C=C/CC[N@H+]1CCC[C@@H]1c1ccc(O)cc1 ZINC000681022304 487698957 /nfs/dbraw/zinc/69/89/57/487698957.db2.gz AYJHRQVNDVXFQS-QDLOVBKTSA-N 1 1 245.366 3.885 20 0 BHADMO CC/C=C\CC[N@H+]1CCC[C@H]1c1ccc(O)cc1 ZINC000681022305 487699145 /nfs/dbraw/zinc/69/91/45/487699145.db2.gz AYJHRQVNDVXFQS-QGZUEGPWSA-N 1 1 245.366 3.885 20 0 BHADMO CC/C=C\CC[N@H+]1CC[C@@H]1c1cccc(F)c1 ZINC000681024795 487699955 /nfs/dbraw/zinc/69/99/55/487699955.db2.gz MQGUXZBGHYOAKB-ABCZVMIZSA-N 1 1 233.330 3.929 20 0 BHADMO CC/C=C/CC[N@H+]1CC[C@H]1c1cccc(F)c1 ZINC000681024798 487699802 /nfs/dbraw/zinc/69/98/02/487699802.db2.gz MQGUXZBGHYOAKB-BWPKMQGJSA-N 1 1 233.330 3.929 20 0 BHADMO CC/C=C\CC[N@H+]1CC[C@H]1c1cccc(F)c1 ZINC000681024800 487699971 /nfs/dbraw/zinc/69/99/71/487699971.db2.gz MQGUXZBGHYOAKB-JZIMQPMSSA-N 1 1 233.330 3.929 20 0 BHADMO CC/C=C/CC[N@H+]1CC[C@@H]1c1cccc(F)c1 ZINC000681024801 487699715 /nfs/dbraw/zinc/69/97/15/487699715.db2.gz MQGUXZBGHYOAKB-NHZBNJEXSA-N 1 1 233.330 3.929 20 0 BHADMO CCCCOc1ccccc1C[N@@H+]1CC=CCC1 ZINC000681081152 487716382 /nfs/dbraw/zinc/71/63/82/487716382.db2.gz BJOFWHRIFZALPQ-UHFFFAOYSA-N 1 1 245.366 3.627 20 0 BHADMO FC(F)(F)C1CCC(C[N@@H+]2CC=CCC2)CC1 ZINC000681083327 487717116 /nfs/dbraw/zinc/71/71/16/487717116.db2.gz SVEITPZACKLJOE-UHFFFAOYSA-N 1 1 247.304 3.617 20 0 BHADMO FC1=CCC[N@@H+](Cc2ccccc2C2CC2)C1 ZINC000681166319 487739819 /nfs/dbraw/zinc/73/98/19/487739819.db2.gz VRKJTLORYMMLAO-UHFFFAOYSA-N 1 1 231.314 3.623 20 0 BHADMO FC1=CCC[N@H+](Cc2ccccc2C2CC2)C1 ZINC000681166319 487739815 /nfs/dbraw/zinc/73/98/15/487739815.db2.gz VRKJTLORYMMLAO-UHFFFAOYSA-N 1 1 231.314 3.623 20 0 BHADMO Clc1cscc1C[N@H+]1CCCC2(CC2)C1 ZINC000681167955 487740539 /nfs/dbraw/zinc/74/05/39/487740539.db2.gz DJIZQBHLDATJOD-UHFFFAOYSA-N 1 1 241.787 3.778 20 0 BHADMO c1ccc(C2CC2)c(C[N@H+]2CCCC3(CC3)C2)c1 ZINC000681167991 487740759 /nfs/dbraw/zinc/74/07/59/487740759.db2.gz OJTLAJGOJAXNRB-UHFFFAOYSA-N 1 1 241.378 3.940 20 0 BHADMO Cc1cccc(N[C@@H]2C[C@]2(C)c2ccccc2)[nH+]1 ZINC000681209007 487747948 /nfs/dbraw/zinc/74/79/48/487747948.db2.gz RCZKQCGVWLWHBF-GDBMZVCRSA-N 1 1 238.334 3.532 20 0 BHADMO Cc1cccc(N[C@H]2C[C@]2(C)c2ccccc2)[nH+]1 ZINC000681209008 487748088 /nfs/dbraw/zinc/74/80/88/487748088.db2.gz RCZKQCGVWLWHBF-GOEBONIOSA-N 1 1 238.334 3.532 20 0 BHADMO Cc1cccc(N[C@H]2C[C@@]2(C)c2ccccc2)[nH+]1 ZINC000681209009 487748189 /nfs/dbraw/zinc/74/81/89/487748189.db2.gz RCZKQCGVWLWHBF-HOCLYGCPSA-N 1 1 238.334 3.532 20 0 BHADMO Cc1cccc(N[C@@H]2C[C@@]2(C)c2ccccc2)[nH+]1 ZINC000681209010 487747898 /nfs/dbraw/zinc/74/78/98/487747898.db2.gz RCZKQCGVWLWHBF-ZBFHGGJFSA-N 1 1 238.334 3.532 20 0 BHADMO CC(C)c1cccc(C[NH2+]Cc2nccs2)c1 ZINC000681367438 487786845 /nfs/dbraw/zinc/78/68/45/487786845.db2.gz AUQAPVUQEHWRMJ-UHFFFAOYSA-N 1 1 246.379 3.556 20 0 BHADMO c1ccc(CCCC[N@@H+]2[C@H]3C=CC[C@@H]2CC3)cc1 ZINC000681407308 487794977 /nfs/dbraw/zinc/79/49/77/487794977.db2.gz DEXJIOSOQQHFQF-DLBZAZTESA-N 1 1 241.378 3.802 20 0 BHADMO C[C@@H](c1cccc(Cl)c1F)[N@@H+]1CC=CCC1 ZINC000681410338 487795837 /nfs/dbraw/zinc/79/58/37/487795837.db2.gz PODPAQQUUMTQGX-JTQLQIEISA-N 1 1 239.721 3.802 20 0 BHADMO C[C@@H](c1cccc(Cl)c1F)[N@H+]1CC=CCC1 ZINC000681410338 487795831 /nfs/dbraw/zinc/79/58/31/487795831.db2.gz PODPAQQUUMTQGX-JTQLQIEISA-N 1 1 239.721 3.802 20 0 BHADMO C[C@H](c1cccc(Cl)c1F)[N@@H+]1CC=CCC1 ZINC000681410339 487795305 /nfs/dbraw/zinc/79/53/05/487795305.db2.gz PODPAQQUUMTQGX-SNVBAGLBSA-N 1 1 239.721 3.802 20 0 BHADMO C[C@H](c1cccc(Cl)c1F)[N@H+]1CC=CCC1 ZINC000681410339 487795300 /nfs/dbraw/zinc/79/53/00/487795300.db2.gz PODPAQQUUMTQGX-SNVBAGLBSA-N 1 1 239.721 3.802 20 0 BHADMO CCCC[C@@H](C)[N@@H+](C)Cc1cccs1 ZINC000681640904 487828595 /nfs/dbraw/zinc/82/85/95/487828595.db2.gz IGLTVTTUMSBGBT-LLVKDONJSA-N 1 1 211.374 3.759 20 0 BHADMO CCCC[C@H](C)[N@@H+](C)Cc1cccs1 ZINC000681640905 487828944 /nfs/dbraw/zinc/82/89/44/487828944.db2.gz IGLTVTTUMSBGBT-NSHDSACASA-N 1 1 211.374 3.759 20 0 BHADMO CCCC[C@@H](C)[N@@H+](C)Cc1ccccc1OC ZINC000681641506 487829757 /nfs/dbraw/zinc/82/97/57/487829757.db2.gz LQKVVRLJXPXHSJ-CYBMUJFWSA-N 1 1 235.371 3.706 20 0 BHADMO CCCC[C@H](C)[N@@H+](C)Cc1ccccc1OC ZINC000681641507 487830163 /nfs/dbraw/zinc/83/01/63/487830163.db2.gz LQKVVRLJXPXHSJ-ZDUSSCGKSA-N 1 1 235.371 3.706 20 0 BHADMO CCCC[C@@H](C)[N@@H+](C)Cc1ccsc1 ZINC000681645528 487829747 /nfs/dbraw/zinc/82/97/47/487829747.db2.gz XVFMOSAIWCHPBK-LLVKDONJSA-N 1 1 211.374 3.759 20 0 BHADMO CCCC[C@H](C)[N@@H+](C)Cc1ccsc1 ZINC000681645529 487829847 /nfs/dbraw/zinc/82/98/47/487829847.db2.gz XVFMOSAIWCHPBK-NSHDSACASA-N 1 1 211.374 3.759 20 0 BHADMO CCC[N@@H+](C)[C@H](C)c1cc(C)c(OC)cc1C ZINC000681659308 487833001 /nfs/dbraw/zinc/83/30/01/487833001.db2.gz ZQTQIWBAWOZGRR-CYBMUJFWSA-N 1 1 235.371 3.715 20 0 BHADMO CCC[N@@H+](C)[C@@H](C)c1cc(C)c(OC)cc1C ZINC000681659309 487831282 /nfs/dbraw/zinc/83/12/82/487831282.db2.gz ZQTQIWBAWOZGRR-ZDUSSCGKSA-N 1 1 235.371 3.715 20 0 BHADMO COc1cc(C)c([C@@H](C)[N@@H+](C)CC2CC2)cc1C ZINC000681679220 487835730 /nfs/dbraw/zinc/83/57/30/487835730.db2.gz XLEZNSLGTSIZKZ-CYBMUJFWSA-N 1 1 247.382 3.715 20 0 BHADMO COc1cc(C)c([C@H](C)[N@@H+](C)CC2CC2)cc1C ZINC000681679221 487835947 /nfs/dbraw/zinc/83/59/47/487835947.db2.gz XLEZNSLGTSIZKZ-ZDUSSCGKSA-N 1 1 247.382 3.715 20 0 BHADMO COc1cc(C)c([C@@H](C)[N@H+]2CC[C@@H](C)C2)cc1C ZINC000681684535 487840381 /nfs/dbraw/zinc/84/03/81/487840381.db2.gz OSOVHJIVBPJQFA-BXUZGUMPSA-N 1 1 247.382 3.715 20 0 BHADMO COc1cc(C)c([C@H](C)[N@H+]2CC[C@H](C)C2)cc1C ZINC000681684537 487840409 /nfs/dbraw/zinc/84/04/09/487840409.db2.gz OSOVHJIVBPJQFA-FZMZJTMJSA-N 1 1 247.382 3.715 20 0 BHADMO COc1cc(C)c([C@H](C)[N@H+]2CC[C@@H](C)C2)cc1C ZINC000681684539 487840368 /nfs/dbraw/zinc/84/03/68/487840368.db2.gz OSOVHJIVBPJQFA-RISCZKNCSA-N 1 1 247.382 3.715 20 0 BHADMO COc1cc(C)c([C@@H](C)[N@H+]2CC[C@H](C)C2)cc1C ZINC000681684540 487840458 /nfs/dbraw/zinc/84/04/58/487840458.db2.gz OSOVHJIVBPJQFA-SMDDNHRTSA-N 1 1 247.382 3.715 20 0 BHADMO Clc1ccc(C[N@H+]2CC[C@@H]3CCC[C@H]32)cc1 ZINC000681712212 487848327 /nfs/dbraw/zinc/84/83/27/487848327.db2.gz QTDBGUSFYYQJKS-GXTWGEPZSA-N 1 1 235.758 3.714 20 0 BHADMO Clc1ccc(C[N@H+]2CC[C@@H]3CCC[C@@H]32)cc1 ZINC000681712213 487847839 /nfs/dbraw/zinc/84/78/39/487847839.db2.gz QTDBGUSFYYQJKS-JSGCOSHPSA-N 1 1 235.758 3.714 20 0 BHADMO Clc1ccc(C[N@H+]2CC[C@H]3CCC[C@@H]32)cc1 ZINC000681712214 487848697 /nfs/dbraw/zinc/84/86/97/487848697.db2.gz QTDBGUSFYYQJKS-OCCSQVGLSA-N 1 1 235.758 3.714 20 0 BHADMO Clc1ccc(C[N@H+]2CC[C@H]3CCC[C@H]32)cc1 ZINC000681712215 487513839 /nfs/dbraw/zinc/51/38/39/487513839.db2.gz QTDBGUSFYYQJKS-TZMCWYRMSA-N 1 1 235.758 3.714 20 0 BHADMO Fc1cncc(C[N@@H+](C2CC2)C2CCCCC2)c1 ZINC000681750443 487853363 /nfs/dbraw/zinc/85/33/63/487853363.db2.gz LGRSSKXMZCIEAW-UHFFFAOYSA-N 1 1 248.345 3.518 20 0 BHADMO C[C@H](Cc1ccsc1)[N@H+]1CC[C@H]2CCC[C@@H]21 ZINC000681754566 487854432 /nfs/dbraw/zinc/85/44/32/487854432.db2.gz FNLYSFLUAVBSHW-BNOWGMLFSA-N 1 1 235.396 3.554 20 0 BHADMO C[C@H](Cc1ccsc1)[N@H+]1CC[C@@H]2CCC[C@H]21 ZINC000681754567 487854586 /nfs/dbraw/zinc/85/45/86/487854586.db2.gz FNLYSFLUAVBSHW-KWCYVHTRSA-N 1 1 235.396 3.554 20 0 BHADMO C[C@H](Cc1ccsc1)[N@H+]1CC[C@H]2CCC[C@H]21 ZINC000681754568 487854993 /nfs/dbraw/zinc/85/49/93/487854993.db2.gz FNLYSFLUAVBSHW-MRVWCRGKSA-N 1 1 235.396 3.554 20 0 BHADMO C[C@H](Cc1ccsc1)[N@H+]1CC[C@@H]2CCC[C@@H]21 ZINC000681754569 487854605 /nfs/dbraw/zinc/85/46/05/487854605.db2.gz FNLYSFLUAVBSHW-XBFCOCLRSA-N 1 1 235.396 3.554 20 0 BHADMO Clc1cscc1C[N@H+]1CC[C@H]2CCC[C@H]21 ZINC000681754755 487854864 /nfs/dbraw/zinc/85/48/64/487854864.db2.gz JTTPFPQAJPCXCG-BXKDBHETSA-N 1 1 241.787 3.776 20 0 BHADMO Clc1cscc1C[N@H+]1CC[C@@H]2CCC[C@@H]21 ZINC000681754756 487855002 /nfs/dbraw/zinc/85/50/02/487855002.db2.gz JTTPFPQAJPCXCG-CABZTGNLSA-N 1 1 241.787 3.776 20 0 BHADMO Clc1cscc1C[N@H+]1CC[C@@H]2CCC[C@H]21 ZINC000681754857 487855128 /nfs/dbraw/zinc/85/51/28/487855128.db2.gz JTTPFPQAJPCXCG-JOYOIKCWSA-N 1 1 241.787 3.776 20 0 BHADMO Clc1cscc1C[N@H+]1CC[C@H]2CCC[C@@H]21 ZINC000681754858 487854449 /nfs/dbraw/zinc/85/44/49/487854449.db2.gz JTTPFPQAJPCXCG-SKDRFNHKSA-N 1 1 241.787 3.776 20 0 BHADMO c1ccc(C2CC2)c(C[N@H+]2CC[C@H]3CCC[C@@H]32)c1 ZINC000681754891 487854959 /nfs/dbraw/zinc/85/49/59/487854959.db2.gz KOVSPOGLHFFXDA-PBHICJAKSA-N 1 1 241.378 3.938 20 0 BHADMO c1ccc(C2CC2)c(C[N@H+]2CC[C@H]3CCC[C@H]32)c1 ZINC000681754892 487854885 /nfs/dbraw/zinc/85/48/85/487854885.db2.gz KOVSPOGLHFFXDA-RHSMWYFYSA-N 1 1 241.378 3.938 20 0 BHADMO c1ccc(C2CC2)c(C[N@H+]2CC[C@@H]3CCC[C@H]32)c1 ZINC000681754893 491106626 /nfs/dbraw/zinc/10/66/26/491106626.db2.gz KOVSPOGLHFFXDA-WMLDXEAASA-N 1 1 241.378 3.938 20 0 BHADMO c1ccc(C2CC2)c(C[N@H+]2CC[C@@H]3CCC[C@@H]32)c1 ZINC000681754894 491106617 /nfs/dbraw/zinc/10/66/17/491106617.db2.gz KOVSPOGLHFFXDA-YOEHRIQHSA-N 1 1 241.378 3.938 20 0 BHADMO CC(C)CCC[N@@H+](C)Cc1ccsc1 ZINC000681755377 487856038 /nfs/dbraw/zinc/85/60/38/487856038.db2.gz SMJDVDMTGHBXIM-UHFFFAOYSA-N 1 1 211.374 3.616 20 0 BHADMO CCc1ccc(C[N@H+]2CC[C@H]3CCC[C@H]32)s1 ZINC000681755869 487855896 /nfs/dbraw/zinc/85/58/96/487855896.db2.gz YXAJAFUJRGUCGI-BXUZGUMPSA-N 1 1 235.396 3.685 20 0 BHADMO CCc1ccc(C[N@H+]2CC[C@@H]3CCC[C@@H]32)s1 ZINC000681755871 487856381 /nfs/dbraw/zinc/85/63/81/487856381.db2.gz YXAJAFUJRGUCGI-FZMZJTMJSA-N 1 1 235.396 3.685 20 0 BHADMO CCc1ccc(C[N@H+]2CC[C@H]3CCC[C@@H]32)s1 ZINC000681755873 487855688 /nfs/dbraw/zinc/85/56/88/487855688.db2.gz YXAJAFUJRGUCGI-RISCZKNCSA-N 1 1 235.396 3.685 20 0 BHADMO CCc1ccc(C[N@H+]2CC[C@@H]3CCC[C@H]32)s1 ZINC000681755874 487538711 /nfs/dbraw/zinc/53/87/11/487538711.db2.gz YXAJAFUJRGUCGI-SMDDNHRTSA-N 1 1 235.396 3.685 20 0 BHADMO CC(C)(C)CCC[N@H+]1CC[C@@H](c2ccco2)C1 ZINC000682028315 487882486 /nfs/dbraw/zinc/88/24/86/487882486.db2.gz FDRVJRGCQYGNPD-CYBMUJFWSA-N 1 1 235.371 3.895 20 0 BHADMO CC(C)(C)CCC[N@H+]1CC[C@H](c2ccco2)C1 ZINC000682028316 487882638 /nfs/dbraw/zinc/88/26/38/487882638.db2.gz FDRVJRGCQYGNPD-ZDUSSCGKSA-N 1 1 235.371 3.895 20 0 BHADMO CC(C)(C)CCC[N@H+]1CCC[C@H]1C(F)F ZINC000682029231 487884134 /nfs/dbraw/zinc/88/41/34/487884134.db2.gz JKVRISOGDHCLJC-JTQLQIEISA-N 1 1 219.319 3.542 20 0 BHADMO CC(C)(C)CCC[N@@H+]1CCC[C@H]1C(F)F ZINC000682029231 487884129 /nfs/dbraw/zinc/88/41/29/487884129.db2.gz JKVRISOGDHCLJC-JTQLQIEISA-N 1 1 219.319 3.542 20 0 BHADMO CC(C)(C)CCC[N@H+]1CC[C@H](C(F)(F)F)C1 ZINC000682029274 487883232 /nfs/dbraw/zinc/88/32/32/487883232.db2.gz KEWQGWYQXWBYHE-JTQLQIEISA-N 1 1 237.309 3.697 20 0 BHADMO CC(C)(C)CCC[N@H+]1CC[C@@H](C(F)(F)F)C1 ZINC000682029279 487884123 /nfs/dbraw/zinc/88/41/23/487884123.db2.gz KEWQGWYQXWBYHE-SNVBAGLBSA-N 1 1 237.309 3.697 20 0 BHADMO C[N@@H+](CCCC(C)(C)C)CCOC(C)(C)C ZINC000682029581 487884173 /nfs/dbraw/zinc/88/41/73/487884173.db2.gz SQOKCASYQAQRLE-UHFFFAOYSA-N 1 1 229.408 3.560 20 0 BHADMO CC(C)(C)CCC[N@H+]1CCC[C@@H](OC(F)F)C1 ZINC000682030031 487883979 /nfs/dbraw/zinc/88/39/79/487883979.db2.gz LSUMEWVVXNXPBY-LLVKDONJSA-N 1 1 249.345 3.516 20 0 BHADMO CC(C)(C)CCC[N@H+]1CCC[C@H](OC(F)F)C1 ZINC000682030032 487883804 /nfs/dbraw/zinc/88/38/04/487883804.db2.gz LSUMEWVVXNXPBY-NSHDSACASA-N 1 1 249.345 3.516 20 0 BHADMO CC(C)[C@@H]1CCC[N@H+]([C@@H](C)c2ccncc2)C1 ZINC000682039098 487888397 /nfs/dbraw/zinc/88/83/97/487888397.db2.gz GFMRWYTVQFVZRQ-DZGCQCFKSA-N 1 1 232.371 3.511 20 0 BHADMO CC(C)[C@H]1CCC[N@H+]([C@H](C)c2ccncc2)C1 ZINC000682039099 487888583 /nfs/dbraw/zinc/88/85/83/487888583.db2.gz GFMRWYTVQFVZRQ-HIFRSBDPSA-N 1 1 232.371 3.511 20 0 BHADMO CC(C)[C@@H]1CCC[N@H+]([C@H](C)c2ccncc2)C1 ZINC000682039100 487887827 /nfs/dbraw/zinc/88/78/27/487887827.db2.gz GFMRWYTVQFVZRQ-UKRRQHHQSA-N 1 1 232.371 3.511 20 0 BHADMO CC(C)[C@H]1CCC[N@H+]([C@@H](C)c2ccncc2)C1 ZINC000682039102 487888365 /nfs/dbraw/zinc/88/83/65/487888365.db2.gz GFMRWYTVQFVZRQ-ZFWWWQNUSA-N 1 1 232.371 3.511 20 0 BHADMO CC(C)[C@H]1CCC[N@@H+](CCCOC(C)(C)C)C1 ZINC000682039674 487887995 /nfs/dbraw/zinc/88/79/95/487887995.db2.gz IYNXZWOHXDXPOV-AWEZNQCLSA-N 1 1 241.419 3.560 20 0 BHADMO CC(C)[C@@H]1CCC[N@@H+](CCCOC(C)(C)C)C1 ZINC000682039675 487888064 /nfs/dbraw/zinc/88/80/64/487888064.db2.gz IYNXZWOHXDXPOV-CQSZACIVSA-N 1 1 241.419 3.560 20 0 BHADMO CC(C)C[C@@H](C)[N@H+]1CC[C@@H](c2ccco2)C1 ZINC000682069597 487890816 /nfs/dbraw/zinc/89/08/16/487890816.db2.gz GSHDRTVGDWTLKD-CHWSQXEVSA-N 1 1 221.344 3.504 20 0 BHADMO CC(C)C[C@@H](C)[N@H+]1CC[C@H](c2ccco2)C1 ZINC000682069598 487890809 /nfs/dbraw/zinc/89/08/09/487890809.db2.gz GSHDRTVGDWTLKD-OLZOCXBDSA-N 1 1 221.344 3.504 20 0 BHADMO CC(C)C[C@H](C)[N@H+]1CC[C@@H](c2ccco2)C1 ZINC000682069599 487982481 /nfs/dbraw/zinc/98/24/81/487982481.db2.gz GSHDRTVGDWTLKD-QWHCGFSZSA-N 1 1 221.344 3.504 20 0 BHADMO CC(C)C[C@H](C)[N@H+]1CC[C@H](c2ccco2)C1 ZINC000682069600 487983707 /nfs/dbraw/zinc/98/37/07/487983707.db2.gz GSHDRTVGDWTLKD-STQMWFEESA-N 1 1 221.344 3.504 20 0 BHADMO CCC[C@@H](C)[N@H+]1CCCc2sccc2C1 ZINC000682069868 487983733 /nfs/dbraw/zinc/98/37/33/487983733.db2.gz IWPXAVOHPJNQDD-LLVKDONJSA-N 1 1 223.385 3.685 20 0 BHADMO CCC[C@H](C)[N@H+]1CCCc2sccc2C1 ZINC000682069869 487983227 /nfs/dbraw/zinc/98/32/27/487983227.db2.gz IWPXAVOHPJNQDD-NSHDSACASA-N 1 1 223.385 3.685 20 0 BHADMO c1ccc2c(c1)CC[C@H]2[N@@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC000682070031 487890881 /nfs/dbraw/zinc/89/08/81/487890881.db2.gz BZROTDCRPAWJOZ-HLLBOEOZSA-N 1 1 241.378 3.796 20 0 BHADMO c1ccc2c(c1)CC[C@@H]2[N@@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC000682070033 487890798 /nfs/dbraw/zinc/89/07/98/487890798.db2.gz BZROTDCRPAWJOZ-UXLLHSPISA-N 1 1 241.378 3.796 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)Cc1cc2ccccc2[nH]1 ZINC000682070669 487984342 /nfs/dbraw/zinc/98/43/42/487984342.db2.gz DZMAOUJSACUUCI-GFCCVEGCSA-N 1 1 230.355 3.788 20 0 BHADMO CCC[C@H](C)[N@@H+](C)Cc1cc2ccccc2[nH]1 ZINC000682070670 487984437 /nfs/dbraw/zinc/98/44/37/487984437.db2.gz DZMAOUJSACUUCI-LBPRGKRZSA-N 1 1 230.355 3.788 20 0 BHADMO CC(C)[C@@H](C)[N@@H+](C)Cc1cc2ccccc2[nH]1 ZINC000682071763 487893175 /nfs/dbraw/zinc/89/31/75/487893175.db2.gz IVPOAVDDYJEETG-GFCCVEGCSA-N 1 1 230.355 3.644 20 0 BHADMO CC(C)[C@H](C)[N@@H+](C)Cc1cc2ccccc2[nH]1 ZINC000682071765 487893100 /nfs/dbraw/zinc/89/31/00/487893100.db2.gz IVPOAVDDYJEETG-LBPRGKRZSA-N 1 1 230.355 3.644 20 0 BHADMO CCC[C@H](C)[N@H+]1CCS[C@@H](c2ccccc2)C1 ZINC000682071977 487986718 /nfs/dbraw/zinc/98/67/18/487986718.db2.gz LPVYNBYZTVNHQU-DZGCQCFKSA-N 1 1 249.423 3.965 20 0 BHADMO CCC[C@@H](C)[N@H+]1CCS[C@H](c2ccccc2)C1 ZINC000682071978 487987199 /nfs/dbraw/zinc/98/71/99/487987199.db2.gz LPVYNBYZTVNHQU-HIFRSBDPSA-N 1 1 249.423 3.965 20 0 BHADMO CCC[C@@H](C)[N@H+]1CCS[C@@H](c2ccccc2)C1 ZINC000682071979 487987416 /nfs/dbraw/zinc/98/74/16/487987416.db2.gz LPVYNBYZTVNHQU-UKRRQHHQSA-N 1 1 249.423 3.965 20 0 BHADMO CCC[C@H](C)[N@H+]1CCS[C@H](c2ccccc2)C1 ZINC000682072332 487986982 /nfs/dbraw/zinc/98/69/82/487986982.db2.gz LPVYNBYZTVNHQU-ZFWWWQNUSA-N 1 1 249.423 3.965 20 0 BHADMO CC1(C)C[N@H+]([C@H]2CCc3ccccc32)CCS1 ZINC000682072571 487895218 /nfs/dbraw/zinc/89/52/18/487895218.db2.gz NSKVSQWWVKNWGF-AWEZNQCLSA-N 1 1 247.407 3.501 20 0 BHADMO CC1(C)C[N@H+]([C@@H]2CCc3ccccc32)CCS1 ZINC000682072573 487895194 /nfs/dbraw/zinc/89/51/94/487895194.db2.gz NSKVSQWWVKNWGF-CQSZACIVSA-N 1 1 247.407 3.501 20 0 BHADMO c1ccc2c(c1)CC[C@@H]2[N@H+]1CCC2(CCC2)C1 ZINC000682074383 487990018 /nfs/dbraw/zinc/99/00/18/487990018.db2.gz SYXBOXJJEQNMCS-HNNXBMFYSA-N 1 1 227.351 3.550 20 0 BHADMO c1ccc2c(c1)CC[C@H]2[N@H+]1CCC2(CCC2)C1 ZINC000682074384 487989608 /nfs/dbraw/zinc/98/96/08/487989608.db2.gz SYXBOXJJEQNMCS-OAHLLOKOSA-N 1 1 227.351 3.550 20 0 BHADMO CC(C)OCCC[N@@H+](C)[C@H](C)C1CCCCC1 ZINC000682074447 487897657 /nfs/dbraw/zinc/89/76/57/487897657.db2.gz UGZICRMZTAOKLY-CQSZACIVSA-N 1 1 241.419 3.702 20 0 BHADMO CC[C@H]1C[N@H+]([C@@H]2CCc3ccccc32)CCS1 ZINC000682074966 487899660 /nfs/dbraw/zinc/89/96/60/487899660.db2.gz WXYXXYBZRLLNEZ-DZGCQCFKSA-N 1 1 247.407 3.501 20 0 BHADMO CC[C@@H]1C[N@H+]([C@H]2CCc3ccccc32)CCS1 ZINC000682074968 487899724 /nfs/dbraw/zinc/89/97/24/487899724.db2.gz WXYXXYBZRLLNEZ-HIFRSBDPSA-N 1 1 247.407 3.501 20 0 BHADMO CC[C@@H]1C[N@H+]([C@@H]2CCc3ccccc32)CCS1 ZINC000682074970 487899348 /nfs/dbraw/zinc/89/93/48/487899348.db2.gz WXYXXYBZRLLNEZ-UKRRQHHQSA-N 1 1 247.407 3.501 20 0 BHADMO CC[C@H]1C[N@H+]([C@H]2CCc3ccccc32)CCS1 ZINC000682074974 487898828 /nfs/dbraw/zinc/89/88/28/487898828.db2.gz WXYXXYBZRLLNEZ-ZFWWWQNUSA-N 1 1 247.407 3.501 20 0 BHADMO c1ccc2c(c1)CC[C@@H]2[N@H+]1CCCC2(CC2)C1 ZINC000682075522 487990050 /nfs/dbraw/zinc/99/00/50/487990050.db2.gz YBTCDSNIMQPURR-HNNXBMFYSA-N 1 1 227.351 3.550 20 0 BHADMO c1ccc2c(c1)CC[C@H]2[N@H+]1CCCC2(CC2)C1 ZINC000682075552 487989520 /nfs/dbraw/zinc/98/95/20/487989520.db2.gz YBTCDSNIMQPURR-OAHLLOKOSA-N 1 1 227.351 3.550 20 0 BHADMO C[C@@H]([N@@H+](C)Cc1cc2ccccc2[nH]1)C1(C)CC1 ZINC000682076664 487900725 /nfs/dbraw/zinc/90/07/25/487900725.db2.gz VIZDRLXQQVNUDQ-GFCCVEGCSA-N 1 1 242.366 3.788 20 0 BHADMO C[C@H]([N@@H+](C)Cc1cc2ccccc2[nH]1)C1(C)CC1 ZINC000682076665 487901092 /nfs/dbraw/zinc/90/10/92/487901092.db2.gz VIZDRLXQQVNUDQ-LBPRGKRZSA-N 1 1 242.366 3.788 20 0 BHADMO CC[C@H](C)[N@H+]1CC[C@@H](c2ccc(C)cc2)C1 ZINC000682076837 487900465 /nfs/dbraw/zinc/90/04/65/487900465.db2.gz MRQAGEGBGIPGLQ-DZGCQCFKSA-N 1 1 217.356 3.583 20 0 BHADMO CC[C@@H](C)[N@H+]1CC[C@H](c2ccc(C)cc2)C1 ZINC000682076844 487901047 /nfs/dbraw/zinc/90/10/47/487901047.db2.gz MRQAGEGBGIPGLQ-HIFRSBDPSA-N 1 1 217.356 3.583 20 0 BHADMO CC[C@@H](C)[N@H+]1CC[C@@H](c2ccc(C)cc2)C1 ZINC000682076845 487990804 /nfs/dbraw/zinc/99/08/04/487990804.db2.gz MRQAGEGBGIPGLQ-UKRRQHHQSA-N 1 1 217.356 3.583 20 0 BHADMO CC[C@H](C)[N@H+]1CC[C@H](c2ccc(C)cc2)C1 ZINC000682076846 487991135 /nfs/dbraw/zinc/99/11/35/487991135.db2.gz MRQAGEGBGIPGLQ-ZFWWWQNUSA-N 1 1 217.356 3.583 20 0 BHADMO CC(C)[C@@H]1CC[N@H+]([C@@H]2CCc3ccccc32)C1 ZINC000682076944 487900551 /nfs/dbraw/zinc/90/05/51/487900551.db2.gz NQTATJDZVSCHHK-GDBMZVCRSA-N 1 1 229.367 3.652 20 0 BHADMO CC(C)[C@H]1CC[N@H+]([C@@H]2CCc3ccccc32)C1 ZINC000682076946 487900932 /nfs/dbraw/zinc/90/09/32/487900932.db2.gz NQTATJDZVSCHHK-GOEBONIOSA-N 1 1 229.367 3.652 20 0 BHADMO CC(C)[C@H]1CC[N@H+]([C@H]2CCc3ccccc32)C1 ZINC000682076947 487900893 /nfs/dbraw/zinc/90/08/93/487900893.db2.gz NQTATJDZVSCHHK-HOCLYGCPSA-N 1 1 229.367 3.652 20 0 BHADMO CC(C)[C@@H]1CC[N@H+]([C@H]2CCc3ccccc32)C1 ZINC000682076949 487900833 /nfs/dbraw/zinc/90/08/33/487900833.db2.gz NQTATJDZVSCHHK-ZBFHGGJFSA-N 1 1 229.367 3.652 20 0 BHADMO C[C@H](C1CCCCC1)[N@@H+](C)CCc1ccccn1 ZINC000682078166 487993738 /nfs/dbraw/zinc/99/37/38/487993738.db2.gz VKZBKFIQTVAPHB-CQSZACIVSA-N 1 1 246.398 3.525 20 0 BHADMO COc1cc(C)c([C@H](C)[N@@H+]2CC=CCC2)cc1C ZINC000682078526 487903223 /nfs/dbraw/zinc/90/32/23/487903223.db2.gz ZUBHVAQEOSTDHY-AWEZNQCLSA-N 1 1 245.366 3.635 20 0 BHADMO COc1cc(C)c([C@@H](C)[N@@H+]2CC=CCC2)cc1C ZINC000682078527 487903585 /nfs/dbraw/zinc/90/35/85/487903585.db2.gz ZUBHVAQEOSTDHY-CQSZACIVSA-N 1 1 245.366 3.635 20 0 BHADMO CCc1ccccc1C[N@@H+](C)Cc1ccsc1 ZINC000682082928 487905608 /nfs/dbraw/zinc/90/56/08/487905608.db2.gz FKVASAHUQYHZCV-UHFFFAOYSA-N 1 1 245.391 3.943 20 0 BHADMO CCc1ccccc1C[N@@H+](CC)Cc1ccoc1 ZINC000682082982 487904000 /nfs/dbraw/zinc/90/40/00/487904000.db2.gz GXDJNBRIGYNLCS-UHFFFAOYSA-N 1 1 243.350 3.864 20 0 BHADMO CCc1ccccc1C[N@H+]1CCC[C@H]1C1CC1 ZINC000682083426 487906222 /nfs/dbraw/zinc/90/62/22/487906222.db2.gz UUOOFEIPRXGVOA-INIZCTEOSA-N 1 1 229.367 3.623 20 0 BHADMO CCc1ccccc1C[N@H+]1CCC[C@@H]1C1CC1 ZINC000682083427 487905664 /nfs/dbraw/zinc/90/56/64/487905664.db2.gz UUOOFEIPRXGVOA-MRXNPFEDSA-N 1 1 229.367 3.623 20 0 BHADMO CCCC[N@@H+](C)Cc1cc(F)ccc1Cl ZINC000682083767 487906579 /nfs/dbraw/zinc/90/65/79/487906579.db2.gz WQWPYPBUODQUQX-UHFFFAOYSA-N 1 1 229.726 3.711 20 0 BHADMO CC(C)CCC[N@H+]1CCC[C@H]1c1ccc(O)cc1 ZINC000682153138 487915717 /nfs/dbraw/zinc/91/57/17/487915717.db2.gz ZGVZHHHNGDVSKW-INIZCTEOSA-N 1 1 247.382 3.965 20 0 BHADMO CC(C)CCC[N@H+]1CCC[C@@H]1c1ccc(O)cc1 ZINC000682153139 487916097 /nfs/dbraw/zinc/91/60/97/487916097.db2.gz ZGVZHHHNGDVSKW-MRXNPFEDSA-N 1 1 247.382 3.965 20 0 BHADMO CC[N@@H+](CCCC(C)C)CCC(F)(F)F ZINC000682153821 487915594 /nfs/dbraw/zinc/91/55/94/487915594.db2.gz SIENGTJBOJELKH-UHFFFAOYSA-N 1 1 225.298 3.697 20 0 BHADMO CC[N@@H+](CCCC(C)C)Cc1ccoc1 ZINC000682154144 487915573 /nfs/dbraw/zinc/91/55/73/487915573.db2.gz VNBDYIQMVXJVBO-UHFFFAOYSA-N 1 1 209.333 3.538 20 0 BHADMO C[C@@H](C[N@H+]1CCC[C@@H]1C1CC1)c1ccc(F)cc1 ZINC000682154145 487915743 /nfs/dbraw/zinc/91/57/43/487915743.db2.gz VOSANEIOBAWDLD-BLLLJJGKSA-N 1 1 247.357 3.804 20 0 BHADMO C[C@@H](C[N@H+]1CCC[C@H]1C1CC1)c1ccc(F)cc1 ZINC000682154146 487915394 /nfs/dbraw/zinc/91/53/94/487915394.db2.gz VOSANEIOBAWDLD-LRDDRELGSA-N 1 1 247.357 3.804 20 0 BHADMO C[C@H](C[N@H+]1CCC[C@@H]1C1CC1)c1ccc(F)cc1 ZINC000682154147 487916170 /nfs/dbraw/zinc/91/61/70/487916170.db2.gz VOSANEIOBAWDLD-MLGOLLRUSA-N 1 1 247.357 3.804 20 0 BHADMO C[C@H](C[N@H+]1CCC[C@H]1C1CC1)c1ccc(F)cc1 ZINC000682154148 487997873 /nfs/dbraw/zinc/99/78/73/487997873.db2.gz VOSANEIOBAWDLD-WBMJQRKESA-N 1 1 247.357 3.804 20 0 BHADMO CC(C)CCC[N@H+]1CC[C@@H](c2ccco2)C1 ZINC000682154571 487916179 /nfs/dbraw/zinc/91/61/79/487916179.db2.gz HLVYTHFHNPWVKF-CYBMUJFWSA-N 1 1 221.344 3.505 20 0 BHADMO CC(C)CCC[N@H+]1CC[C@H](c2ccco2)C1 ZINC000682154572 487916109 /nfs/dbraw/zinc/91/61/09/487916109.db2.gz HLVYTHFHNPWVKF-ZDUSSCGKSA-N 1 1 221.344 3.505 20 0 BHADMO C[C@@]1(c2ccccc2)CC[C@H]([N@@H+]2CC=CCC2)C1 ZINC000682164380 487921585 /nfs/dbraw/zinc/92/15/85/487921585.db2.gz LMXOALSFTZQIED-DLBZAZTESA-N 1 1 241.378 3.759 20 0 BHADMO C[C@@]1(c2ccccc2)CC[C@@H]([N@@H+]2CC=CCC2)C1 ZINC000682164381 487921547 /nfs/dbraw/zinc/92/15/47/487921547.db2.gz LMXOALSFTZQIED-IAGOWNOFSA-N 1 1 241.378 3.759 20 0 BHADMO C[C@]1(c2ccccc2)CC[C@H]([N@@H+]2CC=CCC2)C1 ZINC000682164383 487921685 /nfs/dbraw/zinc/92/16/85/487921685.db2.gz LMXOALSFTZQIED-IRXDYDNUSA-N 1 1 241.378 3.759 20 0 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20 0 BHADMO C[C@H]1CCC[N@@H+](Cc2cc3ccccc3[nH]2)[C@H]1C ZINC000684021199 488255576 /nfs/dbraw/zinc/25/55/76/488255576.db2.gz RPGYWPQGRMUBDI-STQMWFEESA-N 1 1 242.366 3.788 20 0 BHADMO CC[C@@]1(C)CC[N@@H+](Cc2cc3ccccc3[nH]2)C1 ZINC000684021322 488256292 /nfs/dbraw/zinc/25/62/92/488256292.db2.gz OACKBPCYNZHKEJ-INIZCTEOSA-N 1 1 242.366 3.790 20 0 BHADMO CC[C@]1(C)CC[N@@H+](Cc2cc3ccccc3[nH]2)C1 ZINC000684021323 488256092 /nfs/dbraw/zinc/25/60/92/488256092.db2.gz OACKBPCYNZHKEJ-MRXNPFEDSA-N 1 1 242.366 3.790 20 0 BHADMO CC[N@@H+](Cc1cc2ccccc2[nH]1)C1CCCC1 ZINC000684021370 487741691 /nfs/dbraw/zinc/74/16/91/487741691.db2.gz URTZLIQRYPASDR-UHFFFAOYSA-N 1 1 242.366 3.932 20 0 BHADMO C[C@@H]1CC[N@@H+](Cc2cc3ccccc3[nH]2)C[C@H]1C ZINC000684021638 488256487 /nfs/dbraw/zinc/25/64/87/488256487.db2.gz QTQTUNPLHSCYAE-CHWSQXEVSA-N 1 1 242.366 3.646 20 0 BHADMO C[C@@H]1CC[N@@H+](Cc2cc3ccccc3[nH]2)C[C@@H]1C ZINC000684021640 488255951 /nfs/dbraw/zinc/25/59/51/488255951.db2.gz QTQTUNPLHSCYAE-OLZOCXBDSA-N 1 1 242.366 3.646 20 0 BHADMO C[C@H]1CC[N@@H+](Cc2cc3ccccc3[nH]2)C[C@H]1C ZINC000684021642 488256055 /nfs/dbraw/zinc/25/60/55/488256055.db2.gz QTQTUNPLHSCYAE-QWHCGFSZSA-N 1 1 242.366 3.646 20 0 BHADMO C[C@H]1C[N@H+](Cc2cc3ccccc3[nH]2)CC[C@@H]1C ZINC000684021643 488256479 /nfs/dbraw/zinc/25/64/79/488256479.db2.gz QTQTUNPLHSCYAE-STQMWFEESA-N 1 1 242.366 3.646 20 0 BHADMO CC[C@@H]1CCC[N@@H+](Cc2cc3ccccc3[nH]2)C1 ZINC000684021663 488256305 /nfs/dbraw/zinc/25/63/05/488256305.db2.gz ZNYSLLOFSBUBAX-CYBMUJFWSA-N 1 1 242.366 3.790 20 0 BHADMO CC[C@H]1CCC[N@@H+](Cc2cc3ccccc3[nH]2)C1 ZINC000684021667 488256241 /nfs/dbraw/zinc/25/62/41/488256241.db2.gz ZNYSLLOFSBUBAX-ZDUSSCGKSA-N 1 1 242.366 3.790 20 0 BHADMO CC(C)[N@@H+](Cc1cc2ccccc2[nH]1)C1CCC1 ZINC000684021793 488256201 /nfs/dbraw/zinc/25/62/01/488256201.db2.gz UTOSNMDSZFKHFP-UHFFFAOYSA-N 1 1 242.366 3.931 20 0 BHADMO CC(C)[C@H]1CC[N@@H+](Cc2cc3ccccc3[nH]2)C1 ZINC000684021800 488256126 /nfs/dbraw/zinc/25/61/26/488256126.db2.gz BWGCYBORNAFQBX-AWEZNQCLSA-N 1 1 242.366 3.646 20 0 BHADMO CC(C)[C@@H]1CC[N@@H+](Cc2cc3ccccc3[nH]2)C1 ZINC000684021801 488256106 /nfs/dbraw/zinc/25/61/06/488256106.db2.gz BWGCYBORNAFQBX-CQSZACIVSA-N 1 1 242.366 3.646 20 0 BHADMO CC[C@H]1C[C@@H](C)C[N@H+]1Cc1cc2ccccc2[nH]1 ZINC000684021939 488256401 /nfs/dbraw/zinc/25/64/01/488256401.db2.gz YYRCBTYILKBMQU-DOMZBBRYSA-N 1 1 242.366 3.788 20 0 BHADMO CC[C@@H]1C[C@@H](C)C[N@H+]1Cc1cc2ccccc2[nH]1 ZINC000684021940 488256148 /nfs/dbraw/zinc/25/61/48/488256148.db2.gz YYRCBTYILKBMQU-IUODEOHRSA-N 1 1 242.366 3.788 20 0 BHADMO CC[C@@H]1C[C@H](C)C[N@H+]1Cc1cc2ccccc2[nH]1 ZINC000684021941 488255956 /nfs/dbraw/zinc/25/59/56/488255956.db2.gz YYRCBTYILKBMQU-SWLSCSKDSA-N 1 1 242.366 3.788 20 0 BHADMO CC[C@H]1C[C@H](C)C[N@H+]1Cc1cc2ccccc2[nH]1 ZINC000684021942 488256247 /nfs/dbraw/zinc/25/62/47/488256247.db2.gz YYRCBTYILKBMQU-WFASDCNBSA-N 1 1 242.366 3.788 20 0 BHADMO C[C@@H]1CC[C@@H](C)[N@@H+](Cc2cc3ccccc3[nH]2)C1 ZINC000684021954 487741659 /nfs/dbraw/zinc/74/16/59/487741659.db2.gz ZLBPIYJFPPOOIO-CHWSQXEVSA-N 1 1 242.366 3.788 20 0 BHADMO C[C@@H]1CC[C@H](C)[N@@H+](Cc2cc3ccccc3[nH]2)C1 ZINC000684021955 487741647 /nfs/dbraw/zinc/74/16/47/487741647.db2.gz ZLBPIYJFPPOOIO-OLZOCXBDSA-N 1 1 242.366 3.788 20 0 BHADMO C[C@@H]1CC[C@H](C)C[N@@H+]1Cc1cc2ccccc2[nH]1 ZINC000684021956 487741703 /nfs/dbraw/zinc/74/17/03/487741703.db2.gz ZLBPIYJFPPOOIO-QWHCGFSZSA-N 1 1 242.366 3.788 20 0 BHADMO C[C@H]1CC[C@H](C)[N@@H+](Cc2cc3ccccc3[nH]2)C1 ZINC000684021957 487741728 /nfs/dbraw/zinc/74/17/28/487741728.db2.gz ZLBPIYJFPPOOIO-STQMWFEESA-N 1 1 242.366 3.788 20 0 BHADMO C[C@@H]1CC[C@H](C)[N@@H+]1Cc1cc2ccccc2[nH]1 ZINC000684022107 488256027 /nfs/dbraw/zinc/25/60/27/488256027.db2.gz GIFWVNFQPHJJAU-TXEJJXNPSA-N 1 1 228.339 3.541 20 0 BHADMO c1c2ccccc2[nH]c1C[N@H+]1CCC[C@H]1C1CC1 ZINC000684022902 488256660 /nfs/dbraw/zinc/25/66/60/488256660.db2.gz PRYFAZMWJSZKOW-INIZCTEOSA-N 1 1 240.350 3.542 20 0 BHADMO c1c2ccccc2[nH]c1C[N@H+]1CCC[C@@H]1C1CC1 ZINC000684022905 488257107 /nfs/dbraw/zinc/25/71/07/488257107.db2.gz PRYFAZMWJSZKOW-MRXNPFEDSA-N 1 1 240.350 3.542 20 0 BHADMO CCC(C)(C)[N@@H+](C)Cc1cc2ccccc2[nH]1 ZINC000684022965 488257126 /nfs/dbraw/zinc/25/71/26/488257126.db2.gz QRQDTXGCNGINAL-UHFFFAOYSA-N 1 1 230.355 3.788 20 0 BHADMO c1c2ccccc2[nH]c1C[N@H+]1CCCC2(CC2)C1 ZINC000684023680 488257064 /nfs/dbraw/zinc/25/70/64/488257064.db2.gz AFQIXXIZVYOHEY-UHFFFAOYSA-N 1 1 240.350 3.544 20 0 BHADMO C[N@@H+](Cc1cc2ccccc2[nH]1)C1(C)CCCC1 ZINC000684023698 488256853 /nfs/dbraw/zinc/25/68/53/488256853.db2.gz CBZTWAGRMNEMBR-UHFFFAOYSA-N 1 1 242.366 3.932 20 0 BHADMO C[C@@H]1CCCC[N@@H+](Cc2cc3ccccc3[nH]2)C1 ZINC000684023748 488256972 /nfs/dbraw/zinc/25/69/72/488256972.db2.gz BLUSNPNWKNEZSA-CYBMUJFWSA-N 1 1 242.366 3.790 20 0 BHADMO C[C@H]1CCCC[N@@H+](Cc2cc3ccccc3[nH]2)C1 ZINC000684023751 488256831 /nfs/dbraw/zinc/25/68/31/488256831.db2.gz BLUSNPNWKNEZSA-ZDUSSCGKSA-N 1 1 242.366 3.790 20 0 BHADMO CC[C@@H]1[C@@H](C)CC[N@H+]1Cc1cc2ccccc2[nH]1 ZINC000684024921 488257001 /nfs/dbraw/zinc/25/70/01/488257001.db2.gz HZHDCYIFEAIKTC-BLLLJJGKSA-N 1 1 242.366 3.788 20 0 BHADMO CC[C@H]1[C@@H](C)CC[N@H+]1Cc1cc2ccccc2[nH]1 ZINC000684024922 488256995 /nfs/dbraw/zinc/25/69/95/488256995.db2.gz HZHDCYIFEAIKTC-LRDDRELGSA-N 1 1 242.366 3.788 20 0 BHADMO CC[C@@H]1[C@H](C)CC[N@H+]1Cc1cc2ccccc2[nH]1 ZINC000684024923 488256608 /nfs/dbraw/zinc/25/66/08/488256608.db2.gz HZHDCYIFEAIKTC-MLGOLLRUSA-N 1 1 242.366 3.788 20 0 BHADMO CC[C@H]1[C@H](C)CC[N@H+]1Cc1cc2ccccc2[nH]1 ZINC000684024924 488257143 /nfs/dbraw/zinc/25/71/43/488257143.db2.gz HZHDCYIFEAIKTC-WBMJQRKESA-N 1 1 242.366 3.788 20 0 BHADMO CC[N@@H+](CCC1CC1)Cc1cc2ccccc2[nH]1 ZINC000684025127 488256783 /nfs/dbraw/zinc/25/67/83/488256783.db2.gz MSVJSQGIEZYBRG-UHFFFAOYSA-N 1 1 242.366 3.790 20 0 BHADMO c1c2ccccc2[nH]c1C[N@H+]1CC[C@@H]2CCC[C@H]21 ZINC000684025186 488256745 /nfs/dbraw/zinc/25/67/45/488256745.db2.gz NKGUMJQLWJLAIF-BLLLJJGKSA-N 1 1 240.350 3.542 20 0 BHADMO CCC[N@@H+](Cc1ccccc1F)CC1(F)CC1 ZINC000684357775 488298992 /nfs/dbraw/zinc/29/89/92/488298992.db2.gz PJMNEJNYAIDWRH-UHFFFAOYSA-N 1 1 239.309 3.540 20 0 BHADMO CCC[N@H+](Cc1ccccc1F)CC1(F)CC1 ZINC000684357775 488298991 /nfs/dbraw/zinc/29/89/91/488298991.db2.gz PJMNEJNYAIDWRH-UHFFFAOYSA-N 1 1 239.309 3.540 20 0 BHADMO CC1(C)C[N@@H+](CC2(F)CC2)[C@@H]1c1ccccc1 ZINC000684358483 488300554 /nfs/dbraw/zinc/30/05/54/488300554.db2.gz ZLXPSAUBMCPZFP-CYBMUJFWSA-N 1 1 233.330 3.572 20 0 BHADMO CC1(C)C[N@@H+](CC2(F)CC2)[C@H]1c1ccccc1 ZINC000684358484 488300455 /nfs/dbraw/zinc/30/04/55/488300455.db2.gz ZLXPSAUBMCPZFP-ZDUSSCGKSA-N 1 1 233.330 3.572 20 0 BHADMO Cc1ccc(CCC[N@H+](C(C)C)C2CCC2)cn1 ZINC000684361558 488301322 /nfs/dbraw/zinc/30/13/22/488301322.db2.gz UKKUOKHUTMOWNC-UHFFFAOYSA-N 1 1 246.398 3.586 20 0 BHADMO CCc1cccc(F)c1C[NH2+]Cc1ccoc1C ZINC000684373676 488302129 /nfs/dbraw/zinc/30/21/29/488302129.db2.gz YPPHVVLKVWJRKR-UHFFFAOYSA-N 1 1 247.313 3.579 20 0 BHADMO CC(C)C1C[NH+](Cc2ccc(Cl)c(F)c2)C1 ZINC000684407600 488307530 /nfs/dbraw/zinc/30/75/30/488307530.db2.gz GYCGLZYDROUSPN-UHFFFAOYSA-N 1 1 241.737 3.567 20 0 BHADMO CC(C)C1C[NH+](Cc2ccc(F)c(Cl)c2)C1 ZINC000684407661 488307488 /nfs/dbraw/zinc/30/74/88/488307488.db2.gz BDNVHCFOCZBNSN-UHFFFAOYSA-N 1 1 241.737 3.567 20 0 BHADMO CC(C)C1C[NH+](Cc2ccc(Cl)cc2F)C1 ZINC000684407671 488307581 /nfs/dbraw/zinc/30/75/81/488307581.db2.gz BPJPTYNTELUHFZ-UHFFFAOYSA-N 1 1 241.737 3.567 20 0 BHADMO CC(C)C1C[NH+](Cc2c(F)cccc2Cl)C1 ZINC000684407866 488307573 /nfs/dbraw/zinc/30/75/73/488307573.db2.gz JIXVGXZLCARLKL-UHFFFAOYSA-N 1 1 241.737 3.567 20 0 BHADMO CC(C)C1C[NH+](Cc2cccc(Cl)c2F)C1 ZINC000684408213 488307780 /nfs/dbraw/zinc/30/77/80/488307780.db2.gz NTFMFTQNWKNNGS-UHFFFAOYSA-N 1 1 241.737 3.567 20 0 BHADMO CC(C)C1C[NH+](Cc2ccc(F)cc2Cl)C1 ZINC000684408589 488306378 /nfs/dbraw/zinc/30/63/78/488306378.db2.gz KAHWDTLPRXZRHU-UHFFFAOYSA-N 1 1 241.737 3.567 20 0 BHADMO CC(C)C1C[NH+](Cc2cc(F)cc(Cl)c2)C1 ZINC000684408639 488307896 /nfs/dbraw/zinc/30/78/96/488307896.db2.gz VDTQWLQJDQZOAY-UHFFFAOYSA-N 1 1 241.737 3.567 20 0 BHADMO CC(C)C1C[NH+](Cc2cc(Cl)ccc2F)C1 ZINC000684409602 488308405 /nfs/dbraw/zinc/30/84/05/488308405.db2.gz ZQNSJRLFOFEKKQ-UHFFFAOYSA-N 1 1 241.737 3.567 20 0 BHADMO C[C@@H]1C[C@H](C)[N@@H+]1Cc1ccccc1C1CC1 ZINC000684410778 488308356 /nfs/dbraw/zinc/30/83/56/488308356.db2.gz ADQKSVOTSOQZGT-TXEJJXNPSA-N 1 1 215.340 3.547 20 0 BHADMO CC[C@H](C[NH2+]C(C)(C)C(F)F)c1ccccc1 ZINC000684413302 488309075 /nfs/dbraw/zinc/30/90/75/488309075.db2.gz DYVHDHIDXLJECU-LLVKDONJSA-N 1 1 241.325 3.814 20 0 BHADMO CC[C@@H](C[NH2+]C(C)(C)C(F)F)c1ccccc1 ZINC000684413303 488308972 /nfs/dbraw/zinc/30/89/72/488308972.db2.gz DYVHDHIDXLJECU-NSHDSACASA-N 1 1 241.325 3.814 20 0 BHADMO C[C@H](C[NH2+]C(C)(C)C(F)F)c1ccc(F)cc1 ZINC000684413539 488309583 /nfs/dbraw/zinc/30/95/83/488309583.db2.gz OAKPVMBUSAWBAK-SECBINFHSA-N 1 1 245.288 3.563 20 0 BHADMO C[C@@H](C[NH2+]C(C)(C)C(F)F)c1ccc(F)cc1 ZINC000684413540 488309628 /nfs/dbraw/zinc/30/96/28/488309628.db2.gz OAKPVMBUSAWBAK-VIFPVBQESA-N 1 1 245.288 3.563 20 0 BHADMO CC(C)([NH2+]C1CC(c2ccccc2)C1)C(F)F ZINC000684413675 488309371 /nfs/dbraw/zinc/30/93/71/488309371.db2.gz VOMRLSLIBBRRSP-UHFFFAOYSA-N 1 1 239.309 3.566 20 0 BHADMO C[C@H](CCc1ccccc1)[NH2+]C(C)(C)C(F)F ZINC000684413755 488309612 /nfs/dbraw/zinc/30/96/12/488309612.db2.gz ZVKLRSYQVTXDSX-LLVKDONJSA-N 1 1 241.325 3.641 20 0 BHADMO C[C@@H](CCc1ccccc1)[NH2+]C(C)(C)C(F)F ZINC000684413756 488309773 /nfs/dbraw/zinc/30/97/73/488309773.db2.gz ZVKLRSYQVTXDSX-NSHDSACASA-N 1 1 241.325 3.641 20 0 BHADMO Cc1ccccc1C[C@@H](C)[NH2+]C(C)(C)C(F)F ZINC000684413863 488309388 /nfs/dbraw/zinc/30/93/88/488309388.db2.gz HWZVFXQPTGHOBC-LLVKDONJSA-N 1 1 241.325 3.559 20 0 BHADMO Cc1ccccc1C[C@H](C)[NH2+]C(C)(C)C(F)F ZINC000684413864 488309496 /nfs/dbraw/zinc/30/94/96/488309496.db2.gz HWZVFXQPTGHOBC-NSHDSACASA-N 1 1 241.325 3.559 20 0 BHADMO C[C@H](CC[NH2+]C(C)(C)C(F)F)c1ccccc1 ZINC000684414093 487881631 /nfs/dbraw/zinc/88/16/31/487881631.db2.gz SKFGPQAHZFONJT-LLVKDONJSA-N 1 1 241.325 3.814 20 0 BHADMO C[C@@H](CC[NH2+]C(C)(C)C(F)F)c1ccccc1 ZINC000684414094 487881329 /nfs/dbraw/zinc/88/13/29/487881329.db2.gz SKFGPQAHZFONJT-NSHDSACASA-N 1 1 241.325 3.814 20 0 BHADMO CC[N@H+](Cc1cc2ccccc2[nH]1)CC1CCC1 ZINC000684428968 488311796 /nfs/dbraw/zinc/31/17/96/488311796.db2.gz OUAYSTGJWZFVFT-UHFFFAOYSA-N 1 1 242.366 3.790 20 0 BHADMO FC1(F)CC[NH+](Cc2cccc(Cl)c2)CC1 ZINC000684429237 488311874 /nfs/dbraw/zinc/31/18/74/488311874.db2.gz RQKWJHTWIWGFBX-UHFFFAOYSA-N 1 1 245.700 3.571 20 0 BHADMO CC(C)(C)[C@H]1CCC[N@@H+](Cc2ccc(O)cc2)C1 ZINC000684429455 488311880 /nfs/dbraw/zinc/31/18/80/488311880.db2.gz XGKJEJINAKRONW-AWEZNQCLSA-N 1 1 247.382 3.650 20 0 BHADMO CC(C)(C)[C@@H]1CCC[N@@H+](Cc2ccc(O)cc2)C1 ZINC000684429456 488311976 /nfs/dbraw/zinc/31/19/76/488311976.db2.gz XGKJEJINAKRONW-CQSZACIVSA-N 1 1 247.382 3.650 20 0 BHADMO Cc1[nH]ncc1[C@H](C)[NH2+]CC1(C)CCC(C)CC1 ZINC000684558045 488327235 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ZINC000685849877 487588018 /nfs/dbraw/zinc/58/80/18/487588018.db2.gz FXYPEXJYGGCIEG-OAHLLOKOSA-N 1 1 229.367 3.615 20 0 BHADMO Cc1ccc(C[N@H+]2CC(C)(C)[C@H]2C2CC2)s1 ZINC000685849946 487587901 /nfs/dbraw/zinc/58/79/01/487587901.db2.gz UAJRNBZNEIKODK-CYBMUJFWSA-N 1 1 235.396 3.677 20 0 BHADMO Cc1ccc(C[N@H+]2CC(C)(C)[C@@H]2C2CC2)s1 ZINC000685849947 487587887 /nfs/dbraw/zinc/58/78/87/487587887.db2.gz UAJRNBZNEIKODK-ZDUSSCGKSA-N 1 1 235.396 3.677 20 0 BHADMO CCCC[C@@H](C)[N@@H+](C)Cc1n[nH]c2ccccc21 ZINC000685852453 487589152 /nfs/dbraw/zinc/58/91/52/487589152.db2.gz WSVGVLDAWWJDAG-GFCCVEGCSA-N 1 1 245.370 3.573 20 0 BHADMO CCCC[C@@H](C)[N@H+](C)Cc1n[nH]c2ccccc21 ZINC000685852453 487589148 /nfs/dbraw/zinc/58/91/48/487589148.db2.gz WSVGVLDAWWJDAG-GFCCVEGCSA-N 1 1 245.370 3.573 20 0 BHADMO CCCC[C@@H](C)[N@@H+](C)Cc1[nH]nc2ccccc21 ZINC000685852453 487589140 /nfs/dbraw/zinc/58/91/40/487589140.db2.gz WSVGVLDAWWJDAG-GFCCVEGCSA-N 1 1 245.370 3.573 20 0 BHADMO CCCC[C@H](C)[N@@H+](C)Cc1n[nH]c2ccccc21 ZINC000685852454 487589790 /nfs/dbraw/zinc/58/97/90/487589790.db2.gz WSVGVLDAWWJDAG-LBPRGKRZSA-N 1 1 245.370 3.573 20 0 BHADMO CCCC[C@H](C)[N@H+](C)Cc1n[nH]c2ccccc21 ZINC000685852454 487589783 /nfs/dbraw/zinc/58/97/83/487589783.db2.gz WSVGVLDAWWJDAG-LBPRGKRZSA-N 1 1 245.370 3.573 20 0 BHADMO CCCC[C@H](C)[N@@H+](C)Cc1[nH]nc2ccccc21 ZINC000685852454 487589775 /nfs/dbraw/zinc/58/97/75/487589775.db2.gz WSVGVLDAWWJDAG-LBPRGKRZSA-N 1 1 245.370 3.573 20 0 BHADMO CCCCCC[C@@H](C)Nc1[nH+]cnc2[nH]ccc21 ZINC000705183310 712125257 /nfs/dbraw/zinc/12/52/57/712125257.db2.gz YWPRRPXHMKWBAL-LLVKDONJSA-N 1 1 246.358 3.729 20 0 BHADMO CCCCCC[C@H](C)Nc1[nH+]cnc2[nH]ccc21 ZINC000705183314 712125552 /nfs/dbraw/zinc/12/55/52/712125552.db2.gz YWPRRPXHMKWBAL-NSHDSACASA-N 1 1 246.358 3.729 20 0 BHADMO C[C@H]1C[C@H]1CNc1ccc([NH+]2CCCCC2)cc1 ZINC000705210484 712124312 /nfs/dbraw/zinc/12/43/12/712124312.db2.gz DLEIOVOQKUUJNM-KBPBESRZSA-N 1 1 244.382 3.745 20 0 BHADMO C[C@@H]1C[C@H]1CNc1ccc([NH+]2CCCCC2)cc1 ZINC000705210486 712124396 /nfs/dbraw/zinc/12/43/96/712124396.db2.gz DLEIOVOQKUUJNM-KGLIPLIRSA-N 1 1 244.382 3.745 20 0 BHADMO C[C@H]1C[C@@H]1CNc1ccc([NH+]2CCCCC2)cc1 ZINC000705210487 712123848 /nfs/dbraw/zinc/12/38/48/712123848.db2.gz DLEIOVOQKUUJNM-UONOGXRCSA-N 1 1 244.382 3.745 20 0 BHADMO C[C@@H]1C[C@@H]1CNc1ccc([NH+]2CCCCC2)cc1 ZINC000705210810 712124280 /nfs/dbraw/zinc/12/42/80/712124280.db2.gz DLEIOVOQKUUJNM-ZIAGYGMSSA-N 1 1 244.382 3.745 20 0 BHADMO CSC1CC(Nc2cccc3cc[nH+]cc32)C1 ZINC000706742145 712153445 /nfs/dbraw/zinc/15/34/45/712153445.db2.gz JDGHVJDOFKBWDG-UHFFFAOYSA-N 1 1 244.363 3.541 20 0 BHADMO CC[C@H]([NH2+]Cc1nocc1C)c1ccc(C)cc1 ZINC000708315307 712186502 /nfs/dbraw/zinc/18/65/02/712186502.db2.gz NTUMBNCQILSRDO-AWEZNQCLSA-N 1 1 244.338 3.532 20 0 BHADMO CC[C@@H]([NH2+]Cc1nocc1C)c1ccc(C)cc1 ZINC000708315309 712186285 /nfs/dbraw/zinc/18/62/85/712186285.db2.gz NTUMBNCQILSRDO-CQSZACIVSA-N 1 1 244.338 3.532 20 0 BHADMO CCC[C@H]([NH2+]Cc1nocc1C)c1ccccc1 ZINC000708315940 712186534 /nfs/dbraw/zinc/18/65/34/712186534.db2.gz YMQZWUCRKUIRPT-AWEZNQCLSA-N 1 1 244.338 3.614 20 0 BHADMO CCC[C@@H]([NH2+]Cc1nocc1C)c1ccccc1 ZINC000708315942 712186679 /nfs/dbraw/zinc/18/66/79/712186679.db2.gz YMQZWUCRKUIRPT-CQSZACIVSA-N 1 1 244.338 3.614 20 0 BHADMO CCC[C@@H]1CCC[N@@H+](CCC(=O)C(C)(C)C)C1 ZINC000708455453 712194676 /nfs/dbraw/zinc/19/46/76/712194676.db2.gz BLGYPUGBWIDCFP-CYBMUJFWSA-N 1 1 239.403 3.504 20 0 BHADMO CCC[C@H]1CCC[N@@H+](CCC(=O)C(C)(C)C)C1 ZINC000708455463 712194855 /nfs/dbraw/zinc/19/48/55/712194855.db2.gz BLGYPUGBWIDCFP-ZDUSSCGKSA-N 1 1 239.403 3.504 20 0 BHADMO CCc1[nH+]c(C)cn1Cc1ccc(Cl)s1 ZINC000715097619 712508320 /nfs/dbraw/zinc/50/83/20/712508320.db2.gz KLXLADAMIAOVFA-UHFFFAOYSA-N 1 1 240.759 3.517 20 0 BHADMO CCc1[nH+]c(C)cn1Cc1sccc1Cl ZINC000715099032 712509055 /nfs/dbraw/zinc/50/90/55/712509055.db2.gz UMHUPOBBWYPPOZ-UHFFFAOYSA-N 1 1 240.759 3.517 20 0 BHADMO CCc1[nH+]c(C)cn1CCSc1ccccc1 ZINC000715120998 712510295 /nfs/dbraw/zinc/51/02/95/712510295.db2.gz HZXFWVUJVFULHX-UHFFFAOYSA-N 1 1 246.379 3.546 20 0 BHADMO CCc1[nH+]c(C)cn1C[C@H]1CCCCC1(F)F ZINC000715127476 712511503 /nfs/dbraw/zinc/51/15/03/712511503.db2.gz YYTUTAXJOWEFFT-LLVKDONJSA-N 1 1 242.313 3.579 20 0 BHADMO CCc1[nH+]c(C)cn1C[C@@H]1CCCCC1(F)F ZINC000715127477 712511302 /nfs/dbraw/zinc/51/13/02/712511302.db2.gz YYTUTAXJOWEFFT-NSHDSACASA-N 1 1 242.313 3.579 20 0 BHADMO CCc1[nH+]c(C)cn1Cc1ccsc1Cl ZINC000715141030 712511787 /nfs/dbraw/zinc/51/17/87/712511787.db2.gz MJKLVQIPRWLMCV-UHFFFAOYSA-N 1 1 240.759 3.517 20 0 BHADMO Cc1coc(C[NH2+]Cc2ccc(Cl)s2)c1 ZINC000718131645 712746904 /nfs/dbraw/zinc/74/69/04/712746904.db2.gz MWGBNTRBBJBKQA-UHFFFAOYSA-N 1 1 241.743 3.593 20 0 BHADMO Cc1ccc(NCc2ccnc3ccccc23)[nH+]c1 ZINC000719520378 712808986 /nfs/dbraw/zinc/80/89/86/712808986.db2.gz SJCSCUPQHXCBMF-UHFFFAOYSA-N 1 1 249.317 3.550 20 0 BHADMO C[N@@H+](Cc1cnc(Cl)s1)C1(C)CCCC1 ZINC000720378252 712837386 /nfs/dbraw/zinc/83/73/86/712837386.db2.gz FMOVFHRKOGRXCG-UHFFFAOYSA-N 1 1 244.791 3.561 20 0 BHADMO C[N@@H+](Cc1csc(Cl)n1)C1(C)CCCC1 ZINC000720380535 712837116 /nfs/dbraw/zinc/83/71/16/712837116.db2.gz VZSCCAZHJIHKGZ-UHFFFAOYSA-N 1 1 244.791 3.561 20 0 BHADMO CC(C)(C)c1coc(C[NH2+]CC2=CCCCC2)n1 ZINC000724433330 710740510 /nfs/dbraw/zinc/74/05/10/710740510.db2.gz HLCNPFIDEVMWHM-UHFFFAOYSA-N 1 1 248.370 3.562 20 0 BHADMO FC1(F)CC[NH+](Cc2ccc(Cl)cc2)CC1 ZINC000725377937 711664752 /nfs/dbraw/zinc/66/47/52/711664752.db2.gz ITMBOPLJPDLTHB-UHFFFAOYSA-N 1 1 245.700 3.571 20 0 BHADMO FC1(F)CC[NH+](Cc2ccccc2Cl)CC1 ZINC000725378119 711664706 /nfs/dbraw/zinc/66/47/06/711664706.db2.gz WFXMDYQCMIVBNF-UHFFFAOYSA-N 1 1 245.700 3.571 20 0 BHADMO CC(C)Cc1ccc(C[N@@H+](C)CC2CC2)cc1 ZINC000725794685 711609340 /nfs/dbraw/zinc/60/93/40/711609340.db2.gz FGRRDNPCVKVASB-UHFFFAOYSA-N 1 1 231.383 3.727 20 0 BHADMO CCC[N@@H+](C)Cc1ccc(CC(C)C)cc1 ZINC000725798140 632111957 /nfs/dbraw/zinc/11/19/57/632111957.db2.gz QGDSBHZUXHAPJG-UHFFFAOYSA-N 1 1 219.372 3.727 20 0 BHADMO Cc1ccccc1[C@@H]1CC[N@@H+](C/C=C/Cl)C1 ZINC000726071127 583327453 /nfs/dbraw/zinc/32/74/53/583327453.db2.gz JPGXQXDYHMOKPE-FLUIGGAXSA-N 1 1 235.758 3.537 20 0 BHADMO Cc1ccccc1[C@H]1CC[N@@H+](C/C=C/Cl)C1 ZINC000726071396 583327776 /nfs/dbraw/zinc/32/77/76/583327776.db2.gz JPGXQXDYHMOKPE-GBVBUYCNSA-N 1 1 235.758 3.537 20 0 BHADMO Cc1ccccc1[C@@H]1CC[N@@H+](C/C=C\Cl)C1 ZINC000726071399 583327833 /nfs/dbraw/zinc/32/78/33/583327833.db2.gz JPGXQXDYHMOKPE-IBSXUBTNSA-N 1 1 235.758 3.537 20 0 BHADMO Cc1ccccc1[C@H]1CC[N@@H+](C/C=C\Cl)C1 ZINC000726071402 583327769 /nfs/dbraw/zinc/32/77/69/583327769.db2.gz JPGXQXDYHMOKPE-UKOWJOKBSA-N 1 1 235.758 3.537 20 0 BHADMO C[N@H+](C/C=C\Cl)CCC1CCCCC1 ZINC000726072310 583334800 /nfs/dbraw/zinc/33/48/00/583334800.db2.gz PMMLVZWJLFJGTM-UITAMQMPSA-N 1 1 215.768 3.641 20 0 BHADMO C[N@H+](C/C=C/Cl)CCC1CCCCC1 ZINC000726072313 583334379 /nfs/dbraw/zinc/33/43/79/583334379.db2.gz PMMLVZWJLFJGTM-WEVVVXLNSA-N 1 1 215.768 3.641 20 0 BHADMO CC(C)CC[N@@H+](C)Cc1ccc(OC(C)C)cc1 ZINC000726596648 583362078 /nfs/dbraw/zinc/36/20/78/583362078.db2.gz QHFUWJMLEKNYCM-UHFFFAOYSA-N 1 1 249.398 3.952 20 0 BHADMO CC[N@H+](Cc1ccc(OC(C)C)cc1)CC(C)C ZINC000726691730 583368256 /nfs/dbraw/zinc/36/82/56/583368256.db2.gz JPXUYGFSGIBLHO-UHFFFAOYSA-N 1 1 249.398 3.952 20 0 BHADMO C[C@@H]1C[C@H](C)C[N@H+](Cc2ccc(Cl)s2)C1 ZINC000726874663 583379957 /nfs/dbraw/zinc/37/99/57/583379957.db2.gz MIMGHAZEVLBDRH-AOOOYVTPSA-N 1 1 243.803 3.879 20 0 BHADMO CC(C)Oc1ccc(C[N@@H+](C)CC(C)(C)C)cc1 ZINC000726972236 583579176 /nfs/dbraw/zinc/57/91/76/583579176.db2.gz ZHPSYNFRAKYOAD-UHFFFAOYSA-N 1 1 249.398 3.952 20 0 BHADMO Cl/C=C\C[N@H+]1CCCC[C@@H]1Cc1ccccc1 ZINC000727222054 583623690 /nfs/dbraw/zinc/62/36/90/583623690.db2.gz FKEHKAGNLAYJFR-IZIDJEDMSA-N 1 1 249.785 3.836 20 0 BHADMO Cl/C=C\C[N@H+]1CCCC[C@H]1Cc1ccccc1 ZINC000727222055 583623364 /nfs/dbraw/zinc/62/33/64/583623364.db2.gz FKEHKAGNLAYJFR-MLBQELRYSA-N 1 1 249.785 3.836 20 0 BHADMO Cl/C=C/C[N@H+]1CCCC[C@@H]1Cc1ccccc1 ZINC000727222056 583623586 /nfs/dbraw/zinc/62/35/86/583623586.db2.gz FKEHKAGNLAYJFR-WCLQSUPFSA-N 1 1 249.785 3.836 20 0 BHADMO Cl/C=C/C[N@H+]1CCCC[C@H]1Cc1ccccc1 ZINC000727222057 583623711 /nfs/dbraw/zinc/62/37/11/583623711.db2.gz FKEHKAGNLAYJFR-WGPYJDKQSA-N 1 1 249.785 3.836 20 0 BHADMO CC[N@@H+](Cc1cc(Cl)nc(Cl)c1)C(C)C ZINC000727433966 583650769 /nfs/dbraw/zinc/65/07/69/583650769.db2.gz GZXGFNAIOGOPES-UHFFFAOYSA-N 1 1 247.169 3.619 20 0 BHADMO CCCCC[C@@H](C)[NH2+]Cc1ccc2nc[nH]c2c1 ZINC000727464014 583655605 /nfs/dbraw/zinc/65/56/05/583655605.db2.gz QNEIYXVGRAFDND-GFCCVEGCSA-N 1 1 245.370 3.621 20 0 BHADMO CCCCC[C@H](C)[NH2+]Cc1ccc2nc[nH]c2c1 ZINC000727464016 583655364 /nfs/dbraw/zinc/65/53/64/583655364.db2.gz QNEIYXVGRAFDND-LBPRGKRZSA-N 1 1 245.370 3.621 20 0 BHADMO CC(C)[N@@H+](CCc1cccs1)C1CCCC1 ZINC000727757935 583764835 /nfs/dbraw/zinc/76/48/35/583764835.db2.gz MVYLZIPRVWLFGO-UHFFFAOYSA-N 1 1 237.412 3.944 20 0 BHADMO C[C@@H]1C[N@@H+](CC2CCCC2)Cc2ccccc21 ZINC000727827840 583782277 /nfs/dbraw/zinc/78/22/77/583782277.db2.gz TZHKLIWWQBSFQO-CYBMUJFWSA-N 1 1 229.367 3.796 20 0 BHADMO C[C@H]1C[N@@H+](CC2CCCC2)Cc2ccccc21 ZINC000727827841 583782338 /nfs/dbraw/zinc/78/23/38/583782338.db2.gz TZHKLIWWQBSFQO-ZDUSSCGKSA-N 1 1 229.367 3.796 20 0 BHADMO CCCC[N@@H+](C1CC1)[C@H]1CCc2ccccc21 ZINC000728052540 636238176 /nfs/dbraw/zinc/23/81/76/636238176.db2.gz JUZNEQNVQJMSHZ-INIZCTEOSA-N 1 1 229.367 3.938 20 0 BHADMO CCCC[N@@H+](C1CC1)[C@@H]1CCc2ccccc21 ZINC000728052541 636237599 /nfs/dbraw/zinc/23/75/99/636237599.db2.gz JUZNEQNVQJMSHZ-MRXNPFEDSA-N 1 1 229.367 3.938 20 0 BHADMO CC[N@H+]1CCC[C@@H]1c1ccccc1C(F)(F)F ZINC000728061724 583847093 /nfs/dbraw/zinc/84/70/93/583847093.db2.gz YWPGLZWHDOCEGV-GFCCVEGCSA-N 1 1 243.272 3.862 20 0 BHADMO CC[N@H+]1CCC[C@H]1c1ccccc1C(F)(F)F ZINC000728061725 583847130 /nfs/dbraw/zinc/84/71/30/583847130.db2.gz YWPGLZWHDOCEGV-LBPRGKRZSA-N 1 1 243.272 3.862 20 0 BHADMO COCCCCC[N@@H+](C)C1CCCCCCC1 ZINC000728688056 583904269 /nfs/dbraw/zinc/90/42/69/583904269.db2.gz CIZSKFDVEWINHG-UHFFFAOYSA-N 1 1 241.419 3.848 20 0 BHADMO CC(C)OCCC[N@@H+](C)C1CCCCCCC1 ZINC000728688806 583904496 /nfs/dbraw/zinc/90/44/96/583904496.db2.gz YHAYNTBMGQINGF-UHFFFAOYSA-N 1 1 241.419 3.846 20 0 BHADMO C[Si](C)(C)C[N@@H+](Cc1ccccc1)C1CC1 ZINC000729266789 583987950 /nfs/dbraw/zinc/98/79/50/583987950.db2.gz CYWVYRUYTLTYBL-UHFFFAOYSA-N 1 1 233.431 3.528 20 0 BHADMO C[N@@H+](Cc1ccc(Cl)s1)C[Si](C)(C)C ZINC000729266999 583988155 /nfs/dbraw/zinc/98/81/55/583988155.db2.gz GUMSWJCXYYJZBR-UHFFFAOYSA-N 1 1 247.867 3.711 20 0 BHADMO Cc1ccc(OCC[N@@H+]2[C@H](C)CCC[C@@H]2C)cc1 ZINC000729267006 583987954 /nfs/dbraw/zinc/98/79/54/583987954.db2.gz VNBYUXAEJARJGM-GASCZTMLSA-N 1 1 247.382 3.637 20 0 BHADMO C[C@@H](c1cccs1)[N@@H+](C)C[Si](C)(C)C ZINC000729267129 583987948 /nfs/dbraw/zinc/98/79/48/583987948.db2.gz KCDDGQIIHVPISO-JTQLQIEISA-N 1 1 227.449 3.618 20 0 BHADMO C[C@H](c1cccs1)[N@@H+](C)C[Si](C)(C)C ZINC000729267131 583988230 /nfs/dbraw/zinc/98/82/30/583988230.db2.gz KCDDGQIIHVPISO-SNVBAGLBSA-N 1 1 227.449 3.618 20 0 BHADMO C[C@H]1c2ccsc2CC[N@@H+]1C[Si](C)(C)C ZINC000729267308 583988171 /nfs/dbraw/zinc/98/81/71/583988171.db2.gz QKZXEGWOKBICMH-JTQLQIEISA-N 1 1 239.460 3.545 20 0 BHADMO C[C@@H]1c2ccsc2CC[N@@H+]1C[Si](C)(C)C ZINC000729267309 583988197 /nfs/dbraw/zinc/98/81/97/583988197.db2.gz QKZXEGWOKBICMH-SNVBAGLBSA-N 1 1 239.460 3.545 20 0 BHADMO C[Si](C)(C)C[N@H+]1CCC[C@@H]1c1ccsc1 ZINC000729267330 583988001 /nfs/dbraw/zinc/98/80/01/583988001.db2.gz RCWGKHMXWQDBLS-GFCCVEGCSA-N 1 1 239.460 3.762 20 0 BHADMO C[Si](C)(C)C[N@H+]1CCC[C@H]1c1ccsc1 ZINC000729267331 583987988 /nfs/dbraw/zinc/98/79/88/583987988.db2.gz RCWGKHMXWQDBLS-LBPRGKRZSA-N 1 1 239.460 3.762 20 0 BHADMO C[C@H](c1ccc(F)cc1)[N@@H+](C)C[Si](C)(C)C ZINC000729267524 583988219 /nfs/dbraw/zinc/98/82/19/583988219.db2.gz WATLLBYZJBXLEZ-LLVKDONJSA-N 1 1 239.410 3.696 20 0 BHADMO C[C@@H](c1ccc(F)cc1)[N@@H+](C)C[Si](C)(C)C ZINC000729267525 583987964 /nfs/dbraw/zinc/98/79/64/583987964.db2.gz WATLLBYZJBXLEZ-NSHDSACASA-N 1 1 239.410 3.696 20 0 BHADMO C[Si](C)(C)C[N@H+]1CCC[C@H]1c1ccccc1 ZINC000729267543 583988267 /nfs/dbraw/zinc/98/82/67/583988267.db2.gz XBBJQFSVRGRPNT-AWEZNQCLSA-N 1 1 233.431 3.701 20 0 BHADMO C[Si](C)(C)C[N@H+]1CCC[C@@H]1c1ccccc1 ZINC000729267544 583987924 /nfs/dbraw/zinc/98/79/24/583987924.db2.gz XBBJQFSVRGRPNT-CQSZACIVSA-N 1 1 233.431 3.701 20 0 BHADMO C[Si](C)(C)C[N@@H+](Cc1cccs1)C1CC1 ZINC000729267606 583987926 /nfs/dbraw/zinc/98/79/26/583987926.db2.gz ZCLCUCPSDAJSBZ-UHFFFAOYSA-N 1 1 239.460 3.590 20 0 BHADMO C[C@H](c1ccccc1F)[N@@H+](C)C[Si](C)(C)C ZINC000729268213 583988138 /nfs/dbraw/zinc/98/81/38/583988138.db2.gz RHWNJYNTAGZYKG-LLVKDONJSA-N 1 1 239.410 3.696 20 0 BHADMO C[C@@H](c1ccccc1F)[N@@H+](C)C[Si](C)(C)C ZINC000729268214 583987975 /nfs/dbraw/zinc/98/79/75/583987975.db2.gz RHWNJYNTAGZYKG-NSHDSACASA-N 1 1 239.410 3.696 20 0 BHADMO CC(C)(C)[C@H]1CCC[N@H+]1CCc1cccs1 ZINC000729474354 584015118 /nfs/dbraw/zinc/01/51/18/584015118.db2.gz GBGREFIZTVBPOQ-CYBMUJFWSA-N 1 1 237.412 3.801 20 0 BHADMO CC(C)(C)[C@@H]1CCC[N@H+]1CCc1cccs1 ZINC000729474355 584015181 /nfs/dbraw/zinc/01/51/81/584015181.db2.gz GBGREFIZTVBPOQ-ZDUSSCGKSA-N 1 1 237.412 3.801 20 0 BHADMO Cc1cccc2c1CC[N@@H+](CC1CCCC1)C2 ZINC000729476729 584015308 /nfs/dbraw/zinc/01/53/08/584015308.db2.gz DXONBYQFTRRUMU-UHFFFAOYSA-N 1 1 229.367 3.543 20 0 BHADMO CCC(CC)[N@@H+](CCOCCC(C)C)C1CC1 ZINC000729542547 584018214 /nfs/dbraw/zinc/01/82/14/584018214.db2.gz LGQNEJLNIGDVKL-UHFFFAOYSA-N 1 1 241.419 3.702 20 0 BHADMO CC[C@H](C)[C@@H](C)[N@@H+](C/C=C\Cl)C1CC1 ZINC000729544687 584017877 /nfs/dbraw/zinc/01/78/77/584017877.db2.gz LAWXWZCDMPYDQJ-CGBBGSNDSA-N 1 1 215.768 3.638 20 0 BHADMO CC[C@H](C)[C@@H](C)[N@@H+](C/C=C/Cl)C1CC1 ZINC000729544688 584018148 /nfs/dbraw/zinc/01/81/48/584018148.db2.gz LAWXWZCDMPYDQJ-DBWQMSJVSA-N 1 1 215.768 3.638 20 0 BHADMO CC[C@H](C)[C@H](C)[N@@H+](C/C=C/Cl)C1CC1 ZINC000729544690 584017688 /nfs/dbraw/zinc/01/76/88/584017688.db2.gz LAWXWZCDMPYDQJ-VAZREYJMSA-N 1 1 215.768 3.638 20 0 BHADMO CC[C@H](C)[C@H](C)[N@@H+](C/C=C\Cl)C1CC1 ZINC000729544692 584017958 /nfs/dbraw/zinc/01/79/58/584017958.db2.gz LAWXWZCDMPYDQJ-ZSDATDQRSA-N 1 1 215.768 3.638 20 0 BHADMO CCCC(N)=[NH+]OCc1cccc2ccccc21 ZINC000729849629 584026871 /nfs/dbraw/zinc/02/68/71/584026871.db2.gz LMULYRUSFHDXLE-UHFFFAOYSA-N 1 1 242.322 3.638 20 0 BHADMO CCCC(N)=[NH+]OCc1ccc(C(C)(C)C)cc1 ZINC000729850422 584026650 /nfs/dbraw/zinc/02/66/50/584026650.db2.gz YFLIPHJYIHHRBX-UHFFFAOYSA-N 1 1 248.370 3.783 20 0 BHADMO Cl/C=C/C[N@H+]1CCC[C@@H](Cc2ccccc2)C1 ZINC000730062798 584119961 /nfs/dbraw/zinc/11/99/61/584119961.db2.gz SRGAWXQTQHAOMS-BOSPYUDASA-N 1 1 249.785 3.694 20 0 BHADMO Cl/C=C/C[N@H+]1CCC[C@H](Cc2ccccc2)C1 ZINC000730062800 584119997 /nfs/dbraw/zinc/11/99/97/584119997.db2.gz SRGAWXQTQHAOMS-FUVBFXSKSA-N 1 1 249.785 3.694 20 0 BHADMO Cl/C=C\C[N@H+]1CCC[C@H](Cc2ccccc2)C1 ZINC000730062802 584119929 /nfs/dbraw/zinc/11/99/29/584119929.db2.gz SRGAWXQTQHAOMS-HMZQOCAUSA-N 1 1 249.785 3.694 20 0 BHADMO Cl/C=C\C[N@H+]1CCC[C@@H](Cc2ccccc2)C1 ZINC000730062804 584119725 /nfs/dbraw/zinc/11/97/25/584119725.db2.gz SRGAWXQTQHAOMS-ZHMISCPASA-N 1 1 249.785 3.694 20 0 BHADMO ClC1(Cl)C[C@@H]1C[N@@H+](C1CC1)C1CCCC1 ZINC000730893257 584919584 /nfs/dbraw/zinc/91/95/84/584919584.db2.gz OLQQKGAGQVQLLN-SECBINFHSA-N 1 1 248.197 3.587 20 0 BHADMO ClC1(Cl)C[C@H]1C[N@@H+](C1CC1)C1CCCC1 ZINC000730893258 584919559 /nfs/dbraw/zinc/91/95/59/584919559.db2.gz OLQQKGAGQVQLLN-VIFPVBQESA-N 1 1 248.197 3.587 20 0 BHADMO CC[N@@H+](C[Si](C)(C)C)C1CCCCC1 ZINC000731210183 584923405 /nfs/dbraw/zinc/92/34/05/584923405.db2.gz BKHKUJMVFZEITA-UHFFFAOYSA-N 1 1 213.441 3.518 20 0 BHADMO C[C@H]1C[N@H+]([C@@H]2C=CCCC2)Cc2ccccc21 ZINC000731210633 584923420 /nfs/dbraw/zinc/92/34/20/584923420.db2.gz WRHHHCFKTLFPQO-DZGCQCFKSA-N 1 1 227.351 3.714 20 0 BHADMO C[C@@H]1C[N@H+]([C@H]2C=CCCC2)Cc2ccccc21 ZINC000731210634 584923431 /nfs/dbraw/zinc/92/34/31/584923431.db2.gz WRHHHCFKTLFPQO-HIFRSBDPSA-N 1 1 227.351 3.714 20 0 BHADMO C[C@@H]1C[N@H+]([C@@H]2C=CCCC2)Cc2ccccc21 ZINC000731210635 584923533 /nfs/dbraw/zinc/92/35/33/584923533.db2.gz WRHHHCFKTLFPQO-UKRRQHHQSA-N 1 1 227.351 3.714 20 0 BHADMO C[C@H]1C[N@H+]([C@H]2C=CCCC2)Cc2ccccc21 ZINC000731210636 584923597 /nfs/dbraw/zinc/92/35/97/584923597.db2.gz WRHHHCFKTLFPQO-ZFWWWQNUSA-N 1 1 227.351 3.714 20 0 BHADMO CCC(CC)[N@@H+](C[Si](C)(C)C)C1CC1 ZINC000731211608 584923787 /nfs/dbraw/zinc/92/37/87/584923787.db2.gz QLVPSBULLHQPLE-UHFFFAOYSA-N 1 1 213.441 3.517 20 0 BHADMO c1ccc(CC[N@@H+](C2CC2)[C@H]2C=CCCC2)cc1 ZINC000731211978 584923637 /nfs/dbraw/zinc/92/36/37/584923637.db2.gz MCVAVEMWTGZIAW-INIZCTEOSA-N 1 1 241.378 3.802 20 0 BHADMO c1ccc(CC[N@@H+](C2CC2)[C@@H]2C=CCCC2)cc1 ZINC000731211979 584923895 /nfs/dbraw/zinc/92/38/95/584923895.db2.gz MCVAVEMWTGZIAW-MRXNPFEDSA-N 1 1 241.378 3.802 20 0 BHADMO CC(C)[N@@H+](Cc1cccs1)C[Si](C)(C)C ZINC000731212158 584923740 /nfs/dbraw/zinc/92/37/40/584923740.db2.gz WPKMHDLLRCBEOM-UHFFFAOYSA-N 1 1 241.476 3.836 20 0 BHADMO C[C@H](C[N@@H+](C)C[Si](C)(C)C)c1ccccc1 ZINC000731212452 584923729 /nfs/dbraw/zinc/92/37/29/584923729.db2.gz MUPVBRSVOPQDKR-CYBMUJFWSA-N 1 1 235.447 3.599 20 0 BHADMO C[C@@H](C[N@@H+](C)C[Si](C)(C)C)c1ccccc1 ZINC000731212453 584923722 /nfs/dbraw/zinc/92/37/22/584923722.db2.gz MUPVBRSVOPQDKR-ZDUSSCGKSA-N 1 1 235.447 3.599 20 0 BHADMO Cc1ccccc1OCC[N@@H+]1[C@H](C)CCC[C@@H]1C ZINC000731279948 584924521 /nfs/dbraw/zinc/92/45/21/584924521.db2.gz WYXGPUYHAGKXNK-GASCZTMLSA-N 1 1 247.382 3.637 20 0 BHADMO C[N@@H+](CCc1ccccc1F)CC1CCCCC1 ZINC000731670991 584928105 /nfs/dbraw/zinc/92/81/05/584928105.db2.gz LIMDTMSLVYPHDV-UHFFFAOYSA-N 1 1 249.373 3.880 20 0 BHADMO CC[C@H](C)C[N@@H+](C)Cc1ccc(OC(C)C)cc1 ZINC000732205484 584934655 /nfs/dbraw/zinc/93/46/55/584934655.db2.gz ICWUMZHIDIVNGC-AWEZNQCLSA-N 1 1 249.398 3.952 20 0 BHADMO CC[C@@H](C)C[N@@H+](C)Cc1ccc(OC(C)C)cc1 ZINC000732205485 584934734 /nfs/dbraw/zinc/93/47/34/584934734.db2.gz ICWUMZHIDIVNGC-CQSZACIVSA-N 1 1 249.398 3.952 20 0 BHADMO CCCC[N@H+]1[C@H](C)CO[C@H](c2ccccc2)[C@H]1C ZINC000732208888 584934849 /nfs/dbraw/zinc/93/48/49/584934849.db2.gz GJZRNUKUCBUHHX-FMKPAKJESA-N 1 1 247.382 3.637 20 0 BHADMO CCCC[N@H+]1[C@H](C)CO[C@@H](c2ccccc2)[C@H]1C ZINC000732208889 584934759 /nfs/dbraw/zinc/93/47/59/584934759.db2.gz GJZRNUKUCBUHHX-IIAWOOMASA-N 1 1 247.382 3.637 20 0 BHADMO CCCC[N@H+]1[C@H](C)CO[C@@H](c2ccccc2)[C@@H]1C ZINC000732208890 584934795 /nfs/dbraw/zinc/93/47/95/584934795.db2.gz GJZRNUKUCBUHHX-IJEWVQPXSA-N 1 1 247.382 3.637 20 0 BHADMO CCCC[N@H+]1[C@H](C)CO[C@H](c2ccccc2)[C@@H]1C ZINC000732208891 584934584 /nfs/dbraw/zinc/93/45/84/584934584.db2.gz GJZRNUKUCBUHHX-YCPHGPKFSA-N 1 1 247.382 3.637 20 0 BHADMO Cl/C=C\C[N@H+]1CCCC2(CCCCC2)C1 ZINC000732411889 584936989 /nfs/dbraw/zinc/93/69/89/584936989.db2.gz CGBAWNPKFNQGQI-UITAMQMPSA-N 1 1 227.779 3.785 20 0 BHADMO Cl/C=C/C[N@H+]1CCCC2(CCCCC2)C1 ZINC000732411890 584936893 /nfs/dbraw/zinc/93/68/93/584936893.db2.gz CGBAWNPKFNQGQI-WEVVVXLNSA-N 1 1 227.779 3.785 20 0 BHADMO CCC[N@H+]1CCC[C@@H]1c1ccc(F)c(F)c1 ZINC000732987314 641883255 /nfs/dbraw/zinc/88/32/55/641883255.db2.gz UGUBWZHILCDZRE-CYBMUJFWSA-N 1 1 225.282 3.512 20 0 BHADMO CCC[N@H+]1CCC[C@H]1c1ccc(F)c(F)c1 ZINC000732987315 641882556 /nfs/dbraw/zinc/88/25/56/641882556.db2.gz UGUBWZHILCDZRE-ZDUSSCGKSA-N 1 1 225.282 3.512 20 0 BHADMO CC(C)C[N@H+]1CCC[C@H]1c1ccc(F)c(F)c1 ZINC000732988308 641883764 /nfs/dbraw/zinc/88/37/64/641883764.db2.gz GRTOZPDECPAIOZ-AWEZNQCLSA-N 1 1 239.309 3.758 20 0 BHADMO CC(C)C[N@H+]1CCC[C@@H]1c1ccc(F)c(F)c1 ZINC000732988309 641882952 /nfs/dbraw/zinc/88/29/52/641882952.db2.gz GRTOZPDECPAIOZ-CQSZACIVSA-N 1 1 239.309 3.758 20 0 BHADMO CCCC[N@H+]1CCC[C@H]1c1ccc(F)c(F)c1 ZINC000732990010 641883368 /nfs/dbraw/zinc/88/33/68/641883368.db2.gz ZNDNADKPABRGEB-AWEZNQCLSA-N 1 1 239.309 3.902 20 0 BHADMO CCCC[N@H+]1CCC[C@@H]1c1ccc(F)c(F)c1 ZINC000732990011 641882474 /nfs/dbraw/zinc/88/24/74/641882474.db2.gz ZNDNADKPABRGEB-CQSZACIVSA-N 1 1 239.309 3.902 20 0 BHADMO CC(C)c1cnc(C[N@@H+](C)C2CCCCC2)o1 ZINC000733304792 643323740 /nfs/dbraw/zinc/32/37/40/643323740.db2.gz TYFVQJSZHQZODZ-UHFFFAOYSA-N 1 1 236.359 3.563 20 0 BHADMO CC[C@@H]1CCCC[N@H+]1Cc1ncc(C(C)C)o1 ZINC000733305107 643323685 /nfs/dbraw/zinc/32/36/85/643323685.db2.gz YULPVDAOMGLYKD-GFCCVEGCSA-N 1 1 236.359 3.563 20 0 BHADMO CC[C@H]1CCCC[N@H+]1Cc1ncc(C(C)C)o1 ZINC000733305108 643323376 /nfs/dbraw/zinc/32/33/76/643323376.db2.gz YULPVDAOMGLYKD-LBPRGKRZSA-N 1 1 236.359 3.563 20 0 BHADMO CCCC[N@@H+](Cc1ncc(C(C)C)o1)C1CC1 ZINC000733306555 584947005 /nfs/dbraw/zinc/94/70/05/584947005.db2.gz DESKDDXKVUOONR-UHFFFAOYSA-N 1 1 236.359 3.563 20 0 BHADMO CCCC[N@H+](Cc1ncc(C(C)C)o1)C1CC1 ZINC000733306555 584947004 /nfs/dbraw/zinc/94/70/04/584947004.db2.gz DESKDDXKVUOONR-UHFFFAOYSA-N 1 1 236.359 3.563 20 0 BHADMO CC(C)c1cnc(C[N@@H+]([C@H](C)C2CC2)C2CC2)o1 ZINC000733306740 584946984 /nfs/dbraw/zinc/94/69/84/584946984.db2.gz DVSHKTMTUZKCRH-LLVKDONJSA-N 1 1 248.370 3.561 20 0 BHADMO CC(C)c1cnc(C[N@@H+]([C@@H](C)C2CC2)C2CC2)o1 ZINC000733306741 584946995 /nfs/dbraw/zinc/94/69/95/584946995.db2.gz DVSHKTMTUZKCRH-NSHDSACASA-N 1 1 248.370 3.561 20 0 BHADMO CC[N@@H+](Cc1ncc(C(C)C)o1)C1CCCC1 ZINC000733306838 584947011 /nfs/dbraw/zinc/94/70/11/584947011.db2.gz HWSITFFKJFGOTJ-UHFFFAOYSA-N 1 1 236.359 3.563 20 0 BHADMO CC(C)c1cnc(C[N@@H+](C2CC2)C2CCCC2)o1 ZINC000733307190 584946971 /nfs/dbraw/zinc/94/69/71/584946971.db2.gz KHNWIJLIXKAKRC-UHFFFAOYSA-N 1 1 248.370 3.705 20 0 BHADMO CC(C)c1cnc(C[N@@H+](C)[C@H](C)C(C)(C)C)o1 ZINC000733308048 584946935 /nfs/dbraw/zinc/94/69/35/584946935.db2.gz TUHPHDYTAYSQPT-LLVKDONJSA-N 1 1 238.375 3.664 20 0 BHADMO CC(C)c1cnc(C[N@@H+](C)[C@@H](C)C(C)(C)C)o1 ZINC000733308049 584946642 /nfs/dbraw/zinc/94/66/42/584946642.db2.gz TUHPHDYTAYSQPT-NSHDSACASA-N 1 1 238.375 3.664 20 0 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UZHSEEVOASZQFU-UHFFFAOYSA-N 1 1 207.308 3.544 20 0 BHADMO CCCCCC[N@H+]1CC[C@@H](c2ccco2)C1 ZINC000740877281 644560640 /nfs/dbraw/zinc/56/06/40/644560640.db2.gz KWUFIAPIHGRVQT-CYBMUJFWSA-N 1 1 221.344 3.649 20 0 BHADMO CCCCCC[N@H+]1CC[C@H](c2ccco2)C1 ZINC000740877282 644561271 /nfs/dbraw/zinc/56/12/71/644561271.db2.gz KWUFIAPIHGRVQT-ZDUSSCGKSA-N 1 1 221.344 3.649 20 0 BHADMO CCCCCC[N@@H+](C)CCc1ccccc1F ZINC000740877467 644561099 /nfs/dbraw/zinc/56/10/99/644561099.db2.gz PIESOKRWDFNJEA-UHFFFAOYSA-N 1 1 237.362 3.880 20 0 BHADMO CCCCCC[N@@H+](CCC)C[C@@H]1CCCCO1 ZINC000740878043 644563663 /nfs/dbraw/zinc/56/36/63/644563663.db2.gz SCWRCPYLASYVBY-HNNXBMFYSA-N 1 1 241.419 3.848 20 0 BHADMO CCCCCC[N@@H+](CCC)C[C@H]1CCCCO1 ZINC000740878044 644563610 /nfs/dbraw/zinc/56/36/10/644563610.db2.gz SCWRCPYLASYVBY-OAHLLOKOSA-N 1 1 241.419 3.848 20 0 BHADMO CC(C)c1cnc(C[N@H+](C(C)C)C2CCC2)o1 ZINC000740886539 585107949 /nfs/dbraw/zinc/10/79/49/585107949.db2.gz SYBOCLWSZAFXAS-UHFFFAOYSA-N 1 1 236.359 3.561 20 0 BHADMO Cc1ccc(OCC[N@H+](C(C)C)C2CCC2)cc1 ZINC000740886758 585107945 /nfs/dbraw/zinc/10/79/45/585107945.db2.gz YYXYHGFGPKNHDJ-UHFFFAOYSA-N 1 1 247.382 3.637 20 0 BHADMO CC[N@H+](CCc1ccccn1)CCC1CCCC1 ZINC000741781441 585118391 /nfs/dbraw/zinc/11/83/91/585118391.db2.gz MHUWGMCZYAIRRL-UHFFFAOYSA-N 1 1 246.398 3.526 20 0 BHADMO C[N@H+](CCc1ccccc1F)CCC1CCCC1 ZINC000741786203 585119118 /nfs/dbraw/zinc/11/91/18/585119118.db2.gz ZBLUTIRPMLLTNW-UHFFFAOYSA-N 1 1 249.373 3.880 20 0 BHADMO C[C@@H]1CCC[C@@H](C)[N@@H+](CCc2cccs2)C1 ZINC000741793330 585119195 /nfs/dbraw/zinc/11/91/95/585119195.db2.gz IWJGOAYLHCDRNQ-CHWSQXEVSA-N 1 1 237.412 3.801 20 0 BHADMO C[C@@H]1CCC[C@H](C)[N@@H+](CCc2cccs2)C1 ZINC000741793337 585118981 /nfs/dbraw/zinc/11/89/81/585118981.db2.gz IWJGOAYLHCDRNQ-OLZOCXBDSA-N 1 1 237.412 3.801 20 0 BHADMO C[C@@H]1CCC[C@H](C)C[N@@H+]1CCc1cccs1 ZINC000741793338 585119210 /nfs/dbraw/zinc/11/92/10/585119210.db2.gz IWJGOAYLHCDRNQ-QWHCGFSZSA-N 1 1 237.412 3.801 20 0 BHADMO C[C@H]1CCC[C@H](C)[N@@H+](CCc2cccs2)C1 ZINC000741793339 585118923 /nfs/dbraw/zinc/11/89/23/585118923.db2.gz IWJGOAYLHCDRNQ-STQMWFEESA-N 1 1 237.412 3.801 20 0 BHADMO CC1(C)CCC[N@@H+](CCc2cccs2)CC1 ZINC000741805689 585119388 /nfs/dbraw/zinc/11/93/88/585119388.db2.gz SAURSVMXRIHQLF-UHFFFAOYSA-N 1 1 237.412 3.803 20 0 BHADMO c1csc(CC[N@H+]2CCC3(C2)CCCCC3)c1 ZINC000741808338 585119828 /nfs/dbraw/zinc/11/98/28/585119828.db2.gz QRQCLMSVSQMNQB-UHFFFAOYSA-N 1 1 249.423 3.947 20 0 BHADMO CC[C@H](Cc1ccccc1)[N@@H+](C)C/C=C/Cl ZINC000741811281 585119863 /nfs/dbraw/zinc/11/98/63/585119863.db2.gz OEGDICFEKXRMDG-DNGMOHDESA-N 1 1 237.774 3.692 20 0 BHADMO CC[C@H](Cc1ccccc1)[N@@H+](C)C/C=C\Cl ZINC000741811282 585119973 /nfs/dbraw/zinc/11/99/73/585119973.db2.gz OEGDICFEKXRMDG-JKEYDSJLSA-N 1 1 237.774 3.692 20 0 BHADMO CC[C@@H](Cc1ccccc1)[N@@H+](C)C/C=C/Cl ZINC000741811283 585119911 /nfs/dbraw/zinc/11/99/11/585119911.db2.gz OEGDICFEKXRMDG-RNVIBTMRSA-N 1 1 237.774 3.692 20 0 BHADMO CC[C@@H](Cc1ccccc1)[N@@H+](C)C/C=C\Cl ZINC000741811284 585119780 /nfs/dbraw/zinc/11/97/80/585119780.db2.gz OEGDICFEKXRMDG-YHAOYDPOSA-N 1 1 237.774 3.692 20 0 BHADMO C[C@@H]1C[N@@H+](C/C=C/Cl)CC[C@H]1c1ccccc1 ZINC000741811291 585119841 /nfs/dbraw/zinc/11/98/41/585119841.db2.gz OLUJPSIWNLKBSY-IVZDOJFNSA-N 1 1 249.785 3.865 20 0 BHADMO C[C@@H]1C[N@@H+](C/C=C/Cl)CC[C@@H]1c1ccccc1 ZINC000741811292 585119983 /nfs/dbraw/zinc/11/99/83/585119983.db2.gz OLUJPSIWNLKBSY-JHTAHENJSA-N 1 1 249.785 3.865 20 0 BHADMO C[C@@H]1C[N@@H+](C/C=C\Cl)CC[C@@H]1c1ccccc1 ZINC000741811293 585119960 /nfs/dbraw/zinc/11/99/60/585119960.db2.gz OLUJPSIWNLKBSY-JSHITJIMSA-N 1 1 249.785 3.865 20 0 BHADMO C[C@@H]1C[N@@H+](C/C=C\Cl)CC[C@H]1c1ccccc1 ZINC000741811294 585119821 /nfs/dbraw/zinc/11/98/21/585119821.db2.gz OLUJPSIWNLKBSY-UDDXRPRYSA-N 1 1 249.785 3.865 20 0 BHADMO Cc1cccc(F)c1C[NH2+]Cc1ccccc1F ZINC000742380209 585125333 /nfs/dbraw/zinc/12/53/33/585125333.db2.gz KBJRRRSJUJXTMK-UHFFFAOYSA-N 1 1 247.288 3.563 20 0 BHADMO CC[C@@H](CNc1ccc(C)c[nH+]1)c1ccccc1 ZINC000742390655 585125666 /nfs/dbraw/zinc/12/56/66/585125666.db2.gz XIKNGIDEJMRXID-AWEZNQCLSA-N 1 1 240.350 3.996 20 0 BHADMO CC[C@H](CNc1ccc(C)c[nH+]1)c1ccccc1 ZINC000742390659 585125859 /nfs/dbraw/zinc/12/58/59/585125859.db2.gz XIKNGIDEJMRXID-CQSZACIVSA-N 1 1 240.350 3.996 20 0 BHADMO Cc1ccc(NCc2nccc3ccccc32)[nH+]c1 ZINC000742392175 585125801 /nfs/dbraw/zinc/12/58/01/585125801.db2.gz LXRBZUXODKWXOR-UHFFFAOYSA-N 1 1 249.317 3.550 20 0 BHADMO Cc1ccc(NC[C@@H]2CCc3ccccc32)[nH+]c1 ZINC000742406393 585125701 /nfs/dbraw/zinc/12/57/01/585125701.db2.gz LFCBNYMHAOPLNZ-AWEZNQCLSA-N 1 1 238.334 3.532 20 0 BHADMO Cc1ccc(NC[C@H]2CCc3ccccc32)[nH+]c1 ZINC000742406400 585125797 /nfs/dbraw/zinc/12/57/97/585125797.db2.gz LFCBNYMHAOPLNZ-CQSZACIVSA-N 1 1 238.334 3.532 20 0 BHADMO Cc1ccc(NC/C=C\c2ccccc2)[nH+]c1 ZINC000742407339 585125422 /nfs/dbraw/zinc/12/54/22/585125422.db2.gz LJMWPWZDBPBMRA-YVMONPNESA-N 1 1 224.307 3.515 20 0 BHADMO Cc1ccc([C@@H](C)CNc2ccc(C)c[nH+]2)cc1 ZINC000742408448 585125757 /nfs/dbraw/zinc/12/57/57/585125757.db2.gz DYOHHZBVUQLPRY-AWEZNQCLSA-N 1 1 240.350 3.914 20 0 BHADMO Cc1ccc([C@H](C)CNc2ccc(C)c[nH+]2)cc1 ZINC000742408449 585125759 /nfs/dbraw/zinc/12/57/59/585125759.db2.gz DYOHHZBVUQLPRY-CQSZACIVSA-N 1 1 240.350 3.914 20 0 BHADMO Cc1ccc(NCCc2cc(C)cc(C)c2)[nH+]c1 ZINC000742409234 585125689 /nfs/dbraw/zinc/12/56/89/585125689.db2.gz YSONKRKGQYDVMN-UHFFFAOYSA-N 1 1 240.350 3.661 20 0 BHADMO CC[N@@H+](CCOc1ccc(C)cc1)[C@@H](C)C(C)C ZINC000743271579 585134502 /nfs/dbraw/zinc/13/45/02/585134502.db2.gz BVXLEOHFQQNYKF-HNNXBMFYSA-N 1 1 249.398 3.740 20 0 BHADMO CC[N@@H+](C[C@H]1CC1(Cl)Cl)[C@H](C)C(C)C ZINC000743272504 585134446 /nfs/dbraw/zinc/13/44/46/585134446.db2.gz VGHOOIGKPQJCIJ-NXEZZACHSA-N 1 1 238.202 3.547 20 0 BHADMO CC[N@@H+](C[C@@H]1CC1(Cl)Cl)[C@@H](C)C(C)C ZINC000743272507 585134487 /nfs/dbraw/zinc/13/44/87/585134487.db2.gz VGHOOIGKPQJCIJ-UWVGGRQHSA-N 1 1 238.202 3.547 20 0 BHADMO CC[N@@H+](C[C@H]1CC1(Cl)Cl)[C@@H](C)C(C)C ZINC000743272508 585134181 /nfs/dbraw/zinc/13/41/81/585134181.db2.gz VGHOOIGKPQJCIJ-VHSXEESVSA-N 1 1 238.202 3.547 20 0 BHADMO CC[N@@H+](C[C@@H]1CC1(Cl)Cl)[C@H](C)C(C)C ZINC000743272509 585134189 /nfs/dbraw/zinc/13/41/89/585134189.db2.gz VGHOOIGKPQJCIJ-ZJUUUORDSA-N 1 1 238.202 3.547 20 0 BHADMO Cc1ccc(C2=CC[N@@H+](CC3CCC3)CC2)cc1 ZINC000743836036 585140077 /nfs/dbraw/zinc/14/00/77/585140077.db2.gz OCKVNCPHQODZCE-UHFFFAOYSA-N 1 1 241.378 3.884 20 0 BHADMO CCC(C)(C)CC[N@@H+](C)Cc1c(C)noc1C ZINC000743840434 585140189 /nfs/dbraw/zinc/14/01/89/585140189.db2.gz LFIQJUTWRVDDAD-UHFFFAOYSA-N 1 1 238.375 3.550 20 0 BHADMO CC(C)[N@@H+](CCc1cccs1)CC1CCC1 ZINC000743842594 585140419 /nfs/dbraw/zinc/14/04/19/585140419.db2.gz IAQWJVZSQJAFDF-UHFFFAOYSA-N 1 1 237.412 3.801 20 0 BHADMO C[N@@H+](CCC1CC1)C1CCCCCCC1 ZINC000743843474 585140310 /nfs/dbraw/zinc/14/03/10/585140310.db2.gz RKQLCPIWWBLXTH-UHFFFAOYSA-N 1 1 209.377 3.831 20 0 BHADMO CSCCC[N@@H+](C)C1CCCCCCC1 ZINC000743843714 585140351 /nfs/dbraw/zinc/14/03/51/585140351.db2.gz RVJNTCPEJZGAOG-UHFFFAOYSA-N 1 1 229.433 3.784 20 0 BHADMO C[N@@H+](CC1CCC1)C1CCCCCCC1 ZINC000743843784 585140508 /nfs/dbraw/zinc/14/05/08/585140508.db2.gz VCVJTATUFQLRON-UHFFFAOYSA-N 1 1 209.377 3.831 20 0 BHADMO CCCCCC[N@H+]1CCC[C@@H]2CCC[C@@H]21 ZINC000743849909 585140858 /nfs/dbraw/zinc/14/08/58/585140858.db2.gz AZEBWXRRYGYBRA-KBPBESRZSA-N 1 1 209.377 3.831 20 0 BHADMO CCCCCC[N@H+]1CCC[C@H]2CCC[C@@H]21 ZINC000743849910 585140953 /nfs/dbraw/zinc/14/09/53/585140953.db2.gz AZEBWXRRYGYBRA-KGLIPLIRSA-N 1 1 209.377 3.831 20 0 BHADMO CCCCCC[N@H+]1CCC[C@@H]2CCC[C@H]21 ZINC000743849911 585140825 /nfs/dbraw/zinc/14/08/25/585140825.db2.gz AZEBWXRRYGYBRA-UONOGXRCSA-N 1 1 209.377 3.831 20 0 BHADMO CCCCCC[N@H+]1CCC[C@H]2CCC[C@H]21 ZINC000743849912 585140808 /nfs/dbraw/zinc/14/08/08/585140808.db2.gz AZEBWXRRYGYBRA-ZIAGYGMSSA-N 1 1 209.377 3.831 20 0 BHADMO CC[C@H]1CCCCC[N@H+]1CCCCCCCO ZINC000743851173 585140594 /nfs/dbraw/zinc/14/05/94/585140594.db2.gz MRRGRTAVKFYPPG-HNNXBMFYSA-N 1 1 241.419 3.584 20 0 BHADMO CC[C@@H]1CCCCC[N@H+]1CCCCCCCO ZINC000743851174 585140795 /nfs/dbraw/zinc/14/07/95/585140795.db2.gz MRRGRTAVKFYPPG-OAHLLOKOSA-N 1 1 241.419 3.584 20 0 BHADMO CC(C)Cc1ccc(C[N@@H+](C)C2CCC2)cc1 ZINC000743852907 585141336 /nfs/dbraw/zinc/14/13/36/585141336.db2.gz LIEVWVHYVOFQPM-UHFFFAOYSA-N 1 1 231.383 3.869 20 0 BHADMO CCCCCC[N@@H+](C)[C@@H](CCO)c1ccccc1 ZINC000743857010 585141330 /nfs/dbraw/zinc/14/13/30/585141330.db2.gz REWTUVPPADAIAF-INIZCTEOSA-N 1 1 249.398 3.622 20 0 BHADMO CCCCCC[N@@H+](C)[C@H](CCO)c1ccccc1 ZINC000743857011 585141044 /nfs/dbraw/zinc/14/10/44/585141044.db2.gz REWTUVPPADAIAF-MRXNPFEDSA-N 1 1 249.398 3.622 20 0 BHADMO CCCCCC[N@@H+](C)CCc1cccs1 ZINC000743859664 585141430 /nfs/dbraw/zinc/14/14/30/585141430.db2.gz GYIZCPFVZCSFIR-UHFFFAOYSA-N 1 1 225.401 3.803 20 0 BHADMO CC[C@@]1(C)CCC[N@@H+](CCc2cccs2)C1 ZINC000743860862 585141086 /nfs/dbraw/zinc/14/10/86/585141086.db2.gz XVUOHBPDBNDDSJ-AWEZNQCLSA-N 1 1 237.412 3.803 20 0 BHADMO CC[C@]1(C)CCC[N@@H+](CCc2cccs2)C1 ZINC000743860863 585141368 /nfs/dbraw/zinc/14/13/68/585141368.db2.gz XVUOHBPDBNDDSJ-CQSZACIVSA-N 1 1 237.412 3.803 20 0 BHADMO C(C1CCCCC1)[N@H+]1CCC2(CCCC2)C1 ZINC000743863019 585141124 /nfs/dbraw/zinc/14/11/24/585141124.db2.gz PGOWKTKXYWCTFR-UHFFFAOYSA-N 1 1 221.388 3.833 20 0 BHADMO C(=C/c1ccccc1)\C[N@H+]1CCC2(CCCC2)C1 ZINC000743863354 585141318 /nfs/dbraw/zinc/14/13/18/585141318.db2.gz GUYJDEJBCWHRPN-RMKNXTFCSA-N 1 1 241.378 3.966 20 0 BHADMO C(=C\c1ccccc1)\C[N@H+]1CCC2(CCCC2)C1 ZINC000743863356 585141502 /nfs/dbraw/zinc/14/15/02/585141502.db2.gz GUYJDEJBCWHRPN-TWGQIWQCSA-N 1 1 241.378 3.966 20 0 BHADMO Cc1cccc(C[N@H+]2CCC3(CCCC3)C2)c1 ZINC000743863417 585141046 /nfs/dbraw/zinc/14/10/46/585141046.db2.gz JQNCEIRXHIFDQJ-UHFFFAOYSA-N 1 1 229.367 3.761 20 0 BHADMO Cc1ccc(C[N@H+]2CCC3(CCCC3)C2)cc1 ZINC000743863690 585141388 /nfs/dbraw/zinc/14/13/88/585141388.db2.gz LMTAKWFAFAGRMU-UHFFFAOYSA-N 1 1 229.367 3.761 20 0 BHADMO CC(C)(C)CC[N@H+]1CCC2(CCCC2)C1 ZINC000743863695 585141243 /nfs/dbraw/zinc/14/12/43/585141243.db2.gz LVMPHTYLGICWMA-UHFFFAOYSA-N 1 1 209.377 3.689 20 0 BHADMO Cc1ccccc1C[N@H+]1CCC2(CCCC2)C1 ZINC000743863965 585141274 /nfs/dbraw/zinc/14/12/74/585141274.db2.gz FMNHGOKEHNSTMI-UHFFFAOYSA-N 1 1 229.367 3.761 20 0 BHADMO Fc1ccccc1C[N@H+]1CCC2(CCCC2)C1 ZINC000743864060 585141477 /nfs/dbraw/zinc/14/14/77/585141477.db2.gz UBHOBRWUEJQAMC-UHFFFAOYSA-N 1 1 233.330 3.592 20 0 BHADMO Fc1ccc(C[N@H+]2CCC3(CCCC3)C2)cc1 ZINC000743864136 585141294 /nfs/dbraw/zinc/14/12/94/585141294.db2.gz XGFYGPAPLOSYBP-UHFFFAOYSA-N 1 1 233.330 3.592 20 0 BHADMO CC(C)c1cnc(C[N@H+]2CCC3(CCCC3)C2)o1 ZINC000743864440 585141437 /nfs/dbraw/zinc/14/14/37/585141437.db2.gz JUCRNTMEDPEMCR-UHFFFAOYSA-N 1 1 248.370 3.564 20 0 BHADMO c1ccc(CCC[N@H+]2CCC3(CCCC3)C2)cc1 ZINC000743864505 585141357 /nfs/dbraw/zinc/14/13/57/585141357.db2.gz MWTYHCTVUWBNBP-UHFFFAOYSA-N 1 1 243.394 3.885 20 0 BHADMO CCCCCC[N@H+]1CCC2(CCCC2)C1 ZINC000743864530 585141144 /nfs/dbraw/zinc/14/11/44/585141144.db2.gz NUUIPJJMTHHCOF-UHFFFAOYSA-N 1 1 209.377 3.833 20 0 BHADMO Fc1cccc(C[N@H+]2CCC3(CCCC3)C2)c1 ZINC000743864936 585141759 /nfs/dbraw/zinc/14/17/59/585141759.db2.gz VVMVBYAKFCRVDN-UHFFFAOYSA-N 1 1 233.330 3.592 20 0 BHADMO C(C[N@H+]1CCC2(CCCC2)C1)C1CCCC1 ZINC000743864975 585141854 /nfs/dbraw/zinc/14/18/54/585141854.db2.gz YKIZWFYEBDGWTR-UHFFFAOYSA-N 1 1 221.388 3.833 20 0 BHADMO CCCCC[N@@H+](CC)C[C@H](O)c1ccc(C)cc1 ZINC000743866693 585141570 /nfs/dbraw/zinc/14/15/70/585141570.db2.gz KXBZFFUBEULZII-INIZCTEOSA-N 1 1 249.398 3.541 20 0 BHADMO CCCCC[N@@H+](CC)C[C@@H](O)c1ccc(C)cc1 ZINC000743866694 585141591 /nfs/dbraw/zinc/14/15/91/585141591.db2.gz KXBZFFUBEULZII-MRXNPFEDSA-N 1 1 249.398 3.541 20 0 BHADMO CCCCCC[N@H+]1CCS[C@@H](C(C)C)C1 ZINC000743869130 585141820 /nfs/dbraw/zinc/14/18/20/585141820.db2.gz LXAYSZLARXSUKS-CYBMUJFWSA-N 1 1 229.433 3.640 20 0 BHADMO CCCCCC[N@H+]1CCS[C@H](C(C)C)C1 ZINC000743869131 585141628 /nfs/dbraw/zinc/14/16/28/585141628.db2.gz LXAYSZLARXSUKS-ZDUSSCGKSA-N 1 1 229.433 3.640 20 0 BHADMO CCCCCC[N@H+]1CCOC[C@H]1c1ccccc1 ZINC000743871488 585141553 /nfs/dbraw/zinc/14/15/53/585141553.db2.gz FDTBCVNBPAVEFD-INIZCTEOSA-N 1 1 247.382 3.640 20 0 BHADMO CCCCCC[N@H+]1CCOC[C@@H]1c1ccccc1 ZINC000743871489 585141599 /nfs/dbraw/zinc/14/15/99/585141599.db2.gz FDTBCVNBPAVEFD-MRXNPFEDSA-N 1 1 247.382 3.640 20 0 BHADMO CCC[C@]1(C)CCC[N@@H+](C/C=C/Cl)C1 ZINC000743872702 585141786 /nfs/dbraw/zinc/14/17/86/585141786.db2.gz ZTPAEMUUYKBSRR-FZKGZDJFSA-N 1 1 215.768 3.641 20 0 BHADMO CCC[C@@]1(C)CCC[N@@H+](C/C=C\Cl)C1 ZINC000743872703 585140937 /nfs/dbraw/zinc/14/09/37/585140937.db2.gz ZTPAEMUUYKBSRR-JECSTDCCSA-N 1 1 215.768 3.641 20 0 BHADMO CCC[C@]1(C)CCC[N@@H+](C/C=C\Cl)C1 ZINC000743872704 585140598 /nfs/dbraw/zinc/14/05/98/585140598.db2.gz ZTPAEMUUYKBSRR-VVEJJEBESA-N 1 1 215.768 3.641 20 0 BHADMO CCC[C@@]1(C)CCC[N@@H+](C/C=C/Cl)C1 ZINC000743872705 585140723 /nfs/dbraw/zinc/14/07/23/585140723.db2.gz ZTPAEMUUYKBSRR-ZCRIDZFUSA-N 1 1 215.768 3.641 20 0 BHADMO C[C@@H]1CC[N@@H+](C/C=C\Cl)[C@@H](c2ccco2)C1 ZINC000743875286 585141584 /nfs/dbraw/zinc/14/15/84/585141584.db2.gz KSUREXBTVZEVSZ-BCIKPAMSSA-N 1 1 239.746 3.805 20 0 BHADMO C[C@@H]1CC[N@@H+](C/C=C\Cl)[C@H](c2ccco2)C1 ZINC000743875287 585141696 /nfs/dbraw/zinc/14/16/96/585141696.db2.gz KSUREXBTVZEVSZ-FVLQNALFSA-N 1 1 239.746 3.805 20 0 BHADMO C[C@@H]1CC[N@@H+](C/C=C/Cl)[C@@H](c2ccco2)C1 ZINC000743875288 585141679 /nfs/dbraw/zinc/14/16/79/585141679.db2.gz KSUREXBTVZEVSZ-JKNNBXRXSA-N 1 1 239.746 3.805 20 0 BHADMO C[C@@H]1CC[N@@H+](C/C=C/Cl)[C@H](c2ccco2)C1 ZINC000743875289 585141643 /nfs/dbraw/zinc/14/16/43/585141643.db2.gz KSUREXBTVZEVSZ-ZBWCZXCSSA-N 1 1 239.746 3.805 20 0 BHADMO CC[N@@H+](CCc1ccccn1)CCC(C)(C)CC ZINC000744389317 585150061 /nfs/dbraw/zinc/15/00/61/585150061.db2.gz DMPOXICRFKBIQX-UHFFFAOYSA-N 1 1 248.414 3.772 20 0 BHADMO Cc1ccc(CC[N@H+]2CCC3(CCCC3)C2)cc1 ZINC000744419775 585150482 /nfs/dbraw/zinc/15/04/82/585150482.db2.gz AMMSIXIAUUEYJQ-UHFFFAOYSA-N 1 1 243.394 3.804 20 0 BHADMO CC(C)C[C@H]1CC[N@@H+](CCc2cccs2)C1 ZINC000745947258 585161740 /nfs/dbraw/zinc/16/17/40/585161740.db2.gz XOFWFPNMYPZJDB-CYBMUJFWSA-N 1 1 237.412 3.659 20 0 BHADMO CC(C)C[C@@H]1CC[N@@H+](CCc2cccs2)C1 ZINC000745947259 585161519 /nfs/dbraw/zinc/16/15/19/585161519.db2.gz XOFWFPNMYPZJDB-ZDUSSCGKSA-N 1 1 237.412 3.659 20 0 BHADMO CCC[N@@H+](CC)Cc1cc(Cl)nc(Cl)c1 ZINC000746107488 585163037 /nfs/dbraw/zinc/16/30/37/585163037.db2.gz IRWSYVOMHFNKHV-UHFFFAOYSA-N 1 1 247.169 3.620 20 0 BHADMO CC(C)=CC[N@@H+](CCc1ccccc1)C1CC1 ZINC000746119526 585163382 /nfs/dbraw/zinc/16/33/82/585163382.db2.gz YLYBQQOWKNFPBG-UHFFFAOYSA-N 1 1 229.367 3.660 20 0 BHADMO CCC[N@@H+](Cc1cccc(F)c1)C1CCCC1 ZINC000746143014 585163806 /nfs/dbraw/zinc/16/38/06/585163806.db2.gz IZTOQRIHOUWCJF-UHFFFAOYSA-N 1 1 235.346 3.980 20 0 BHADMO CC(C)C[N@@H+](CCc1cccs1)C(C)C ZINC000746167226 585164430 /nfs/dbraw/zinc/16/44/30/585164430.db2.gz CJCSYOZNNVDBGR-UHFFFAOYSA-N 1 1 225.401 3.657 20 0 BHADMO c1csc(CC[N@H+]2CC[C@H]2c2ccccc2)c1 ZINC000746456630 585168494 /nfs/dbraw/zinc/16/84/94/585168494.db2.gz BTYAPRLIMFHPNS-HNNXBMFYSA-N 1 1 243.375 3.738 20 0 BHADMO c1csc(CC[N@H+]2CC[C@@H]2c2ccccc2)c1 ZINC000746456637 585168469 /nfs/dbraw/zinc/16/84/69/585168469.db2.gz BTYAPRLIMFHPNS-OAHLLOKOSA-N 1 1 243.375 3.738 20 0 BHADMO Cc1ccc(C[N@H+](C)C2CCCCCCC2)nc1 ZINC000746469368 585168509 /nfs/dbraw/zinc/16/85/09/585168509.db2.gz LHCDGFYIHYPVQC-UHFFFAOYSA-N 1 1 246.398 3.935 20 0 BHADMO Cc1ccncc1C[N@H+](C)C1CCCCCCC1 ZINC000746469848 585168332 /nfs/dbraw/zinc/16/83/32/585168332.db2.gz OCZSGMGDBQDCPZ-UHFFFAOYSA-N 1 1 246.398 3.935 20 0 BHADMO CC(C)CC[N@@H+](C/C(Cl)=C\Cl)C1CC1 ZINC000746499177 585168780 /nfs/dbraw/zinc/16/87/80/585168780.db2.gz GWFFWSNTFMAWHD-JXMROGBWSA-N 1 1 236.186 3.816 20 0 BHADMO CC(C)CC[N@H+](C/C(Cl)=C\Cl)C1CC1 ZINC000746499177 585168779 /nfs/dbraw/zinc/16/87/79/585168779.db2.gz GWFFWSNTFMAWHD-JXMROGBWSA-N 1 1 236.186 3.816 20 0 BHADMO CC(C)CC[N@@H+](C/C(Cl)=C/Cl)C1CC1 ZINC000746499183 585168842 /nfs/dbraw/zinc/16/88/42/585168842.db2.gz GWFFWSNTFMAWHD-YFHOEESVSA-N 1 1 236.186 3.816 20 0 BHADMO CC(C)CC[N@H+](C/C(Cl)=C/Cl)C1CC1 ZINC000746499183 585168841 /nfs/dbraw/zinc/16/88/41/585168841.db2.gz GWFFWSNTFMAWHD-YFHOEESVSA-N 1 1 236.186 3.816 20 0 BHADMO C[N@@H+](C/C(Cl)=C\Cl)C1CCCCCC1 ZINC000746499608 585168770 /nfs/dbraw/zinc/16/87/70/585168770.db2.gz MBZFDYIWFFDIQQ-CSKARUKUSA-N 1 1 236.186 3.960 20 0 BHADMO C[N@@H+](C/C(Cl)=C/Cl)C1CCCCCC1 ZINC000746499609 585168800 /nfs/dbraw/zinc/16/88/00/585168800.db2.gz MBZFDYIWFFDIQQ-NTMALXAHSA-N 1 1 236.186 3.960 20 0 BHADMO FCC[N@H+]1CCCC[C@H]1c1cc2ccccc2[nH]1 ZINC000746502497 585169099 /nfs/dbraw/zinc/16/90/99/585169099.db2.gz QVUIOEMULCPIRD-HNNXBMFYSA-N 1 1 246.329 3.664 20 0 BHADMO FCC[N@@H+]1CCCC[C@H]1c1cc2ccccc2[nH]1 ZINC000746502497 585169098 /nfs/dbraw/zinc/16/90/98/585169098.db2.gz QVUIOEMULCPIRD-HNNXBMFYSA-N 1 1 246.329 3.664 20 0 BHADMO FCC[N@H+]1CCCC[C@@H]1c1cc2ccccc2[nH]1 ZINC000746502498 585169309 /nfs/dbraw/zinc/16/93/09/585169309.db2.gz QVUIOEMULCPIRD-OAHLLOKOSA-N 1 1 246.329 3.664 20 0 BHADMO FCC[N@@H+]1CCCC[C@@H]1c1cc2ccccc2[nH]1 ZINC000746502498 585169308 /nfs/dbraw/zinc/16/93/08/585169308.db2.gz QVUIOEMULCPIRD-OAHLLOKOSA-N 1 1 246.329 3.664 20 0 BHADMO FCC[N@@H+](Cc1ccccc1)C1CCCCC1 ZINC000746502719 585169095 /nfs/dbraw/zinc/16/90/95/585169095.db2.gz MINWVDGTWNDHFV-UHFFFAOYSA-N 1 1 235.346 3.791 20 0 BHADMO C[N@@H+](CCF)Cc1ccccc1-c1ccccc1 ZINC000746503349 585169228 /nfs/dbraw/zinc/16/92/28/585169228.db2.gz ZHZLYKBJQUSONZ-UHFFFAOYSA-N 1 1 243.325 3.755 20 0 BHADMO c1ccc(CC[N@@H+](CC2CCCC2)C2CC2)cc1 ZINC000746650999 585171551 /nfs/dbraw/zinc/17/15/51/585171551.db2.gz GZDYWNBLXIRMRH-UHFFFAOYSA-N 1 1 243.394 3.884 20 0 BHADMO Cc1ccccc1C[N@@H+](C/C=C/Cl)C1CC1 ZINC000746651191 585171399 /nfs/dbraw/zinc/17/13/99/585171399.db2.gz PKBOGBNWDYCYAB-RUDMXATFSA-N 1 1 235.758 3.712 20 0 BHADMO Cc1ccccc1C[N@@H+](C/C=C\Cl)C1CC1 ZINC000746651195 585171586 /nfs/dbraw/zinc/17/15/86/585171586.db2.gz PKBOGBNWDYCYAB-WTKPLQERSA-N 1 1 235.758 3.712 20 0 BHADMO CC[N@@H+](C/C=C\Cl)Cc1ccc(Cl)cc1 ZINC000746651770 585171701 /nfs/dbraw/zinc/17/17/01/585171701.db2.gz KLOYGMJFLFRZRC-BAQGIRSFSA-N 1 1 244.165 3.914 20 0 BHADMO CC[N@@H+](C/C=C/Cl)Cc1ccc(Cl)cc1 ZINC000746651771 585171663 /nfs/dbraw/zinc/17/16/63/585171663.db2.gz KLOYGMJFLFRZRC-FPYGCLRLSA-N 1 1 244.165 3.914 20 0 BHADMO CCC[N@@H+](C/C=C/Cl)Cc1ccccc1F ZINC000746651779 585171440 /nfs/dbraw/zinc/17/14/40/585171440.db2.gz KTMOBDKKVYRCMB-VMPITWQZSA-N 1 1 241.737 3.790 20 0 BHADMO CCC[N@H+](C/C=C/Cl)Cc1ccccc1F ZINC000746651779 585171439 /nfs/dbraw/zinc/17/14/39/585171439.db2.gz KTMOBDKKVYRCMB-VMPITWQZSA-N 1 1 241.737 3.790 20 0 BHADMO CCC[N@@H+](C/C=C\Cl)Cc1ccccc1F ZINC000746651780 585171445 /nfs/dbraw/zinc/17/14/45/585171445.db2.gz KTMOBDKKVYRCMB-YVMONPNESA-N 1 1 241.737 3.790 20 0 BHADMO CCC[N@H+](C/C=C\Cl)Cc1ccccc1F ZINC000746651780 585171444 /nfs/dbraw/zinc/17/14/44/585171444.db2.gz KTMOBDKKVYRCMB-YVMONPNESA-N 1 1 241.737 3.790 20 0 BHADMO CC(C)[N@@H+](C/C=C/Cl)Cc1ccccc1F ZINC000746651795 585171575 /nfs/dbraw/zinc/17/15/75/585171575.db2.gz LQPQIJJGVOPSHY-VMPITWQZSA-N 1 1 241.737 3.789 20 0 BHADMO CC(C)[N@H+](C/C=C/Cl)Cc1ccccc1F ZINC000746651795 585171574 /nfs/dbraw/zinc/17/15/74/585171574.db2.gz LQPQIJJGVOPSHY-VMPITWQZSA-N 1 1 241.737 3.789 20 0 BHADMO CC(C)[N@@H+](C/C=C\Cl)Cc1ccccc1F ZINC000746651796 585171412 /nfs/dbraw/zinc/17/14/12/585171412.db2.gz LQPQIJJGVOPSHY-YVMONPNESA-N 1 1 241.737 3.789 20 0 BHADMO CC(C)[N@H+](C/C=C\Cl)Cc1ccccc1F ZINC000746651796 585171411 /nfs/dbraw/zinc/17/14/11/585171411.db2.gz LQPQIJJGVOPSHY-YVMONPNESA-N 1 1 241.737 3.789 20 0 BHADMO CC[N@@H+](C/C=C/Cl)Cc1ccc(C)cc1 ZINC000746653307 585171698 /nfs/dbraw/zinc/17/16/98/585171698.db2.gz SQQOEFNBWXKGIX-RUDMXATFSA-N 1 1 223.747 3.569 20 0 BHADMO CC[N@@H+](C/C=C\Cl)Cc1ccc(C)cc1 ZINC000746653329 585171519 /nfs/dbraw/zinc/17/15/19/585171519.db2.gz SQQOEFNBWXKGIX-WTKPLQERSA-N 1 1 223.747 3.569 20 0 BHADMO CC(C)[N@@H+](C/C=C\Cl)Cc1ccc(F)cc1 ZINC000746653357 585171492 /nfs/dbraw/zinc/17/14/92/585171492.db2.gz TVTIITOQAGHWDE-BAQGIRSFSA-N 1 1 241.737 3.789 20 0 BHADMO CC(C)[N@@H+](C/C=C/Cl)Cc1ccc(F)cc1 ZINC000746653359 585171629 /nfs/dbraw/zinc/17/16/29/585171629.db2.gz TVTIITOQAGHWDE-FPYGCLRLSA-N 1 1 241.737 3.789 20 0 BHADMO CCC[N@@H+](C/C=C\Cl)Cc1ccc(F)cc1 ZINC000746654342 585171667 /nfs/dbraw/zinc/17/16/67/585171667.db2.gz ZXHRYQCEDPSLPC-BAQGIRSFSA-N 1 1 241.737 3.790 20 0 BHADMO CCC[N@@H+](C/C=C/Cl)Cc1ccc(F)cc1 ZINC000746654343 585171625 /nfs/dbraw/zinc/17/16/25/585171625.db2.gz ZXHRYQCEDPSLPC-FPYGCLRLSA-N 1 1 241.737 3.790 20 0 BHADMO CCC[N@@H+](CC(C)C)C[C@@H]1CC1(Cl)Cl ZINC000746654348 585171425 /nfs/dbraw/zinc/17/14/25/585171425.db2.gz ZYJSEQSEZYOWMC-JTQLQIEISA-N 1 1 238.202 3.548 20 0 BHADMO CCC[N@@H+](CC(C)C)C[C@H]1CC1(Cl)Cl ZINC000746654349 585171397 /nfs/dbraw/zinc/17/13/97/585171397.db2.gz ZYJSEQSEZYOWMC-SNVBAGLBSA-N 1 1 238.202 3.548 20 0 BHADMO CC(C)C[N@@H+](C/C=C/Cl)Cc1ccccc1 ZINC000746656821 585171833 /nfs/dbraw/zinc/17/18/33/585171833.db2.gz ANOFZHIEPPZKGW-RMKNXTFCSA-N 1 1 237.774 3.897 20 0 BHADMO CC(C)C[N@@H+](C/C=C\Cl)Cc1ccccc1 ZINC000746656830 585171731 /nfs/dbraw/zinc/17/17/31/585171731.db2.gz ANOFZHIEPPZKGW-TWGQIWQCSA-N 1 1 237.774 3.897 20 0 BHADMO CC(C)C[N@@H+](C/C=C/Cl)C1CCCC1 ZINC000746656907 585171950 /nfs/dbraw/zinc/17/19/50/585171950.db2.gz BGAGBZAYWYTGCG-VMPITWQZSA-N 1 1 215.768 3.640 20 0 BHADMO CC(C)C[N@@H+](C/C=C\Cl)C1CCCC1 ZINC000746656911 585171815 /nfs/dbraw/zinc/17/18/15/585171815.db2.gz BGAGBZAYWYTGCG-YVMONPNESA-N 1 1 215.768 3.640 20 0 BHADMO C[C@@H]1c2ccccc2C[N@@H+]1CCc1cccs1 ZINC000746668891 585171878 /nfs/dbraw/zinc/17/18/78/585171878.db2.gz BRJBUHKIZPPYJA-GFCCVEGCSA-N 1 1 243.375 3.867 20 0 BHADMO C[C@H]1c2ccccc2C[N@@H+]1CCc1cccs1 ZINC000746668897 585172142 /nfs/dbraw/zinc/17/21/42/585172142.db2.gz BRJBUHKIZPPYJA-LBPRGKRZSA-N 1 1 243.375 3.867 20 0 BHADMO C[C@H]1c2ccccc2C[N@@H+]1CCCCCCCO ZINC000746671077 585171783 /nfs/dbraw/zinc/17/17/83/585171783.db2.gz KNAVAEOJNMIVCZ-AWEZNQCLSA-N 1 1 247.382 3.506 20 0 BHADMO C[C@@H]1c2ccccc2C[N@@H+]1CCCCCCCO ZINC000746671081 585171830 /nfs/dbraw/zinc/17/18/30/585171830.db2.gz KNAVAEOJNMIVCZ-CQSZACIVSA-N 1 1 247.382 3.506 20 0 BHADMO C[N@@H+](Cc1cccc(O)c1)C1CCCCCCC1 ZINC000746710978 585172250 /nfs/dbraw/zinc/17/22/50/585172250.db2.gz QJENSNYDIUNIHR-UHFFFAOYSA-N 1 1 247.382 3.937 20 0 BHADMO CC(C)(C)C[C@H]1CCC[N@H+]1C/C=C\Cl ZINC000747112989 585175232 /nfs/dbraw/zinc/17/52/32/585175232.db2.gz PEVVAVHSJUPMTE-JPVGGKMYSA-N 1 1 215.768 3.640 20 0 BHADMO CC(C)(C)C[C@@H]1CCC[N@H+]1C/C=C\Cl ZINC000747112990 585175026 /nfs/dbraw/zinc/17/50/26/585175026.db2.gz PEVVAVHSJUPMTE-XOIDGJRKSA-N 1 1 215.768 3.640 20 0 BHADMO CC(C)(C)C[C@@H]1CCC[N@H+]1C/C=C/Cl ZINC000747112991 585175087 /nfs/dbraw/zinc/17/50/87/585175087.db2.gz PEVVAVHSJUPMTE-ZRQQLDRUSA-N 1 1 215.768 3.640 20 0 BHADMO C[C@@H]1C[N@@H+](Cc2cccs2)Cc2ccccc21 ZINC000747352409 585178340 /nfs/dbraw/zinc/17/83/40/585178340.db2.gz BVEAHBCDRWEASA-GFCCVEGCSA-N 1 1 243.375 3.867 20 0 BHADMO C[C@H]1C[N@@H+](Cc2cccs2)Cc2ccccc21 ZINC000747352411 585178287 /nfs/dbraw/zinc/17/82/87/585178287.db2.gz BVEAHBCDRWEASA-LBPRGKRZSA-N 1 1 243.375 3.867 20 0 BHADMO C[C@@H]1[C@@H](Cc2ccccc2)CC[N@H+]1C/C=C/Cl ZINC000747532496 585180219 /nfs/dbraw/zinc/18/02/19/585180219.db2.gz YVKYFDRTOPIHLV-IVZDOJFNSA-N 1 1 249.785 3.692 20 0 BHADMO C[C@@H]1[C@H](Cc2ccccc2)CC[N@H+]1C/C=C/Cl ZINC000747532497 585180352 /nfs/dbraw/zinc/18/03/52/585180352.db2.gz YVKYFDRTOPIHLV-JHTAHENJSA-N 1 1 249.785 3.692 20 0 BHADMO C[C@@H]1[C@H](Cc2ccccc2)CC[N@H+]1C/C=C\Cl ZINC000747532498 585180557 /nfs/dbraw/zinc/18/05/57/585180557.db2.gz YVKYFDRTOPIHLV-JSHITJIMSA-N 1 1 249.785 3.692 20 0 BHADMO C[C@@H]1[C@@H](Cc2ccccc2)CC[N@H+]1C/C=C\Cl ZINC000747532500 585180375 /nfs/dbraw/zinc/18/03/75/585180375.db2.gz YVKYFDRTOPIHLV-UDDXRPRYSA-N 1 1 249.785 3.692 20 0 BHADMO Cc1ccc(NC/C=C\c2ccc(F)cc2)[nH+]c1 ZINC000747917542 585185957 /nfs/dbraw/zinc/18/59/57/585185957.db2.gz ZHRWIPJGQRMSGN-IHWYPQMZSA-N 1 1 242.297 3.654 20 0 BHADMO C[N@@H+](CCOC(C)(C)C)C1CCCCCCC1 ZINC000748803115 585196592 /nfs/dbraw/zinc/19/65/92/585196592.db2.gz PTBMYSRLQQPXFO-UHFFFAOYSA-N 1 1 241.419 3.846 20 0 BHADMO C[N@@H+](CCc1ccncc1)C1CCCCCCC1 ZINC000748804784 585196688 /nfs/dbraw/zinc/19/66/88/585196688.db2.gz ATBVRNLJPGGPHC-UHFFFAOYSA-N 1 1 246.398 3.669 20 0 BHADMO CC(C)=CC[N@H+](C)C1CCCCCCC1 ZINC000748804827 585196813 /nfs/dbraw/zinc/19/68/13/585196813.db2.gz CMTXGTRZZGMQNX-UHFFFAOYSA-N 1 1 209.377 3.997 20 0 BHADMO C[N@@H+](C[C@@H]1CCCCO1)C1CCCCCCC1 ZINC000748805633 585196472 /nfs/dbraw/zinc/19/64/72/585196472.db2.gz NKKJNTQRUQAAFQ-HNNXBMFYSA-N 1 1 239.403 3.600 20 0 BHADMO C[N@@H+](C[C@H]1CCCCO1)C1CCCCCCC1 ZINC000748805634 585196585 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BHADMO CCC[C@H]1CCCC[N@H+]1Cc1coc(C2CC2)n1 ZINC000757996016 585348079 /nfs/dbraw/zinc/34/80/79/585348079.db2.gz QXELGEQGCNITIL-AWEZNQCLSA-N 1 1 248.370 3.707 20 0 BHADMO CCC[C@@H]1CCCC[N@H+]1Cc1coc(C2CC2)n1 ZINC000757996017 585348091 /nfs/dbraw/zinc/34/80/91/585348091.db2.gz QXELGEQGCNITIL-CQSZACIVSA-N 1 1 248.370 3.707 20 0 BHADMO Cc1ccc[nH+]c1NCc1cncc2ccccc21 ZINC000759079950 585364179 /nfs/dbraw/zinc/36/41/79/585364179.db2.gz OKQWYCSLZZFOEV-UHFFFAOYSA-N 1 1 249.317 3.550 20 0 BHADMO CC1(C)C[N@@H+](C/C=C/Cl)Cc2ccccc21 ZINC000759307373 585366852 /nfs/dbraw/zinc/36/68/52/585366852.db2.gz BGXSTFWLELBDJA-VMPITWQZSA-N 1 1 235.758 3.532 20 0 BHADMO CC1(C)C[N@@H+](C/C=C\Cl)Cc2ccccc21 ZINC000759307377 585366802 /nfs/dbraw/zinc/36/68/02/585366802.db2.gz BGXSTFWLELBDJA-YVMONPNESA-N 1 1 235.758 3.532 20 0 BHADMO CCCCC[N@@H+](CCF)Cc1ccc(F)cc1 ZINC000759326814 585367570 /nfs/dbraw/zinc/36/75/70/585367570.db2.gz HNFTWWQEOKJACG-UHFFFAOYSA-N 1 1 241.325 3.787 20 0 BHADMO 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ZINC000759329308 585367522 /nfs/dbraw/zinc/36/75/22/585367522.db2.gz XKDTXQXRVJVTFZ-UHFFFAOYSA-N 1 1 229.726 3.520 20 0 BHADMO CCC[N@@H+](CCF)[C@@H](CC)c1ccccc1 ZINC000759330007 584906556 /nfs/dbraw/zinc/90/65/56/584906556.db2.gz AAAVETNUESHMPW-AWEZNQCLSA-N 1 1 223.335 3.819 20 0 BHADMO CCC[N@@H+](CCF)[C@H](CC)c1ccccc1 ZINC000759330015 584906571 /nfs/dbraw/zinc/90/65/71/584906571.db2.gz AAAVETNUESHMPW-CQSZACIVSA-N 1 1 223.335 3.819 20 0 BHADMO FCC[N@@H+](Cc1ccc2ccccc2c1)C1CC1 ZINC000759330094 585367996 /nfs/dbraw/zinc/36/79/96/585367996.db2.gz CJXDZVHJILLBRK-UHFFFAOYSA-N 1 1 243.325 3.774 20 0 BHADMO FCC[N@H+]1CCC[C@H]1c1cccc2ccccc21 ZINC000759330103 585367821 /nfs/dbraw/zinc/36/78/21/585367821.db2.gz CVPXLPLEXKUWHV-INIZCTEOSA-N 1 1 243.325 3.946 20 0 BHADMO FCC[N@H+]1CCC[C@@H]1c1cccc2ccccc21 ZINC000759330104 585368119 /nfs/dbraw/zinc/36/81/19/585368119.db2.gz CVPXLPLEXKUWHV-MRXNPFEDSA-N 1 1 243.325 3.946 20 0 BHADMO C[C@H](c1ccc(C(F)(F)F)cc1)[N@@H+](C)CCF ZINC000759330201 585367900 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ZINC000761080999 585406586 /nfs/dbraw/zinc/40/65/86/585406586.db2.gz FCANVWCMKJTVQP-JLZZUVOBSA-N 1 1 237.346 3.995 20 0 BHADMO C[C@H](c1ccc2ccccc2c1)[N@H+]1CC[C@H]2C[C@H]21 ZINC000761081001 585406734 /nfs/dbraw/zinc/40/67/34/585406734.db2.gz FCANVWCMKJTVQP-OAUYIBNBSA-N 1 1 237.346 3.995 20 0 BHADMO c1ccc2c(c1)-c1ccccc1C2[N@H+]1CC[C@@H]2C[C@@H]21 ZINC000761085060 585407400 /nfs/dbraw/zinc/40/74/00/585407400.db2.gz AFOOYVFCCCZNED-PXAZEXFGSA-N 1 1 247.341 3.851 20 0 BHADMO c1ccc2c(c1)-c1ccccc1C2[N@H+]1CC[C@H]2C[C@H]21 ZINC000761085065 585407459 /nfs/dbraw/zinc/40/74/59/585407459.db2.gz AFOOYVFCCCZNED-YVEFUNNKSA-N 1 1 247.341 3.851 20 0 BHADMO c1ccc(-c2ccc(C[N@H+]3CC[C@@H]4C[C@@H]43)cc2)cc1 ZINC000761088071 585407723 /nfs/dbraw/zinc/40/77/23/585407723.db2.gz QAUNDGWJODYXGK-MSOLQXFVSA-N 1 1 249.357 3.948 20 0 BHADMO c1ccc(-c2ccc(C[N@H+]3CC[C@H]4C[C@H]43)cc2)cc1 ZINC000761088074 585407707 /nfs/dbraw/zinc/40/77/07/585407707.db2.gz QAUNDGWJODYXGK-ZWKOTPCHSA-N 1 1 249.357 3.948 20 0 BHADMO Clc1cccc(Cl)c1C[N@H+]1CC[C@@H]2C[C@@H]21 ZINC000761088540 585407823 /nfs/dbraw/zinc/40/78/23/585407823.db2.gz GQMHJKHJIVPUTQ-PELKAZGASA-N 1 1 242.149 3.588 20 0 BHADMO Clc1cccc(Cl)c1C[N@@H+]1CC[C@@H]2C[C@@H]21 ZINC000761088540 585407822 /nfs/dbraw/zinc/40/78/22/585407822.db2.gz GQMHJKHJIVPUTQ-PELKAZGASA-N 1 1 242.149 3.588 20 0 BHADMO Clc1cccc(Cl)c1C[N@H+]1CC[C@H]2C[C@H]21 ZINC000761088551 585407606 /nfs/dbraw/zinc/40/76/06/585407606.db2.gz GQMHJKHJIVPUTQ-QPUJVOFHSA-N 1 1 242.149 3.588 20 0 BHADMO Clc1cccc(Cl)c1C[N@@H+]1CC[C@H]2C[C@H]21 ZINC000761088551 585407605 /nfs/dbraw/zinc/40/76/05/585407605.db2.gz GQMHJKHJIVPUTQ-QPUJVOFHSA-N 1 1 242.149 3.588 20 0 BHADMO C[C@H](c1ccc(F)c(Cl)c1)[N@H+]1CC[C@H]2C[C@H]21 ZINC000761089777 585407947 /nfs/dbraw/zinc/40/79/47/585407947.db2.gz GPZBRONRWFKBOA-DFAYQTQMSA-N 1 1 239.721 3.634 20 0 BHADMO C[C@H](c1ccc(F)c(Cl)c1)[N@H+]1CC[C@@H]2C[C@@H]21 ZINC000761089783 585408007 /nfs/dbraw/zinc/40/80/07/585408007.db2.gz GPZBRONRWFKBOA-JQEORGNBSA-N 1 1 239.721 3.634 20 0 BHADMO CC[C@H](c1ccc(Cl)cc1)[N@H+]1CC[C@@H]2C[C@@H]21 ZINC000761090172 585408074 /nfs/dbraw/zinc/40/80/74/585408074.db2.gz JPVYSERDJOYVFU-BNOWGMLFSA-N 1 1 235.758 3.885 20 0 BHADMO CC[C@H](c1ccc(Cl)cc1)[N@H+]1CC[C@H]2C[C@H]21 ZINC000761090177 585407958 /nfs/dbraw/zinc/40/79/58/585407958.db2.gz JPVYSERDJOYVFU-IACUBPJLSA-N 1 1 235.758 3.885 20 0 BHADMO Clc1ccc(C[N@H+]2CC[C@@H]3C[C@@H]32)c(Cl)c1 ZINC000761090236 585407866 /nfs/dbraw/zinc/40/78/66/585407866.db2.gz TVUNJVRMEKCTNF-PELKAZGASA-N 1 1 242.149 3.588 20 0 BHADMO Clc1ccc(C[N@@H+]2CC[C@@H]3C[C@@H]32)c(Cl)c1 ZINC000761090236 585407865 /nfs/dbraw/zinc/40/78/65/585407865.db2.gz TVUNJVRMEKCTNF-PELKAZGASA-N 1 1 242.149 3.588 20 0 BHADMO Clc1ccc(C[N@H+]2CC[C@H]3C[C@H]32)c(Cl)c1 ZINC000761090240 585407884 /nfs/dbraw/zinc/40/78/84/585407884.db2.gz TVUNJVRMEKCTNF-QPUJVOFHSA-N 1 1 242.149 3.588 20 0 BHADMO Clc1ccc(C[N@@H+]2CC[C@H]3C[C@H]32)c(Cl)c1 ZINC000761090240 585407883 /nfs/dbraw/zinc/40/78/83/585407883.db2.gz TVUNJVRMEKCTNF-QPUJVOFHSA-N 1 1 242.149 3.588 20 0 BHADMO CC(C)(C)c1ccc(C[N@H+]2CC[C@H]3C[C@H]32)cc1 ZINC000761090366 585408026 /nfs/dbraw/zinc/40/80/26/585408026.db2.gz JXWUATWZYQDTQH-DZGCQCFKSA-N 1 1 229.367 3.578 20 0 BHADMO CC(C)(C)c1ccc(C[N@H+]2CC[C@@H]3C[C@@H]32)cc1 ZINC000761090371 585407982 /nfs/dbraw/zinc/40/79/82/585407982.db2.gz JXWUATWZYQDTQH-HIFRSBDPSA-N 1 1 229.367 3.578 20 0 BHADMO Clc1ccc(Cl)c(C[N@H+]2CC[C@@H]3C[C@@H]32)c1 ZINC000761090424 585407976 /nfs/dbraw/zinc/40/79/76/585407976.db2.gz KEGOENIRYRVYFN-PELKAZGASA-N 1 1 242.149 3.588 20 0 BHADMO Clc1ccc(Cl)c(C[N@@H+]2CC[C@@H]3C[C@@H]32)c1 ZINC000761090424 585407975 /nfs/dbraw/zinc/40/79/75/585407975.db2.gz KEGOENIRYRVYFN-PELKAZGASA-N 1 1 242.149 3.588 20 0 BHADMO Clc1ccc(Cl)c(C[N@H+]2CC[C@H]3C[C@H]32)c1 ZINC000761090437 585408114 /nfs/dbraw/zinc/40/81/14/585408114.db2.gz KEGOENIRYRVYFN-QPUJVOFHSA-N 1 1 242.149 3.588 20 0 BHADMO Clc1ccc(Cl)c(C[N@@H+]2CC[C@H]3C[C@H]32)c1 ZINC000761090437 585408113 /nfs/dbraw/zinc/40/81/13/585408113.db2.gz KEGOENIRYRVYFN-QPUJVOFHSA-N 1 1 242.149 3.588 20 0 BHADMO C[C@H](c1cccc2ccccc21)[N@H+]1CC[C@H]2C[C@H]21 ZINC000761090940 585407868 /nfs/dbraw/zinc/40/78/68/585407868.db2.gz JERCXYCHRUPMKR-HACGYAERSA-N 1 1 237.346 3.995 20 0 BHADMO C[C@H](c1cccc2ccccc21)[N@H+]1CC[C@@H]2C[C@@H]21 ZINC000761090948 585407980 /nfs/dbraw/zinc/40/79/80/585407980.db2.gz JERCXYCHRUPMKR-MRRJBJDNSA-N 1 1 237.346 3.995 20 0 BHADMO Clc1ccc(C[N@H+]2CC[C@H]3C[C@H]32)cc1Cl ZINC000761091981 585408344 /nfs/dbraw/zinc/40/83/44/585408344.db2.gz KOGIHZVXBLVWRZ-JOYOIKCWSA-N 1 1 242.149 3.588 20 0 BHADMO Clc1ccc(C[N@@H+]2CC[C@H]3C[C@H]32)cc1Cl ZINC000761091981 585408343 /nfs/dbraw/zinc/40/83/43/585408343.db2.gz KOGIHZVXBLVWRZ-JOYOIKCWSA-N 1 1 242.149 3.588 20 0 BHADMO Clc1ccc(C[N@H+]2CC[C@@H]3C[C@@H]32)cc1Cl ZINC000761091985 585408314 /nfs/dbraw/zinc/40/83/14/585408314.db2.gz KOGIHZVXBLVWRZ-SKDRFNHKSA-N 1 1 242.149 3.588 20 0 BHADMO Clc1ccc(C[N@@H+]2CC[C@@H]3C[C@@H]32)cc1Cl ZINC000761091985 585408313 /nfs/dbraw/zinc/40/83/13/585408313.db2.gz KOGIHZVXBLVWRZ-SKDRFNHKSA-N 1 1 242.149 3.588 20 0 BHADMO C[C@H](CCSc1ccccc1)[N@H+]1CC[C@@H]2C[C@@H]21 ZINC000761094033 585408687 /nfs/dbraw/zinc/40/86/87/585408687.db2.gz MYARILBVCPLHBI-NFAWXSAZSA-N 1 1 247.407 3.652 20 0 BHADMO C[C@H](CCSc1ccccc1)[N@H+]1CC[C@H]2C[C@H]21 ZINC000761094035 585408538 /nfs/dbraw/zinc/40/85/38/585408538.db2.gz MYARILBVCPLHBI-VNHYZAJKSA-N 1 1 247.407 3.652 20 0 BHADMO CC[C@H](c1ccc(F)cc1F)[N@H+]1CC[C@H]2C[C@H]21 ZINC000761094144 585408439 /nfs/dbraw/zinc/40/84/39/585408439.db2.gz NGGLAVMSPWLEKI-CUOATXAZSA-N 1 1 237.293 3.510 20 0 BHADMO CC[C@H](c1ccc(F)cc1F)[N@H+]1CC[C@@H]2C[C@@H]21 ZINC000761094149 585408597 /nfs/dbraw/zinc/40/85/97/585408597.db2.gz NGGLAVMSPWLEKI-FZQKWOKYSA-N 1 1 237.293 3.510 20 0 BHADMO Cc1ccc2ccccc2c1C[N@H+]1CC[C@@H]2C[C@@H]21 ZINC000761100155 585409010 /nfs/dbraw/zinc/40/90/10/585409010.db2.gz YKAXCFACQAVLBO-PBHICJAKSA-N 1 1 237.346 3.742 20 0 BHADMO Cc1ccc2ccccc2c1C[N@H+]1CC[C@H]2C[C@H]21 ZINC000761100164 585409026 /nfs/dbraw/zinc/40/90/26/585409026.db2.gz YKAXCFACQAVLBO-WMLDXEAASA-N 1 1 237.346 3.742 20 0 BHADMO CCCCCC[N@H+]1CCc2ccsc2C1 ZINC000761124480 585410856 /nfs/dbraw/zinc/41/08/56/585410856.db2.gz RFZZKYQLSPCWBK-UHFFFAOYSA-N 1 1 223.385 3.687 20 0 BHADMO CC[N@@H+](CCC1CC1)Cc1cc(C)oc1C ZINC000761225803 585412328 /nfs/dbraw/zinc/41/23/28/585412328.db2.gz IOWNFOFZEHMHRG-UHFFFAOYSA-N 1 1 221.344 3.518 20 0 BHADMO FC(F)(F)[C@@H]1CC[N@@H+](CC2CCCCCC2)C1 ZINC000762621174 585434666 /nfs/dbraw/zinc/43/46/66/585434666.db2.gz FISOHXIJYXWBCJ-GFCCVEGCSA-N 1 1 249.320 3.841 20 0 BHADMO FC(F)(F)[C@H]1CC[N@@H+](CC2CCCCCC2)C1 ZINC000762621175 585434679 /nfs/dbraw/zinc/43/46/79/585434679.db2.gz FISOHXIJYXWBCJ-LBPRGKRZSA-N 1 1 249.320 3.841 20 0 BHADMO Cl/C=C\C[N@H+]1CCCC[C@H]1c1ccccc1 ZINC000762634454 585434509 /nfs/dbraw/zinc/43/45/09/585434509.db2.gz PJHOHMDUXHCUPX-APFBBLRHSA-N 1 1 235.758 3.966 20 0 BHADMO Cl/C=C\C[N@H+]1CCCC[C@@H]1c1ccccc1 ZINC000762634483 585434694 /nfs/dbraw/zinc/43/46/94/585434694.db2.gz PJHOHMDUXHCUPX-LBIZBFCRSA-N 1 1 235.758 3.966 20 0 BHADMO Cl/C=C/C[N@H+]1CCCC[C@@H]1c1ccccc1 ZINC000762634486 585434602 /nfs/dbraw/zinc/43/46/02/585434602.db2.gz PJHOHMDUXHCUPX-OAUONFCTSA-N 1 1 235.758 3.966 20 0 BHADMO Cl/C=C/C[N@H+]1CCCC[C@H]1c1ccccc1 ZINC000762634489 585434599 /nfs/dbraw/zinc/43/45/99/585434599.db2.gz PJHOHMDUXHCUPX-XYYIANASSA-N 1 1 235.758 3.966 20 0 BHADMO C[N@@H+](C/C=C\Cl)Cc1ccc(Cl)c(F)c1 ZINC000762927521 585439680 /nfs/dbraw/zinc/43/96/80/585439680.db2.gz KWORPQYGWRXSKM-DJWKRKHSSA-N 1 1 248.128 3.663 20 0 BHADMO C[N@H+](C/C=C\Cl)Cc1ccc(Cl)c(F)c1 ZINC000762927521 585439679 /nfs/dbraw/zinc/43/96/79/585439679.db2.gz KWORPQYGWRXSKM-DJWKRKHSSA-N 1 1 248.128 3.663 20 0 BHADMO C[N@@H+](C/C=C/Cl)Cc1ccc(Cl)c(F)c1 ZINC000762927522 585439719 /nfs/dbraw/zinc/43/97/19/585439719.db2.gz KWORPQYGWRXSKM-GORDUTHDSA-N 1 1 248.128 3.663 20 0 BHADMO C[N@H+](C/C=C/Cl)Cc1ccc(Cl)c(F)c1 ZINC000762927522 585439718 /nfs/dbraw/zinc/43/97/18/585439718.db2.gz KWORPQYGWRXSKM-GORDUTHDSA-N 1 1 248.128 3.663 20 0 BHADMO CCC(CC)(CC)SCCn1cc[nH+]c1C ZINC000762973216 585440396 /nfs/dbraw/zinc/44/03/96/585440396.db2.gz MGPGUIMQYKDJKH-UHFFFAOYSA-N 1 1 240.416 3.894 20 0 BHADMO CC(C)C(C)(C)SCC[C@H]1CCC[N@H+]1C ZINC000762977710 585440631 /nfs/dbraw/zinc/44/06/31/585440631.db2.gz AIKGLEGSLJTWGJ-GFCCVEGCSA-N 1 1 229.433 3.639 20 0 BHADMO CC(C)C(C)(C)SCC[C@@H]1CCC[N@H+]1C ZINC000762977721 585440606 /nfs/dbraw/zinc/44/06/06/585440606.db2.gz AIKGLEGSLJTWGJ-LBPRGKRZSA-N 1 1 229.433 3.639 20 0 BHADMO Cc1[nH+]ccn1CCCSC(C)(C)C(C)C ZINC000762981554 585440854 /nfs/dbraw/zinc/44/08/54/585440854.db2.gz XUPLXSMKHCYFEY-UHFFFAOYSA-N 1 1 240.416 3.749 20 0 BHADMO Fc1ccc([C@@H]2CCC[N@H+]2CC2CC2)cc1F ZINC000763409551 585447949 /nfs/dbraw/zinc/44/79/49/585447949.db2.gz GDXPRBTWTPKDQT-AWEZNQCLSA-N 1 1 237.293 3.512 20 0 BHADMO Fc1ccc([C@H]2CCC[N@H+]2CC2CC2)cc1F ZINC000763409557 585447807 /nfs/dbraw/zinc/44/78/07/585447807.db2.gz GDXPRBTWTPKDQT-CQSZACIVSA-N 1 1 237.293 3.512 20 0 BHADMO C[N@H+](C/C(Cl)=C/Cl)CC1CCCCC1 ZINC000763476466 585448737 /nfs/dbraw/zinc/44/87/37/585448737.db2.gz BBTZJZMGLWIVJL-XFFZJAGNSA-N 1 1 236.186 3.818 20 0 BHADMO C[N@@H+](C/C(Cl)=C/Cl)CC1CCCCC1 ZINC000763476466 585448736 /nfs/dbraw/zinc/44/87/36/585448736.db2.gz BBTZJZMGLWIVJL-XFFZJAGNSA-N 1 1 236.186 3.818 20 0 BHADMO C[N@H+](C/C(Cl)=C\Cl)CC1CCCCC1 ZINC000763476642 585448722 /nfs/dbraw/zinc/44/87/22/585448722.db2.gz BBTZJZMGLWIVJL-YRNVUSSQSA-N 1 1 236.186 3.818 20 0 BHADMO C[N@@H+](C/C(Cl)=C\Cl)CC1CCCCC1 ZINC000763476642 585448721 /nfs/dbraw/zinc/44/87/21/585448721.db2.gz BBTZJZMGLWIVJL-YRNVUSSQSA-N 1 1 236.186 3.818 20 0 BHADMO CC1CCC([N@@H+](C)C/C(Cl)=C\Cl)CC1 ZINC000763482724 585448768 /nfs/dbraw/zinc/44/87/68/585448768.db2.gz ZUSDJZXUTGQTAN-JXMROGBWSA-N 1 1 236.186 3.816 20 0 BHADMO CC1CCC([N@@H+](C)C/C(Cl)=C/Cl)CC1 ZINC000763482725 585448774 /nfs/dbraw/zinc/44/87/74/585448774.db2.gz ZUSDJZXUTGQTAN-YFHOEESVSA-N 1 1 236.186 3.816 20 0 BHADMO CC[N@@H+](C/C(Cl)=C\Cl)C1CCCCC1 ZINC000763487561 585448874 /nfs/dbraw/zinc/44/88/74/585448874.db2.gz TTYZLRAMBZDHNR-CSKARUKUSA-N 1 1 236.186 3.960 20 0 BHADMO CC[N@@H+](C/C(Cl)=C/Cl)C1CCCCC1 ZINC000763487563 585448779 /nfs/dbraw/zinc/44/87/79/585448779.db2.gz TTYZLRAMBZDHNR-NTMALXAHSA-N 1 1 236.186 3.960 20 0 BHADMO C[C@@H]1CCCC[C@H]1[N@@H+](C)C/C(Cl)=C\Cl ZINC000763488301 585448899 /nfs/dbraw/zinc/44/88/99/585448899.db2.gz ZBCADTPRZIXXAM-DHJNVWGISA-N 1 1 236.186 3.816 20 0 BHADMO C[C@@H]1CCCC[C@@H]1[N@@H+](C)C/C(Cl)=C\Cl ZINC000763488302 585448878 /nfs/dbraw/zinc/44/88/78/585448878.db2.gz ZBCADTPRZIXXAM-LCIINNLCSA-N 1 1 236.186 3.816 20 0 BHADMO C[C@@H]1CCCC[C@@H]1[N@@H+](C)C/C(Cl)=C/Cl ZINC000763488305 585448966 /nfs/dbraw/zinc/44/89/66/585448966.db2.gz ZBCADTPRZIXXAM-UEQOSDTHSA-N 1 1 236.186 3.816 20 0 BHADMO C[C@@H]1CCCC[C@H]1[N@@H+](C)C/C(Cl)=C/Cl ZINC000763488308 585449012 /nfs/dbraw/zinc/44/90/12/585449012.db2.gz ZBCADTPRZIXXAM-XMZCBSEDSA-N 1 1 236.186 3.816 20 0 BHADMO C[C@@H]1CCC[C@@H]([N@@H+](C)C/C(Cl)=C\Cl)C1 ZINC000763489407 585448754 /nfs/dbraw/zinc/44/87/54/585448754.db2.gz APWLLPJHGLVNMC-DHJNVWGISA-N 1 1 236.186 3.816 20 0 BHADMO C[C@@H]1CCC[C@H]([N@@H+](C)C/C(Cl)=C\Cl)C1 ZINC000763489408 585448997 /nfs/dbraw/zinc/44/89/97/585448997.db2.gz APWLLPJHGLVNMC-LCIINNLCSA-N 1 1 236.186 3.816 20 0 BHADMO C[C@@H]1CCC[C@H]([N@@H+](C)C/C(Cl)=C/Cl)C1 ZINC000763489409 585449001 /nfs/dbraw/zinc/44/90/01/585449001.db2.gz APWLLPJHGLVNMC-UEQOSDTHSA-N 1 1 236.186 3.816 20 0 BHADMO C[C@@H]1CCC[C@@H]([N@@H+](C)C/C(Cl)=C/Cl)C1 ZINC000763489410 585448862 /nfs/dbraw/zinc/44/88/62/585448862.db2.gz APWLLPJHGLVNMC-XMZCBSEDSA-N 1 1 236.186 3.816 20 0 BHADMO Cl/C=C(\Cl)C[N@@H+](C1CC1)C1CCCC1 ZINC000763491115 585448921 /nfs/dbraw/zinc/44/89/21/585448921.db2.gz VWYFHMJJBITZFP-CLFYSBASSA-N 1 1 234.170 3.712 20 0 BHADMO Cl/C=C(\Cl)C[N@H+](C1CC1)C1CCCC1 ZINC000763491115 585448920 /nfs/dbraw/zinc/44/89/20/585448920.db2.gz VWYFHMJJBITZFP-CLFYSBASSA-N 1 1 234.170 3.712 20 0 BHADMO Cl/C=C(/Cl)C[N@@H+](C1CC1)C1CCCC1 ZINC000763491117 585448785 /nfs/dbraw/zinc/44/87/85/585448785.db2.gz VWYFHMJJBITZFP-VQHVLOKHSA-N 1 1 234.170 3.712 20 0 BHADMO Cl/C=C(/Cl)C[N@H+](C1CC1)C1CCCC1 ZINC000763491117 585448784 /nfs/dbraw/zinc/44/87/84/585448784.db2.gz VWYFHMJJBITZFP-VQHVLOKHSA-N 1 1 234.170 3.712 20 0 BHADMO Cl/C=C(/Cl)C[N@H+]1CCC[C@@H]1C1CCCC1 ZINC000763492393 585448904 /nfs/dbraw/zinc/44/89/04/585448904.db2.gz HZSAFBIZGUYMMS-JATZPVMKSA-N 1 1 248.197 3.960 20 0 BHADMO Cl/C=C(\Cl)C[N@H+]1CCC[C@H]1C1CCCC1 ZINC000763492394 585448764 /nfs/dbraw/zinc/44/87/64/585448764.db2.gz HZSAFBIZGUYMMS-KGTBHZDVSA-N 1 1 248.197 3.960 20 0 BHADMO Cl/C=C(\Cl)C[N@H+]1CCC[C@@H]1C1CCCC1 ZINC000763492395 585448987 /nfs/dbraw/zinc/44/89/87/585448987.db2.gz HZSAFBIZGUYMMS-NXIHDVOMSA-N 1 1 248.197 3.960 20 0 BHADMO Cl/C=C(/Cl)C[N@H+]1CCC[C@H]1C1CCCC1 ZINC000763492397 585448969 /nfs/dbraw/zinc/44/89/69/585448969.db2.gz HZSAFBIZGUYMMS-OBIHZWKSSA-N 1 1 248.197 3.960 20 0 BHADMO CCC(CC)[N@@H+](C/C(Cl)=C/Cl)C1CC1 ZINC000763495769 585449221 /nfs/dbraw/zinc/44/92/21/585449221.db2.gz MXMQOMLYWIRZHP-CLFYSBASSA-N 1 1 236.186 3.958 20 0 BHADMO CCC(CC)[N@@H+](C/C(Cl)=C\Cl)C1CC1 ZINC000763495770 585449122 /nfs/dbraw/zinc/44/91/22/585449122.db2.gz MXMQOMLYWIRZHP-VQHVLOKHSA-N 1 1 236.186 3.958 20 0 BHADMO CC(C)C[C@@H]1CCC[N@H+]1C/C(Cl)=C/Cl ZINC000763518393 585449440 /nfs/dbraw/zinc/44/94/40/585449440.db2.gz JZTXJVOVLMLKMG-BRNRAETOSA-N 1 1 236.186 3.816 20 0 BHADMO CC(C)C[C@@H]1CCC[N@H+]1C/C(Cl)=C\Cl ZINC000763518394 585449392 /nfs/dbraw/zinc/44/93/92/585449392.db2.gz JZTXJVOVLMLKMG-HUYFXPKMSA-N 1 1 236.186 3.816 20 0 BHADMO CC(C)C[C@H]1CCC[N@H+]1C/C(Cl)=C\Cl ZINC000763518397 585449302 /nfs/dbraw/zinc/44/93/02/585449302.db2.gz JZTXJVOVLMLKMG-PFEDMVJOSA-N 1 1 236.186 3.816 20 0 BHADMO CC(C)C[C@H]1CCC[N@H+]1C/C(Cl)=C/Cl ZINC000763518398 585449091 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/nfs/dbraw/zinc/45/07/18/585450718.db2.gz IOMAHDBLIFGJIW-FLIBITNWSA-N 1 1 248.197 3.962 20 0 BHADMO CC(C)C1CC[NH+](C/C(Cl)=C/Cl)CC1 ZINC000763558089 585450824 /nfs/dbraw/zinc/45/08/24/585450824.db2.gz IZVRBVWNZUWLLW-XFFZJAGNSA-N 1 1 236.186 3.673 20 0 BHADMO CC(C)C1CC[NH+](C/C(Cl)=C\Cl)CC1 ZINC000763558090 585450806 /nfs/dbraw/zinc/45/08/06/585450806.db2.gz IZVRBVWNZUWLLW-YRNVUSSQSA-N 1 1 236.186 3.673 20 0 BHADMO CC(C)C[C@H]1CC[N@@H+](C/C(Cl)=C/Cl)C1 ZINC000763558220 585450691 /nfs/dbraw/zinc/45/06/91/585450691.db2.gz RNFHDZRKBRZUEX-CHPNCVJKSA-N 1 1 236.186 3.673 20 0 BHADMO CC(C)C[C@@H]1CC[N@@H+](C/C(Cl)=C\Cl)C1 ZINC000763558223 585450652 /nfs/dbraw/zinc/45/06/52/585450652.db2.gz RNFHDZRKBRZUEX-OTXQMUPVSA-N 1 1 236.186 3.673 20 0 BHADMO CC(C)C[C@@H]1CC[N@@H+](C/C(Cl)=C/Cl)C1 ZINC000763558224 585450855 /nfs/dbraw/zinc/45/08/55/585450855.db2.gz RNFHDZRKBRZUEX-OYUORYAFSA-N 1 1 236.186 3.673 20 0 BHADMO CC(C)C[C@H]1CC[N@@H+](C/C(Cl)=C\Cl)C1 ZINC000763558227 585450861 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/nfs/dbraw/zinc/45/07/15/585450715.db2.gz SHUAOPZSTWDZIN-PFEDMVJOSA-N 1 1 236.186 3.818 20 0 BHADMO CC[C@]1(C)CCC[N@@H+](C/C(Cl)=C/Cl)C1 ZINC000763558273 585450770 /nfs/dbraw/zinc/45/07/70/585450770.db2.gz SHUAOPZSTWDZIN-ZJRUKIMVSA-N 1 1 236.186 3.818 20 0 BHADMO CC[C@]1(C)CCC[N@H+](C/C(Cl)=C/Cl)C1 ZINC000763558273 585450769 /nfs/dbraw/zinc/45/07/69/585450769.db2.gz SHUAOPZSTWDZIN-ZJRUKIMVSA-N 1 1 236.186 3.818 20 0 BHADMO Cl/C=C(/Cl)C[N@H+]1CCC2(CCCC2)C1 ZINC000763558808 585450700 /nfs/dbraw/zinc/45/07/00/585450700.db2.gz WHBDFDPGFWUJRF-JXMROGBWSA-N 1 1 234.170 3.572 20 0 BHADMO Cl/C=C(\Cl)C[N@H+]1CCC2(CCCC2)C1 ZINC000763558809 585450891 /nfs/dbraw/zinc/45/08/91/585450891.db2.gz WHBDFDPGFWUJRF-YFHOEESVSA-N 1 1 234.170 3.572 20 0 BHADMO CC[C@@H]1CCCCC[N@H+]1C/C(Cl)=C/Cl ZINC000763559608 585450858 /nfs/dbraw/zinc/45/08/58/585450858.db2.gz FCPLCBZRYLJLJO-HIJJYWJESA-N 1 1 236.186 3.960 20 0 BHADMO CC[C@H]1CCCCC[N@H+]1C/C(Cl)=C/Cl ZINC000763559609 585450880 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585450993 /nfs/dbraw/zinc/45/09/93/585450993.db2.gz XCLASVPZSIIFAQ-LRFOQYRPSA-N 1 1 248.197 3.958 20 0 BHADMO C[C@@H]1C[C@@H]2CCCC[C@H]2[N@H+]1C/C(Cl)=C\Cl ZINC000763564866 585451040 /nfs/dbraw/zinc/45/10/40/585451040.db2.gz XCLASVPZSIIFAQ-OPUTXYDFSA-N 1 1 248.197 3.958 20 0 BHADMO C[C@@H]1C[C@@H]2CCCC[C@H]2[N@H+]1C/C(Cl)=C/Cl ZINC000763564870 585451143 /nfs/dbraw/zinc/45/11/43/585451143.db2.gz XCLASVPZSIIFAQ-ZBFSUVIJSA-N 1 1 248.197 3.958 20 0 BHADMO CCC1(CC)CC[N@@H+](C/C(Cl)=C\Cl)C1 ZINC000763587635 585451135 /nfs/dbraw/zinc/45/11/35/585451135.db2.gz DQDYPTPWWFVCMA-JXMROGBWSA-N 1 1 236.186 3.818 20 0 BHADMO CCC1(CC)CC[N@@H+](C/C(Cl)=C/Cl)C1 ZINC000763587636 585450990 /nfs/dbraw/zinc/45/09/90/585450990.db2.gz DQDYPTPWWFVCMA-YFHOEESVSA-N 1 1 236.186 3.818 20 0 BHADMO CCC[C@@H]1CCC[N@@H+](C/C(Cl)=C/Cl)C1 ZINC000763588337 585451065 /nfs/dbraw/zinc/45/10/65/585451065.db2.gz FKTWWOKKQYIWQL-PAKSIRSJSA-N 1 1 236.186 3.818 20 0 BHADMO CCC[C@@H]1CCC[N@H+](C/C(Cl)=C/Cl)C1 ZINC000763588337 585451064 /nfs/dbraw/zinc/45/10/64/585451064.db2.gz FKTWWOKKQYIWQL-PAKSIRSJSA-N 1 1 236.186 3.818 20 0 BHADMO CCC[C@H]1CCC[N@@H+](C/C(Cl)=C/Cl)C1 ZINC000763588338 585450981 /nfs/dbraw/zinc/45/09/81/585450981.db2.gz FKTWWOKKQYIWQL-QBQSQJOESA-N 1 1 236.186 3.818 20 0 BHADMO CCC[C@H]1CCC[N@H+](C/C(Cl)=C/Cl)C1 ZINC000763588338 585450980 /nfs/dbraw/zinc/45/09/80/585450980.db2.gz FKTWWOKKQYIWQL-QBQSQJOESA-N 1 1 236.186 3.818 20 0 BHADMO CCC[C@@H]1CCC[N@@H+](C/C(Cl)=C\Cl)C1 ZINC000763588339 585451156 /nfs/dbraw/zinc/45/11/56/585451156.db2.gz FKTWWOKKQYIWQL-UEUZTHOGSA-N 1 1 236.186 3.818 20 0 BHADMO CCC[C@@H]1CCC[N@H+](C/C(Cl)=C\Cl)C1 ZINC000763588339 585451155 /nfs/dbraw/zinc/45/11/55/585451155.db2.gz FKTWWOKKQYIWQL-UEUZTHOGSA-N 1 1 236.186 3.818 20 0 BHADMO CCC[C@H]1CCC[N@@H+](C/C(Cl)=C\Cl)C1 ZINC000763588340 585451037 /nfs/dbraw/zinc/45/10/37/585451037.db2.gz FKTWWOKKQYIWQL-VUBLIPMDSA-N 1 1 236.186 3.818 20 0 BHADMO CCC[C@H]1CCC[N@H+](C/C(Cl)=C\Cl)C1 ZINC000763588340 585451036 /nfs/dbraw/zinc/45/10/36/585451036.db2.gz FKTWWOKKQYIWQL-VUBLIPMDSA-N 1 1 236.186 3.818 20 0 BHADMO CC(C)=CC[N@H+]1Cc2ccccc2[C@H](C)C1 ZINC000763619436 585451299 /nfs/dbraw/zinc/45/12/99/585451299.db2.gz WSBJFNNNOIMINN-CYBMUJFWSA-N 1 1 215.340 3.572 20 0 BHADMO CC(C)=CC[N@H+]1Cc2ccccc2[C@@H](C)C1 ZINC000763619437 585451229 /nfs/dbraw/zinc/45/12/29/585451229.db2.gz WSBJFNNNOIMINN-ZDUSSCGKSA-N 1 1 215.340 3.572 20 0 BHADMO Cc1cc(C[N@@H+]2CC3(CCC3)C[C@H]2C)c(C)o1 ZINC000763646127 585451493 /nfs/dbraw/zinc/45/14/93/585451493.db2.gz IZCKQTKVQGICQT-LLVKDONJSA-N 1 1 233.355 3.661 20 0 BHADMO Cc1cc(C[N@@H+]2CC3(CCC3)C[C@@H]2C)c(C)o1 ZINC000763646128 585451733 /nfs/dbraw/zinc/45/17/33/585451733.db2.gz IZCKQTKVQGICQT-NSHDSACASA-N 1 1 233.355 3.661 20 0 BHADMO C[N@@H+](C/C=C\Cl)Cc1ccc(F)c(Cl)c1 ZINC000763824504 585454806 /nfs/dbraw/zinc/45/48/06/585454806.db2.gz LOZDLLJHHGRRFH-DJWKRKHSSA-N 1 1 248.128 3.663 20 0 BHADMO C[N@H+](C/C=C\Cl)Cc1ccc(F)c(Cl)c1 ZINC000763824504 585454805 /nfs/dbraw/zinc/45/48/05/585454805.db2.gz LOZDLLJHHGRRFH-DJWKRKHSSA-N 1 1 248.128 3.663 20 0 BHADMO C[N@@H+](C/C=C/Cl)Cc1ccc(F)c(Cl)c1 ZINC000763824505 585454760 /nfs/dbraw/zinc/45/47/60/585454760.db2.gz LOZDLLJHHGRRFH-GORDUTHDSA-N 1 1 248.128 3.663 20 0 BHADMO C[N@H+](C/C=C/Cl)Cc1ccc(F)c(Cl)c1 ZINC000763824505 585454759 /nfs/dbraw/zinc/45/47/59/585454759.db2.gz LOZDLLJHHGRRFH-GORDUTHDSA-N 1 1 248.128 3.663 20 0 BHADMO Cc1ccc(C[N@H+](C)C2CCCCCCC2)cn1 ZINC000765582025 585490175 /nfs/dbraw/zinc/49/01/75/585490175.db2.gz NPHGHHQVXAQWAY-UHFFFAOYSA-N 1 1 246.398 3.935 20 0 BHADMO Cc1cc(C)c([C@H](C)[N@@H+](C)CCCF)c(C)c1 ZINC000766025675 585496386 /nfs/dbraw/zinc/49/63/86/585496386.db2.gz BFLVAEDJWNQNEX-AWEZNQCLSA-N 1 1 237.362 3.964 20 0 BHADMO Cc1cc(C)c([C@@H](C)[N@@H+](C)CCCF)c(C)c1 ZINC000766025683 585496215 /nfs/dbraw/zinc/49/62/15/585496215.db2.gz BFLVAEDJWNQNEX-CQSZACIVSA-N 1 1 237.362 3.964 20 0 BHADMO CC[C@H](c1ccc(F)cc1)[N@@H+](C)CCCF ZINC000766028970 585496461 /nfs/dbraw/zinc/49/64/61/585496461.db2.gz WXQQWHXLNNESQW-CYBMUJFWSA-N 1 1 227.298 3.568 20 0 BHADMO CC[C@@H](c1ccc(F)cc1)[N@@H+](C)CCCF ZINC000766028972 585496457 /nfs/dbraw/zinc/49/64/57/585496457.db2.gz WXQQWHXLNNESQW-ZDUSSCGKSA-N 1 1 227.298 3.568 20 0 BHADMO CCCCCC[N@@H+](C)[C@@H](C)Cc1ccc(O)cc1 ZINC000766209886 585498676 /nfs/dbraw/zinc/49/86/76/585498676.db2.gz OYJFEIUMAGEUER-AWEZNQCLSA-N 1 1 249.398 3.835 20 0 BHADMO CCCCCC[N@@H+](C)[C@H](C)Cc1ccc(O)cc1 ZINC000766209888 585498735 /nfs/dbraw/zinc/49/87/35/585498735.db2.gz OYJFEIUMAGEUER-CQSZACIVSA-N 1 1 249.398 3.835 20 0 BHADMO Cc1ccc([C@@H](C)[NH2+]Cc2c(C)cccc2F)o1 ZINC000766212548 585498939 /nfs/dbraw/zinc/49/89/39/585498939.db2.gz IGBQVXKUUSQFON-GFCCVEGCSA-N 1 1 247.313 3.886 20 0 BHADMO Cc1ccc([C@H](C)[NH2+]Cc2c(C)cccc2F)o1 ZINC000766212565 585499038 /nfs/dbraw/zinc/49/90/38/585499038.db2.gz IGBQVXKUUSQFON-LBPRGKRZSA-N 1 1 247.313 3.886 20 0 BHADMO Cc1cccc(F)c1C[NH2+][C@H](C)c1ccco1 ZINC000766213066 585498919 /nfs/dbraw/zinc/49/89/19/585498919.db2.gz NAFKEMVZFIVEJO-LLVKDONJSA-N 1 1 233.286 3.578 20 0 BHADMO Cc1cccc(F)c1C[NH2+][C@@H](C)c1ccco1 ZINC000766213070 585499092 /nfs/dbraw/zinc/49/90/92/585499092.db2.gz NAFKEMVZFIVEJO-NSHDSACASA-N 1 1 233.286 3.578 20 0 BHADMO Cc1cc([NH2+]CC2(C)CCC2)ccc1N(C)C ZINC000766213211 585499069 /nfs/dbraw/zinc/49/90/69/585499069.db2.gz MEXURWAPDPORAZ-UHFFFAOYSA-N 1 1 232.371 3.663 20 0 BHADMO Cc1cccc(F)c1C[NH2+][C@H](C)c1ccoc1 ZINC000766213378 585498976 /nfs/dbraw/zinc/49/89/76/585498976.db2.gz OUYCPFZWMYDNLG-LLVKDONJSA-N 1 1 233.286 3.578 20 0 BHADMO Cc1cccc(F)c1C[NH2+][C@@H](C)c1ccoc1 ZINC000766213382 585498616 /nfs/dbraw/zinc/49/86/16/585498616.db2.gz OUYCPFZWMYDNLG-NSHDSACASA-N 1 1 233.286 3.578 20 0 BHADMO CC/C=C\CC[N@@H+](C)CCc1ccccc1F ZINC000767316074 585516603 /nfs/dbraw/zinc/51/66/03/585516603.db2.gz BVXHOGBFWYVGDU-PLNGDYQASA-N 1 1 235.346 3.656 20 0 BHADMO CC/C=C/CC[N@@H+](C)CCc1ccccc1F ZINC000767316079 585516579 /nfs/dbraw/zinc/51/65/79/585516579.db2.gz BVXHOGBFWYVGDU-SNAWJCMRSA-N 1 1 235.346 3.656 20 0 BHADMO CC/C=C\CC[N@H+]1CCC2(CCCC2)C1 ZINC000767330910 585516607 /nfs/dbraw/zinc/51/66/07/585516607.db2.gz UZWPVDXBHXSAKE-ARJAWSKDSA-N 1 1 207.361 3.609 20 0 BHADMO CC/C=C/CC[N@H+]1CCC2(CCCC2)C1 ZINC000767330914 585516522 /nfs/dbraw/zinc/51/65/22/585516522.db2.gz UZWPVDXBHXSAKE-ONEGZZNKSA-N 1 1 207.361 3.609 20 0 BHADMO CCC(CC)[N@@H+](CCC(=O)C1CC1)CC(C)C ZINC000767416587 585519691 /nfs/dbraw/zinc/51/96/91/585519691.db2.gz WFWSMZMOYZCVQO-UHFFFAOYSA-N 1 1 239.403 3.502 20 0 BHADMO CCCCC(N)=[NH+]OCc1cc2ccccc2o1 ZINC000767826988 585526619 /nfs/dbraw/zinc/52/66/19/585526619.db2.gz BCASSDRLGKQAAD-UHFFFAOYSA-N 1 1 246.310 3.621 20 0 BHADMO CC[C@@H]1Cc2ccccc2C[N@H+]1C/C=C\Cl ZINC000767880006 585527322 /nfs/dbraw/zinc/52/73/22/585527322.db2.gz BNYKOSJBGVZLCN-BMWLXYDHSA-N 1 1 235.758 3.576 20 0 BHADMO CC[C@H]1Cc2ccccc2C[N@H+]1C/C=C/Cl ZINC000767880034 585527152 /nfs/dbraw/zinc/52/71/52/585527152.db2.gz BNYKOSJBGVZLCN-GPAKFWEMSA-N 1 1 235.758 3.576 20 0 BHADMO CC[C@@H]1Cc2ccccc2C[N@H+]1C/C=C/Cl ZINC000767880037 585527190 /nfs/dbraw/zinc/52/71/90/585527190.db2.gz BNYKOSJBGVZLCN-LHRNQBEKSA-N 1 1 235.758 3.576 20 0 BHADMO CC[C@H]1Cc2ccccc2C[N@H+]1C/C=C\Cl ZINC000767880042 585527373 /nfs/dbraw/zinc/52/73/73/585527373.db2.gz BNYKOSJBGVZLCN-PODYEWJSSA-N 1 1 235.758 3.576 20 0 BHADMO C[C@@H](c1ccccc1)[N@@H+](C/C=C/Cl)C1CC1 ZINC000767889266 585527517 /nfs/dbraw/zinc/52/75/17/585527517.db2.gz KIMOVAFHOYOYOO-DJTWPOEFSA-N 1 1 235.758 3.965 20 0 BHADMO C[C@H](c1ccccc1)[N@@H+](C/C=C\Cl)C1CC1 ZINC000767889267 585527597 /nfs/dbraw/zinc/52/75/97/585527597.db2.gz KIMOVAFHOYOYOO-DUWGPSABSA-N 1 1 235.758 3.965 20 0 BHADMO C[C@@H](c1ccccc1)[N@@H+](C/C=C\Cl)C1CC1 ZINC000767889269 585527439 /nfs/dbraw/zinc/52/74/39/585527439.db2.gz KIMOVAFHOYOYOO-JSJZCHLLSA-N 1 1 235.758 3.965 20 0 BHADMO C[C@H](c1ccccc1)[N@@H+](C/C=C/Cl)C1CC1 ZINC000767889270 585527500 /nfs/dbraw/zinc/52/75/00/585527500.db2.gz KIMOVAFHOYOYOO-SBKJXLNCSA-N 1 1 235.758 3.965 20 0 BHADMO Cl/C=C/C[N@@H+](C1CC1)[C@H]1CCc2ccccc21 ZINC000767891892 585527532 /nfs/dbraw/zinc/52/75/32/585527532.db2.gz UFLMOKMEDHBPEO-GMLHSMKSSA-N 1 1 247.769 3.891 20 0 BHADMO Cl/C=C\C[N@@H+](C1CC1)[C@H]1CCc2ccccc21 ZINC000767891894 585527626 /nfs/dbraw/zinc/52/76/26/585527626.db2.gz UFLMOKMEDHBPEO-ICSVTGKESA-N 1 1 247.769 3.891 20 0 BHADMO Cl/C=C\C[N@@H+](C1CC1)[C@@H]1CCc2ccccc21 ZINC000767891895 585527580 /nfs/dbraw/zinc/52/75/80/585527580.db2.gz UFLMOKMEDHBPEO-ITOFIOBYSA-N 1 1 247.769 3.891 20 0 BHADMO Cl/C=C/C[N@@H+](C1CC1)[C@@H]1CCc2ccccc21 ZINC000767891896 585527535 /nfs/dbraw/zinc/52/75/35/585527535.db2.gz UFLMOKMEDHBPEO-RDJHCISDSA-N 1 1 247.769 3.891 20 0 BHADMO CC(C)[N@@H+](C/C=C/Cl)C1CCCCC1 ZINC000767894091 585527211 /nfs/dbraw/zinc/52/72/11/585527211.db2.gz SELSDKBVXVXWMW-RMKNXTFCSA-N 1 1 215.768 3.782 20 0 BHADMO CC(C)[N@@H+](C/C=C\Cl)C1CCCCC1 ZINC000767894098 585527333 /nfs/dbraw/zinc/52/73/33/585527333.db2.gz SELSDKBVXVXWMW-TWGQIWQCSA-N 1 1 215.768 3.782 20 0 BHADMO CCC[C@@H]1[C@@H](C)CCC[N@H+]1C/C=C\Cl ZINC000767900200 585527885 /nfs/dbraw/zinc/52/78/85/585527885.db2.gz PYYTXIAMZPRBDB-HJLXKUKWSA-N 1 1 215.768 3.640 20 0 BHADMO CCC[C@@H]1[C@@H](C)CCC[N@H+]1C/C=C/Cl ZINC000767900202 585527843 /nfs/dbraw/zinc/52/78/43/585527843.db2.gz PYYTXIAMZPRBDB-JZUADKBYSA-N 1 1 215.768 3.640 20 0 BHADMO CCC[C@@H]1[C@H](C)CCC[N@H+]1C/C=C\Cl ZINC000767900203 585527230 /nfs/dbraw/zinc/52/72/30/585527230.db2.gz PYYTXIAMZPRBDB-OBBGCOQJSA-N 1 1 215.768 3.640 20 0 BHADMO CCC[C@@H]1[C@H](C)CCC[N@H+]1C/C=C/Cl ZINC000767900205 585527304 /nfs/dbraw/zinc/52/73/04/585527304.db2.gz PYYTXIAMZPRBDB-ZOUVEMKTSA-N 1 1 215.768 3.640 20 0 BHADMO CC(C)C[C@H]1CCCC[N@H+]1C/C=C/Cl ZINC000767902535 585528224 /nfs/dbraw/zinc/52/82/24/585528224.db2.gz QSVTWHYAMHWMOM-HOSRBBHYSA-N 1 1 215.768 3.640 20 0 BHADMO CC(C)C[C@@H]1CCCC[N@H+]1C/C=C\Cl ZINC000767902659 585528247 /nfs/dbraw/zinc/52/82/47/585528247.db2.gz QSVTWHYAMHWMOM-HWPRWLFBSA-N 1 1 215.768 3.640 20 0 BHADMO CC(C)C[C@@H]1CCCC[N@H+]1C/C=C/Cl ZINC000767902660 585528035 /nfs/dbraw/zinc/52/80/35/585528035.db2.gz QSVTWHYAMHWMOM-PZBABLGHSA-N 1 1 215.768 3.640 20 0 BHADMO CC(C)C[C@H]1CCCC[N@H+]1C/C=C\Cl ZINC000767902661 585528080 /nfs/dbraw/zinc/52/80/80/585528080.db2.gz QSVTWHYAMHWMOM-SMYYYNMVSA-N 1 1 215.768 3.640 20 0 BHADMO CC(C)CC[C@@H]1CCC[N@H+]1C/C=C/Cl ZINC000767905723 585528119 /nfs/dbraw/zinc/52/81/19/585528119.db2.gz HTGSTBRUIMEHBU-GXWOQWCDSA-N 1 1 215.768 3.640 20 0 BHADMO CC(C)CC[C@H]1CCC[N@H+]1C/C=C\Cl ZINC000767905724 585528218 /nfs/dbraw/zinc/52/82/18/585528218.db2.gz HTGSTBRUIMEHBU-HXUAIIEXSA-N 1 1 215.768 3.640 20 0 BHADMO CC(C)CC[C@@H]1CCC[N@H+]1C/C=C\Cl ZINC000767905725 585528277 /nfs/dbraw/zinc/52/82/77/585528277.db2.gz HTGSTBRUIMEHBU-LDJOOVGUSA-N 1 1 215.768 3.640 20 0 BHADMO CC(C)CC[C@H]1CCC[N@H+]1C/C=C/Cl ZINC000767905726 585528032 /nfs/dbraw/zinc/52/80/32/585528032.db2.gz HTGSTBRUIMEHBU-WNPFHQFXSA-N 1 1 215.768 3.640 20 0 BHADMO CCC[C@H](C)[C@H]1CCC[N@H+]1C/C=C\Cl ZINC000767906189 585527978 /nfs/dbraw/zinc/52/79/78/585527978.db2.gz KVJSZBMKUCXXBC-HJLXKUKWSA-N 1 1 215.768 3.640 20 0 BHADMO CCC[C@H](C)[C@H]1CCC[N@H+]1C/C=C/Cl ZINC000767906190 585528138 /nfs/dbraw/zinc/52/81/38/585528138.db2.gz KVJSZBMKUCXXBC-JZUADKBYSA-N 1 1 215.768 3.640 20 0 BHADMO CCC[C@H](C)[C@@H]1CCC[N@H+]1C/C=C/Cl ZINC000767906192 585528238 /nfs/dbraw/zinc/52/82/38/585528238.db2.gz KVJSZBMKUCXXBC-LHXDFBSTSA-N 1 1 215.768 3.640 20 0 BHADMO CCC[C@H](C)[C@@H]1CCC[N@H+]1C/C=C\Cl ZINC000767906194 585528297 /nfs/dbraw/zinc/52/82/97/585528297.db2.gz KVJSZBMKUCXXBC-MUDVKMOPSA-N 1 1 215.768 3.640 20 0 BHADMO CCCCCC[N@@H+](CC(F)F)C(C)C ZINC000767906411 585528019 /nfs/dbraw/zinc/52/80/19/585528019.db2.gz MRDACXNOVWDYNF-UHFFFAOYSA-N 1 1 207.308 3.542 20 0 BHADMO CCCCCC[N@H+](CC(F)F)C(C)C ZINC000767906411 585528018 /nfs/dbraw/zinc/52/80/18/585528018.db2.gz MRDACXNOVWDYNF-UHFFFAOYSA-N 1 1 207.308 3.542 20 0 BHADMO CCCCC[C@H]1CCC[N@H+]1CCCCCCO ZINC000767906454 585528254 /nfs/dbraw/zinc/52/82/54/585528254.db2.gz OZGOAAXMHXPYMC-HNNXBMFYSA-N 1 1 241.419 3.584 20 0 BHADMO CCCCC[C@@H]1CCC[N@H+]1CCCCCCO ZINC000767906455 585528103 /nfs/dbraw/zinc/52/81/03/585528103.db2.gz OZGOAAXMHXPYMC-OAHLLOKOSA-N 1 1 241.419 3.584 20 0 BHADMO CCCCC[C@H]1CCC[N@H+]1C/C=C/Cl ZINC000767906923 585528309 /nfs/dbraw/zinc/52/83/09/585528309.db2.gz PGRLTXMCKLFEFN-LZGFCCKTSA-N 1 1 215.768 3.784 20 0 BHADMO CCCCC[C@@H]1CCC[N@H+]1C/C=C\Cl ZINC000767906927 585528121 /nfs/dbraw/zinc/52/81/21/585528121.db2.gz PGRLTXMCKLFEFN-OJIASSBASA-N 1 1 215.768 3.784 20 0 BHADMO CCCCC[C@H]1CCC[N@H+]1C/C=C\Cl ZINC000767906929 585528266 /nfs/dbraw/zinc/52/82/66/585528266.db2.gz PGRLTXMCKLFEFN-PWWFUAJNSA-N 1 1 215.768 3.784 20 0 BHADMO CCCCC[C@@H]1CCC[N@H+]1C/C=C/Cl ZINC000767906931 585528258 /nfs/dbraw/zinc/52/82/58/585528258.db2.gz PGRLTXMCKLFEFN-UVMWJGKXSA-N 1 1 215.768 3.784 20 0 BHADMO C[C@]1(Cc2ccccc2)CCC[N@H+]1C/C=C\Cl ZINC000767936071 585528596 /nfs/dbraw/zinc/52/85/96/585528596.db2.gz PAOHQBHUDNJQHC-IZIDJEDMSA-N 1 1 249.785 3.836 20 0 BHADMO C[C@@]1(Cc2ccccc2)CCC[N@H+]1C/C=C\Cl ZINC000767936072 585528461 /nfs/dbraw/zinc/52/84/61/585528461.db2.gz PAOHQBHUDNJQHC-MLBQELRYSA-N 1 1 249.785 3.836 20 0 BHADMO C[C@]1(Cc2ccccc2)CCC[N@H+]1C/C=C/Cl ZINC000767936073 585528568 /nfs/dbraw/zinc/52/85/68/585528568.db2.gz PAOHQBHUDNJQHC-WCLQSUPFSA-N 1 1 249.785 3.836 20 0 BHADMO C[C@@]1(Cc2ccccc2)CCC[N@H+]1C/C=C/Cl ZINC000767936074 585528389 /nfs/dbraw/zinc/52/83/89/585528389.db2.gz PAOHQBHUDNJQHC-WGPYJDKQSA-N 1 1 249.785 3.836 20 0 BHADMO CCCCCC[N@H+]1CCCC[C@@H](CCOC)C1 ZINC000767942923 585528691 /nfs/dbraw/zinc/52/86/91/585528691.db2.gz USNWEIZKERDHSM-HNNXBMFYSA-N 1 1 241.419 3.705 20 0 BHADMO CCCCCC[N@H+]1CCCC[C@H](CCOC)C1 ZINC000767942926 585528687 /nfs/dbraw/zinc/52/86/87/585528687.db2.gz USNWEIZKERDHSM-OAHLLOKOSA-N 1 1 241.419 3.705 20 0 BHADMO CCC[N@H+](Cc1cc(C)oc1C)CC1CC1 ZINC000768129387 585532416 /nfs/dbraw/zinc/53/24/16/585532416.db2.gz GMTGSKFYYSXHFQ-UHFFFAOYSA-N 1 1 221.344 3.518 20 0 BHADMO Cc1cc(C[N@H+]2CC[C@H]2c2ccccc2)c(C)o1 ZINC000768130204 585532400 /nfs/dbraw/zinc/53/24/00/585532400.db2.gz OZXUINFLVUHYQH-INIZCTEOSA-N 1 1 241.334 3.843 20 0 BHADMO Cc1cc(C[N@H+]2CC[C@@H]2c2ccccc2)c(C)o1 ZINC000768130212 585532467 /nfs/dbraw/zinc/53/24/67/585532467.db2.gz OZXUINFLVUHYQH-MRXNPFEDSA-N 1 1 241.334 3.843 20 0 BHADMO Cc1cc(C[N@H+]([C@H](C)C(C)C)C2CC2)c(C)o1 ZINC000768136782 585532624 /nfs/dbraw/zinc/53/26/24/585532624.db2.gz ATRJLPMIAUCIBN-GFCCVEGCSA-N 1 1 235.371 3.905 20 0 BHADMO Cc1cc(C[N@H+]([C@@H](C)C(C)C)C2CC2)c(C)o1 ZINC000768136783 585532923 /nfs/dbraw/zinc/53/29/23/585532923.db2.gz ATRJLPMIAUCIBN-LBPRGKRZSA-N 1 1 235.371 3.905 20 0 BHADMO Cc1cc(C[N@H+](C)C2CCCCC2)c(C)o1 ZINC000768138327 585532662 /nfs/dbraw/zinc/53/26/62/585532662.db2.gz IUOPNGQMFAVPQW-UHFFFAOYSA-N 1 1 221.344 3.661 20 0 BHADMO CC[C@H]1CCCC[N@H+]1Cc1cc(C)oc1C ZINC000768138456 585532909 /nfs/dbraw/zinc/53/29/09/585532909.db2.gz KVUYHUBGFPTLDP-AWEZNQCLSA-N 1 1 221.344 3.661 20 0 BHADMO CC[C@@H]1CCCC[N@H+]1Cc1cc(C)oc1C ZINC000768138457 585532426 /nfs/dbraw/zinc/53/24/26/585532426.db2.gz KVUYHUBGFPTLDP-CQSZACIVSA-N 1 1 221.344 3.661 20 0 BHADMO CC[N@@H+](Cc1coc(C2CC2)n1)C1CCCCC1 ZINC000768138908 585532686 /nfs/dbraw/zinc/53/26/86/585532686.db2.gz WPCFCKUHSHCOHN-UHFFFAOYSA-N 1 1 248.370 3.707 20 0 BHADMO CC[N@@H+](Cc1cc(C)oc1C)Cc1ccccc1 ZINC000768140075 585532901 /nfs/dbraw/zinc/53/29/01/585532901.db2.gz ARTUWXODXPRWLE-UHFFFAOYSA-N 1 1 243.350 3.919 20 0 BHADMO C[C@@H]1CCCC[N@H+]1Cc1nccc2ccccc21 ZINC000768142310 585532984 /nfs/dbraw/zinc/53/29/84/585532984.db2.gz ARLVPQAUODRFBK-CYBMUJFWSA-N 1 1 240.350 3.609 20 0 BHADMO C[C@H]1CCCC[N@H+]1Cc1nccc2ccccc21 ZINC000768142311 585532849 /nfs/dbraw/zinc/53/28/49/585532849.db2.gz ARLVPQAUODRFBK-ZDUSSCGKSA-N 1 1 240.350 3.609 20 0 BHADMO CCCC[N@@H+](CC)Cc1cnc(Cl)c(C)c1 ZINC000768142799 643457501 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243.350 3.837 20 0 BHADMO Cc1cc(C[N@H+](C)Cc2ccc(F)cc2)c(C)o1 ZINC000768175809 585533358 /nfs/dbraw/zinc/53/33/58/585533358.db2.gz WVRWLLDCXFLXJW-UHFFFAOYSA-N 1 1 247.313 3.668 20 0 BHADMO C[N@@H+](Cc1ccco1)C1CCCCCCC1 ZINC000768184796 585533525 /nfs/dbraw/zinc/53/35/25/585533525.db2.gz IZVKEAHYJZNGBM-UHFFFAOYSA-N 1 1 221.344 3.824 20 0 BHADMO Cc1ccoc1C[N@H+]1Cc2ccccc2[C@H](C)C1 ZINC000768194537 585533638 /nfs/dbraw/zinc/53/36/38/585533638.db2.gz AGWMAJLBWWSWPX-CYBMUJFWSA-N 1 1 241.334 3.707 20 0 BHADMO Cc1ccoc1C[N@H+]1Cc2ccccc2[C@@H](C)C1 ZINC000768194538 585533666 /nfs/dbraw/zinc/53/36/66/585533666.db2.gz AGWMAJLBWWSWPX-ZDUSSCGKSA-N 1 1 241.334 3.707 20 0 BHADMO c1csc([C@H]2CCC[N@@H+]2Cc2ccoc2)c1 ZINC000768194586 585533744 /nfs/dbraw/zinc/53/37/44/585533744.db2.gz BVPVATZOOBCELR-GFCCVEGCSA-N 1 1 233.336 3.678 20 0 BHADMO c1csc([C@@H]2CCC[N@@H+]2Cc2ccoc2)c1 ZINC000768194587 585533882 /nfs/dbraw/zinc/53/38/82/585533882.db2.gz BVPVATZOOBCELR-LBPRGKRZSA-N 1 1 233.336 3.678 20 0 BHADMO C[C@@H]1C[N@@H+](Cc2ccsc2)Cc2ccccc21 ZINC000768194821 585533793 /nfs/dbraw/zinc/53/37/93/585533793.db2.gz FKTIOEHLTXIZMD-GFCCVEGCSA-N 1 1 243.375 3.867 20 0 BHADMO C[C@H]1C[N@@H+](Cc2ccsc2)Cc2ccccc21 ZINC000768194822 585533691 /nfs/dbraw/zinc/53/36/91/585533691.db2.gz FKTIOEHLTXIZMD-LBPRGKRZSA-N 1 1 243.375 3.867 20 0 BHADMO Cc1ccc(C[N@H+]2Cc3ccccc3[C@H](C)C2)o1 ZINC000768194995 585533878 /nfs/dbraw/zinc/53/38/78/585533878.db2.gz IFFICGDGLLXAIZ-GFCCVEGCSA-N 1 1 241.334 3.707 20 0 BHADMO Cc1ccc(C[N@H+]2Cc3ccccc3[C@@H](C)C2)o1 ZINC000768194996 585533909 /nfs/dbraw/zinc/53/39/09/585533909.db2.gz IFFICGDGLLXAIZ-LBPRGKRZSA-N 1 1 241.334 3.707 20 0 BHADMO CC[N@@H+](Cc1cccs1)Cc1cc(C)oc1C ZINC000768196303 585533718 /nfs/dbraw/zinc/53/37/18/585533718.db2.gz BIPDDQHMFOVEHN-UHFFFAOYSA-N 1 1 249.379 3.980 20 0 BHADMO CC1CCC([N@@H+](C)Cc2coc(C3CC3)n2)CC1 ZINC000768198313 585533889 /nfs/dbraw/zinc/53/38/89/585533889.db2.gz SCKCMESGWLKXKD-UHFFFAOYSA-N 1 1 248.370 3.563 20 0 BHADMO C[N@@H+](Cc1cncc2ccccc21)C1CCCC1 ZINC000768214095 585534002 /nfs/dbraw/zinc/53/40/02/585534002.db2.gz HGLFIPIVIXOEAV-UHFFFAOYSA-N 1 1 240.350 3.609 20 0 BHADMO c1cc(C[N@H+]2CCC[C@H]2c2ccccc2)co1 ZINC000768224176 585534146 /nfs/dbraw/zinc/53/41/46/585534146.db2.gz VGXLZQQRSRKBAM-HNNXBMFYSA-N 1 1 227.307 3.617 20 0 BHADMO c1cc(C[N@H+]2CCC[C@@H]2c2ccccc2)co1 ZINC000768224177 585533967 /nfs/dbraw/zinc/53/39/67/585533967.db2.gz VGXLZQQRSRKBAM-OAHLLOKOSA-N 1 1 227.307 3.617 20 0 BHADMO Fc1ccc([C@@H]2CCC[N@H+]2Cc2ccoc2)cc1 ZINC000768225189 585533957 /nfs/dbraw/zinc/53/39/57/585533957.db2.gz DCQWQILSXHFVNG-HNNXBMFYSA-N 1 1 245.297 3.756 20 0 BHADMO Fc1ccc([C@H]2CCC[N@H+]2Cc2ccoc2)cc1 ZINC000768225190 585534084 /nfs/dbraw/zinc/53/40/84/585534084.db2.gz DCQWQILSXHFVNG-OAHLLOKOSA-N 1 1 245.297 3.756 20 0 BHADMO Cc1cc(C[N@H+]2CCc3sccc3C2)c(C)o1 ZINC000768235021 585534473 /nfs/dbraw/zinc/53/44/73/585534473.db2.gz VSWRICSTJMZBTH-UHFFFAOYSA-N 1 1 247.363 3.516 20 0 BHADMO Cc1cc(C[N@@H+]2CCc3sccc3C2)c(C)o1 ZINC000768235021 585534472 /nfs/dbraw/zinc/53/44/72/585534472.db2.gz VSWRICSTJMZBTH-UHFFFAOYSA-N 1 1 247.363 3.516 20 0 BHADMO CC[N@@H+](Cc1cc2cccc(OC)c2o1)C(C)C ZINC000768236240 585534404 /nfs/dbraw/zinc/53/44/04/585534404.db2.gz CWUKVNZIPHIEMS-UHFFFAOYSA-N 1 1 247.338 3.672 20 0 BHADMO CC[N@@H+](Cc1ccccc1C1CC1)C(C)C ZINC000768237495 585534368 /nfs/dbraw/zinc/53/43/68/585534368.db2.gz TZZKJXVYSTWPAY-UHFFFAOYSA-N 1 1 217.356 3.794 20 0 BHADMO Cc1ccc([C@@H]2CCC[N@H+]2Cc2ccoc2)cc1 ZINC000768238228 585534289 /nfs/dbraw/zinc/53/42/89/585534289.db2.gz XLJCYPBVWGZYDI-INIZCTEOSA-N 1 1 241.334 3.925 20 0 BHADMO Cc1ccc([C@H]2CCC[N@H+]2Cc2ccoc2)cc1 ZINC000768238230 585534370 /nfs/dbraw/zinc/53/43/70/585534370.db2.gz XLJCYPBVWGZYDI-MRXNPFEDSA-N 1 1 241.334 3.925 20 0 BHADMO C[N@H+](Cc1coc(C2CC2)n1)CC1CCCCC1 ZINC000768238353 585534459 /nfs/dbraw/zinc/53/44/59/585534459.db2.gz YXCUHTUFHUKMAO-UHFFFAOYSA-N 1 1 248.370 3.564 20 0 BHADMO CC[N@@H+](C)Cc1ccc(SC(F)(F)F)cc1 ZINC000768238379 585534380 /nfs/dbraw/zinc/53/43/80/585534380.db2.gz YYKMLAAYYSEOBF-UHFFFAOYSA-N 1 1 249.301 3.750 20 0 BHADMO COc1cccc2cc(C[N@@H+](C)CC(C)C)oc21 ZINC000768245372 585534722 /nfs/dbraw/zinc/53/47/22/585534722.db2.gz QOQLMSVOAVCWEW-UHFFFAOYSA-N 1 1 247.338 3.529 20 0 BHADMO Cc1cc(C[N@H+](Cc2ccco2)C(C)C)c(C)o1 ZINC000768249165 585534947 /nfs/dbraw/zinc/53/49/47/585534947.db2.gz AIPAWNRUJHGAIS-UHFFFAOYSA-N 1 1 247.338 3.900 20 0 BHADMO Cc1cc(C[N@@H+](C2CC2)C2CCCC2)c(C)o1 ZINC000768251780 584949235 /nfs/dbraw/zinc/94/92/35/584949235.db2.gz ACHNHQVIYPHDJK-UHFFFAOYSA-N 1 1 233.355 3.803 20 0 BHADMO Cc1cccc(C[N@@H+](Cc2ccoc2)C2CC2)c1 ZINC000768252014 585534650 /nfs/dbraw/zinc/53/46/50/585534650.db2.gz GDYRJKONWHEQBM-UHFFFAOYSA-N 1 1 241.334 3.753 20 0 BHADMO Cc1ccc(C[N@@H+](Cc2ccoc2)C2CC2)cc1 ZINC000768252017 585534982 /nfs/dbraw/zinc/53/49/82/585534982.db2.gz GNQHTRSYWKJTPY-UHFFFAOYSA-N 1 1 241.334 3.753 20 0 BHADMO Cc1ccccc1C[N@@H+](Cc1ccoc1)C1CC1 ZINC000768252452 585534764 /nfs/dbraw/zinc/53/47/64/585534764.db2.gz LVLFTAYMJSMGTA-UHFFFAOYSA-N 1 1 241.334 3.753 20 0 BHADMO CC1CCC([N@@H+](Cc2ccoc2)C2CC2)CC1 ZINC000768252741 585534626 /nfs/dbraw/zinc/53/46/26/585534626.db2.gz OAGIJTHJUKHNCS-UHFFFAOYSA-N 1 1 233.355 3.823 20 0 BHADMO c1csc(C[N@@H+](Cc2ccoc2)C2CC2)c1 ZINC000768252772 585534610 /nfs/dbraw/zinc/53/46/10/585534610.db2.gz PCJRRVFZNQZWBV-UHFFFAOYSA-N 1 1 233.336 3.506 20 0 BHADMO CCC(CC)[N@@H+](Cc1coc(C2CC2)n1)C1CC1 ZINC000768256213 584949200 /nfs/dbraw/zinc/94/92/00/584949200.db2.gz ABEACYUFXLFBKG-UHFFFAOYSA-N 1 1 248.370 3.705 20 0 BHADMO CC(C)CC[N@@H+](Cc1coc(C2CC2)n1)C1CC1 ZINC000768258210 585534888 /nfs/dbraw/zinc/53/48/88/585534888.db2.gz UWYASVKBJCORLV-UHFFFAOYSA-N 1 1 248.370 3.563 20 0 BHADMO CC(C)CC[N@H+](Cc1coc(C2CC2)n1)C1CC1 ZINC000768258210 585534887 /nfs/dbraw/zinc/53/48/87/585534887.db2.gz UWYASVKBJCORLV-UHFFFAOYSA-N 1 1 248.370 3.563 20 0 BHADMO Fc1cccc(C[N@@H+](Cc2ccoc2)C2CC2)c1 ZINC000768258687 585534619 /nfs/dbraw/zinc/53/46/19/585534619.db2.gz VRSGPCZETWXTIJ-UHFFFAOYSA-N 1 1 245.297 3.583 20 0 BHADMO Fc1cccc(C[N@H+](Cc2ccoc2)C2CC2)c1 ZINC000768258687 585534618 /nfs/dbraw/zinc/53/46/18/585534618.db2.gz VRSGPCZETWXTIJ-UHFFFAOYSA-N 1 1 245.297 3.583 20 0 BHADMO Cc1ccc([C@@H](C)[N@@H+](C)Cc2ccoc2)cc1 ZINC000768261457 585534613 /nfs/dbraw/zinc/53/46/13/585534613.db2.gz CYWYTLKOJZQUEY-CYBMUJFWSA-N 1 1 229.323 3.781 20 0 BHADMO Cc1ccc([C@H](C)[N@@H+](C)Cc2ccoc2)cc1 ZINC000768261459 585534678 /nfs/dbraw/zinc/53/46/78/585534678.db2.gz CYWYTLKOJZQUEY-ZDUSSCGKSA-N 1 1 229.323 3.781 20 0 BHADMO CC(C)CC[N@@H+](C)Cc1cnc(C(C)C)s1 ZINC000768262221 585534896 /nfs/dbraw/zinc/53/48/96/585534896.db2.gz IBALMDLFUJGOGK-UHFFFAOYSA-N 1 1 240.416 3.744 20 0 BHADMO CCC1CCC([N@@H+](C)Cc2ccoc2)CC1 ZINC000768262354 585534726 /nfs/dbraw/zinc/53/47/26/585534726.db2.gz JDARTGHFVNFDMT-UHFFFAOYSA-N 1 1 221.344 3.680 20 0 BHADMO CC(C)CC[N@@H+](C)Cc1cncc2ccccc21 ZINC000768262969 585534941 /nfs/dbraw/zinc/53/49/41/585534941.db2.gz MVHDZMAZGKUFFI-UHFFFAOYSA-N 1 1 242.366 3.713 20 0 BHADMO Cc1cc(C[N@H+](C)Cc2cccc(C)c2)c(C)o1 ZINC000768263512 585534820 /nfs/dbraw/zinc/53/48/20/585534820.db2.gz SYBRWUAVHDQIKW-UHFFFAOYSA-N 1 1 243.350 3.837 20 0 BHADMO C[C@@H]1CCC[C@@H]([N@@H+](C)Cc2coc(C3CC3)n2)C1 ZINC000768263814 585534902 /nfs/dbraw/zinc/53/49/02/585534902.db2.gz WHSLVWJJJGQHRJ-BXUZGUMPSA-N 1 1 248.370 3.563 20 0 BHADMO C[C@H]1CCC[C@H]([N@@H+](C)Cc2coc(C3CC3)n2)C1 ZINC000768263815 585534730 /nfs/dbraw/zinc/53/47/30/585534730.db2.gz WHSLVWJJJGQHRJ-FZMZJTMJSA-N 1 1 248.370 3.563 20 0 BHADMO C[C@@H]1CCC[C@H]([N@@H+](C)Cc2coc(C3CC3)n2)C1 ZINC000768263816 585534861 /nfs/dbraw/zinc/53/48/61/585534861.db2.gz WHSLVWJJJGQHRJ-RISCZKNCSA-N 1 1 248.370 3.563 20 0 BHADMO C[C@H]1CCC[C@@H]([N@@H+](C)Cc2coc(C3CC3)n2)C1 ZINC000768263817 585534777 /nfs/dbraw/zinc/53/47/77/585534777.db2.gz WHSLVWJJJGQHRJ-SMDDNHRTSA-N 1 1 248.370 3.563 20 0 BHADMO Cc1cc(C[N@H+](C)CCC(C)C)cnc1Cl ZINC000768263830 585534607 /nfs/dbraw/zinc/53/46/07/585534607.db2.gz WUVJLZOLTIFCIL-UHFFFAOYSA-N 1 1 240.778 3.521 20 0 BHADMO CC(C)[C@@H](C)[N@@H+](C)Cc1cncc2ccccc21 ZINC000768267501 585535210 /nfs/dbraw/zinc/53/52/10/585535210.db2.gz AJDGRBQYTBLFCK-CYBMUJFWSA-N 1 1 242.366 3.711 20 0 BHADMO CC(C)[C@H](C)[N@@H+](C)Cc1cncc2ccccc21 ZINC000768267502 585535022 /nfs/dbraw/zinc/53/50/22/585535022.db2.gz AJDGRBQYTBLFCK-ZDUSSCGKSA-N 1 1 242.366 3.711 20 0 BHADMO Cc1cc(C[N@H+](C)[C@H](C)C(C)C)cnc1Cl ZINC000768267642 585535087 /nfs/dbraw/zinc/53/50/87/585535087.db2.gz BUKDMAVOIWVVKY-LLVKDONJSA-N 1 1 240.778 3.520 20 0 BHADMO Cc1cc(C[N@H+](C)[C@@H](C)C(C)C)cnc1Cl ZINC000768267644 585535127 /nfs/dbraw/zinc/53/51/27/585535127.db2.gz BUKDMAVOIWVVKY-NSHDSACASA-N 1 1 240.778 3.520 20 0 BHADMO c1coc(C[N@@H+](Cc2ccoc2)C2CCCC2)c1 ZINC000768270759 585535150 /nfs/dbraw/zinc/53/51/50/585535150.db2.gz YAFBPXLRISNQFQ-UHFFFAOYSA-N 1 1 245.322 3.817 20 0 BHADMO CCCC[N@@H+](Cc1cc(C)oc1C)C1CC1 ZINC000768291994 585535456 /nfs/dbraw/zinc/53/54/56/585535456.db2.gz TWNXVDGMRCHMET-UHFFFAOYSA-N 1 1 221.344 3.661 20 0 BHADMO CCC[N@@H+](Cc1cncc2ccccc21)C1CC1 ZINC000768292294 585535393 /nfs/dbraw/zinc/53/53/93/585535393.db2.gz YSPBAHBDXOYDLK-UHFFFAOYSA-N 1 1 240.350 3.609 20 0 BHADMO Cc1ccccc1[C@@H]1CCC[N@H+]1Cc1ccoc1 ZINC000768318013 585535932 /nfs/dbraw/zinc/53/59/32/585535932.db2.gz IVZHLTOISUBYBQ-INIZCTEOSA-N 1 1 241.334 3.925 20 0 BHADMO Cc1ccccc1[C@H]1CCC[N@H+]1Cc1ccoc1 ZINC000768318017 585535840 /nfs/dbraw/zinc/53/58/40/585535840.db2.gz IVZHLTOISUBYBQ-MRXNPFEDSA-N 1 1 241.334 3.925 20 0 BHADMO c1cc(C[N@H+]2CCC[C@H]2C2CCCCC2)co1 ZINC000768318047 585535799 /nfs/dbraw/zinc/53/57/99/585535799.db2.gz IYOJAEFDRIPYPH-HNNXBMFYSA-N 1 1 233.355 3.824 20 0 BHADMO c1cc(C[N@H+]2CCC[C@@H]2C2CCCCC2)co1 ZINC000768318053 585535832 /nfs/dbraw/zinc/53/58/32/585535832.db2.gz IYOJAEFDRIPYPH-OAHLLOKOSA-N 1 1 233.355 3.824 20 0 BHADMO CC(C)C[C@@H]1CCC[N@H+]1Cc1coc(C2CC2)n1 ZINC000768320466 585535819 /nfs/dbraw/zinc/53/58/19/585535819.db2.gz WIDUUPJXDURHLE-AWEZNQCLSA-N 1 1 248.370 3.563 20 0 BHADMO CC(C)C[C@H]1CCC[N@H+]1Cc1coc(C2CC2)n1 ZINC000768320468 585535790 /nfs/dbraw/zinc/53/57/90/585535790.db2.gz WIDUUPJXDURHLE-CQSZACIVSA-N 1 1 248.370 3.563 20 0 BHADMO Cc1cc(C[N@@H+]2CCC[C@H]2C(C)C)c(C)o1 ZINC000768321022 585535687 /nfs/dbraw/zinc/53/56/87/585535687.db2.gz ZIKAGQCRKGXBCH-AWEZNQCLSA-N 1 1 221.344 3.517 20 0 BHADMO Cc1cc(C[N@@H+]2CCC[C@@H]2C(C)C)c(C)o1 ZINC000768321025 585535728 /nfs/dbraw/zinc/53/57/28/585535728.db2.gz ZIKAGQCRKGXBCH-CQSZACIVSA-N 1 1 221.344 3.517 20 0 BHADMO CC(C)[N@@H+](Cc1ccoc1)Cc1cccc(F)c1 ZINC000768329465 585535891 /nfs/dbraw/zinc/53/58/91/585535891.db2.gz FQFNJHLCATZWKD-UHFFFAOYSA-N 1 1 247.313 3.829 20 0 BHADMO c1cc(C[N@H+]2CCC[C@@H]2c2ccsc2)co1 ZINC000768329472 585535755 /nfs/dbraw/zinc/53/57/55/585535755.db2.gz FSZMFOHHKFPTBR-CYBMUJFWSA-N 1 1 233.336 3.678 20 0 BHADMO c1cc(C[N@H+]2CCC[C@H]2c2ccsc2)co1 ZINC000768329474 585535936 /nfs/dbraw/zinc/53/59/36/585535936.db2.gz FSZMFOHHKFPTBR-ZDUSSCGKSA-N 1 1 233.336 3.678 20 0 BHADMO CC(C)[N@@H+](Cc1ccoc1)Cc1ccc(F)cc1 ZINC000768329899 585535768 /nfs/dbraw/zinc/53/57/68/585535768.db2.gz KDYRSSWIUFQMAH-UHFFFAOYSA-N 1 1 247.313 3.829 20 0 BHADMO Cc1cccc([C@@H]2CCC[N@H+]2Cc2ccoc2)c1 ZINC000768330466 585535896 /nfs/dbraw/zinc/53/58/96/585535896.db2.gz SRFFWJDNBFCUAX-INIZCTEOSA-N 1 1 241.334 3.925 20 0 BHADMO Cc1cccc([C@H]2CCC[N@H+]2Cc2ccoc2)c1 ZINC000768330467 585535667 /nfs/dbraw/zinc/53/56/67/585535667.db2.gz SRFFWJDNBFCUAX-MRXNPFEDSA-N 1 1 241.334 3.925 20 0 BHADMO Fc1cccc([C@@H]2CCC[N@H+]2Cc2ccoc2)c1 ZINC000768330531 585535614 /nfs/dbraw/zinc/53/56/14/585535614.db2.gz VBNLQNHNSFCDIU-HNNXBMFYSA-N 1 1 245.297 3.756 20 0 BHADMO Fc1cccc([C@H]2CCC[N@H+]2Cc2ccoc2)c1 ZINC000768330533 585535676 /nfs/dbraw/zinc/53/56/76/585535676.db2.gz VBNLQNHNSFCDIU-OAHLLOKOSA-N 1 1 245.297 3.756 20 0 BHADMO CC(C)[N@@H+](Cc1ccoc1)Cc1ccccc1F ZINC000768333614 585535637 /nfs/dbraw/zinc/53/56/37/585535637.db2.gz HONZVZAIKOYMAX-UHFFFAOYSA-N 1 1 247.313 3.829 20 0 BHADMO CC(C)[N@H+](Cc1ccoc1)Cc1ccccc1F ZINC000768333614 585535636 /nfs/dbraw/zinc/53/56/36/585535636.db2.gz HONZVZAIKOYMAX-UHFFFAOYSA-N 1 1 247.313 3.829 20 0 BHADMO CCCCC[N@@H+](Cc1ccoc1)C(C)C ZINC000768334181 585535858 /nfs/dbraw/zinc/53/58/58/585535858.db2.gz MWEOQLNYDANJGV-UHFFFAOYSA-N 1 1 209.333 3.680 20 0 BHADMO CC[N@@H+](Cc1cc(C)oc1C)C1CCCC1 ZINC000768334346 585535943 /nfs/dbraw/zinc/53/59/43/585535943.db2.gz FSVLLQAGPOHJMV-UHFFFAOYSA-N 1 1 221.344 3.661 20 0 BHADMO C[N@@H+](Cc1ccccc1-c1ccccc1)C1CC1 ZINC000768335410 585535630 /nfs/dbraw/zinc/53/56/30/585535630.db2.gz OLYALMRWLOIEAG-UHFFFAOYSA-N 1 1 237.346 3.948 20 0 BHADMO CC[N@H+](Cc1cncc2ccccc21)CC(C)C ZINC000768336329 585535660 /nfs/dbraw/zinc/53/56/60/585535660.db2.gz RRKGVOTZSUELPL-UHFFFAOYSA-N 1 1 242.366 3.713 20 0 BHADMO CC[N@H+](Cc1cnc(Cl)c(C)c1)CC(C)C ZINC000768336414 585535662 /nfs/dbraw/zinc/53/56/62/585535662.db2.gz TULRJYNXOZXWPN-UHFFFAOYSA-N 1 1 240.778 3.521 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)Cc1cncc2ccccc21 ZINC000768337765 585536072 /nfs/dbraw/zinc/53/60/72/585536072.db2.gz GHRCHGSZTIDYDV-CYBMUJFWSA-N 1 1 242.366 3.855 20 0 BHADMO CCC[C@H](C)[N@@H+](C)Cc1cncc2ccccc21 ZINC000768337766 585536013 /nfs/dbraw/zinc/53/60/13/585536013.db2.gz GHRCHGSZTIDYDV-ZDUSSCGKSA-N 1 1 242.366 3.855 20 0 BHADMO c1cc(C[N@@H+](C2CC2)C2CCCCC2)co1 ZINC000768338627 585536036 /nfs/dbraw/zinc/53/60/36/585536036.db2.gz PZVACSQWZZMOIZ-UHFFFAOYSA-N 1 1 219.328 3.577 20 0 BHADMO C[C@@H](c1cccs1)[N@@H+](C)Cc1ccoc1 ZINC000768418067 585538059 /nfs/dbraw/zinc/53/80/59/585538059.db2.gz SPKUIEGHHMTLAB-JTQLQIEISA-N 1 1 221.325 3.534 20 0 BHADMO C[C@H](c1cccs1)[N@@H+](C)Cc1ccoc1 ZINC000768418071 585538221 /nfs/dbraw/zinc/53/82/21/585538221.db2.gz SPKUIEGHHMTLAB-SNVBAGLBSA-N 1 1 221.325 3.534 20 0 BHADMO CC(C)[N@@H+](Cc1coc(C2CC2)n1)C1CCCC1 ZINC000768424063 585538383 /nfs/dbraw/zinc/53/83/83/585538383.db2.gz ALVHGFUEAJPGBI-UHFFFAOYSA-N 1 1 248.370 3.705 20 0 BHADMO CCC[N@@H+](Cc1ccoc1)Cc1ccc(F)cc1 ZINC000768468433 585539030 /nfs/dbraw/zinc/53/90/30/585539030.db2.gz ONYZHYPEWUGJKF-UHFFFAOYSA-N 1 1 247.313 3.831 20 0 BHADMO CCC[N@H+](Cc1ccc2c(c1)COC2)CC(C)C ZINC000768477419 585538942 /nfs/dbraw/zinc/53/89/42/585538942.db2.gz ATAKBRVZGCZWIJ-UHFFFAOYSA-N 1 1 247.382 3.585 20 0 BHADMO CCC[N@@H+](Cc1ccoc1)Cc1ccccc1F ZINC000768486821 585539297 /nfs/dbraw/zinc/53/92/97/585539297.db2.gz QETYLXPFTCOLEI-UHFFFAOYSA-N 1 1 247.313 3.831 20 0 BHADMO CCC[N@H+](Cc1ccoc1)Cc1ccccc1F ZINC000768486821 585539296 /nfs/dbraw/zinc/53/92/96/585539296.db2.gz QETYLXPFTCOLEI-UHFFFAOYSA-N 1 1 247.313 3.831 20 0 BHADMO CC(C)[N@@H+](Cc1nccc2ccccc21)C1CC1 ZINC000768520625 585539713 /nfs/dbraw/zinc/53/97/13/585539713.db2.gz NISFHQOJCHBISY-UHFFFAOYSA-N 1 1 240.350 3.608 20 0 BHADMO CC(C)[N@@H+](Cc1cncc2ccccc21)C1CC1 ZINC000768521459 585539624 /nfs/dbraw/zinc/53/96/24/585539624.db2.gz ZKFKMDSSTINTBD-UHFFFAOYSA-N 1 1 240.350 3.608 20 0 BHADMO CCC[N@@H+](CCc1cccs1)Cc1ccoc1 ZINC000768525326 585539666 /nfs/dbraw/zinc/53/96/66/585539666.db2.gz VUYFZQOTHFWKAH-UHFFFAOYSA-N 1 1 249.379 3.796 20 0 BHADMO CC[C@H]1Cc2ccccc2C[N@H+]1Cc1ccoc1 ZINC000768531514 585539864 /nfs/dbraw/zinc/53/98/64/585539864.db2.gz YRZFXJVZZBRKRZ-INIZCTEOSA-N 1 1 241.334 3.617 20 0 BHADMO CC[C@@H]1Cc2ccccc2C[N@H+]1Cc1ccoc1 ZINC000768531515 585539835 /nfs/dbraw/zinc/53/98/35/585539835.db2.gz YRZFXJVZZBRKRZ-MRXNPFEDSA-N 1 1 241.334 3.617 20 0 BHADMO Cc1cc(C[N@H+](CC(C)C)C2CC2)c(C)o1 ZINC000768532891 585540162 /nfs/dbraw/zinc/54/01/62/585540162.db2.gz QGAFRFGSVUYVSZ-UHFFFAOYSA-N 1 1 221.344 3.517 20 0 BHADMO Cc1cc(C[N@H+](C)[C@H](C)C(C)(C)C)c(C)o1 ZINC000768543486 585539823 /nfs/dbraw/zinc/53/98/23/585539823.db2.gz KXQNMCSPLBKCRO-GFCCVEGCSA-N 1 1 223.360 3.763 20 0 BHADMO Cc1cc(C[N@H+](C)[C@@H](C)C(C)(C)C)c(C)o1 ZINC000768543487 585539922 /nfs/dbraw/zinc/53/99/22/585539922.db2.gz KXQNMCSPLBKCRO-LBPRGKRZSA-N 1 1 223.360 3.763 20 0 BHADMO C[C@@H]([N@@H+](C)Cc1ccc2c(c1)COC2)C(C)(C)C ZINC000768544079 585540038 /nfs/dbraw/zinc/54/00/38/585540038.db2.gz OSIRCJWLJPPESQ-GFCCVEGCSA-N 1 1 247.382 3.583 20 0 BHADMO C[C@H]([N@@H+](C)Cc1ccc2c(c1)COC2)C(C)(C)C ZINC000768544080 585539852 /nfs/dbraw/zinc/53/98/52/585539852.db2.gz OSIRCJWLJPPESQ-LBPRGKRZSA-N 1 1 247.382 3.583 20 0 BHADMO CC(C)C[N@@H+](Cc1ccoc1)C1CCCC1 ZINC000768652197 585541569 /nfs/dbraw/zinc/54/15/69/585541569.db2.gz MBPBQMLMKPGMJN-UHFFFAOYSA-N 1 1 221.344 3.680 20 0 BHADMO Fc1ccccc1CC[N@H+]1CCC2(CCCC2)C1 ZINC000768663279 585541765 /nfs/dbraw/zinc/54/17/65/585541765.db2.gz KIXMRUMHUNKSRI-UHFFFAOYSA-N 1 1 247.357 3.634 20 0 BHADMO CC(C)C[N@@H+](Cc1ccoc1)Cc1ccccc1 ZINC000768670259 585541701 /nfs/dbraw/zinc/54/17/01/585541701.db2.gz OYLOWUQBAORGSX-UHFFFAOYSA-N 1 1 243.350 3.938 20 0 BHADMO Cc1cc(C[N@H+](CC2CC2)C(C)C)c(C)o1 ZINC000768672499 585541574 /nfs/dbraw/zinc/54/15/74/585541574.db2.gz FBRJKFLCOFJVLK-UHFFFAOYSA-N 1 1 221.344 3.517 20 0 BHADMO CC[C@H](C)C[N@@H+](C)Cc1cnc(Cl)c(C)c1 ZINC000768765311 585542711 /nfs/dbraw/zinc/54/27/11/585542711.db2.gz DCOPEMZOMPSMEI-JTQLQIEISA-N 1 1 240.778 3.521 20 0 BHADMO CC[C@@H](C)C[N@@H+](C)Cc1cnc(Cl)c(C)c1 ZINC000768765312 585542977 /nfs/dbraw/zinc/54/29/77/585542977.db2.gz DCOPEMZOMPSMEI-SNVBAGLBSA-N 1 1 240.778 3.521 20 0 BHADMO CC[C@@H](C)C[N@@H+](C)Cc1cncc2ccccc21 ZINC000768768880 585542692 /nfs/dbraw/zinc/54/26/92/585542692.db2.gz PFLOGZDSAYKGSF-CYBMUJFWSA-N 1 1 242.366 3.713 20 0 BHADMO CC[C@H](C)C[N@@H+](C)Cc1cncc2ccccc21 ZINC000768768883 585542843 /nfs/dbraw/zinc/54/28/43/585542843.db2.gz PFLOGZDSAYKGSF-ZDUSSCGKSA-N 1 1 242.366 3.713 20 0 BHADMO CC(C)C[N@@H+](Cc1ccc2c(c1)COC2)C(C)C ZINC000768780157 585543592 /nfs/dbraw/zinc/54/35/92/585543592.db2.gz LREMWOUJIJFXOJ-UHFFFAOYSA-N 1 1 247.382 3.583 20 0 BHADMO Cc1cc(C[N@H+](CC(C)C)C(C)C)c(C)o1 ZINC000768780420 585543390 /nfs/dbraw/zinc/54/33/90/585543390.db2.gz UXAKYCDNEOWTSB-UHFFFAOYSA-N 1 1 223.360 3.763 20 0 BHADMO Cc1[nH+]cn(Cc2ccc(Cl)cc2C)c1C ZINC000768804236 585543672 /nfs/dbraw/zinc/54/36/72/585543672.db2.gz RWLYRTYWEFFNNW-UHFFFAOYSA-N 1 1 234.730 3.510 20 0 BHADMO CCCc1[nH+]ccn1Cc1ccc(Cl)cc1C ZINC000768804605 585543627 /nfs/dbraw/zinc/54/36/27/585543627.db2.gz XFTSMCCZPGKWKQ-UHFFFAOYSA-N 1 1 248.757 3.846 20 0 BHADMO CC[C@@H]1CCC[N@@H+](Cc2cc(C)oc2C)C1 ZINC000768845275 585544478 /nfs/dbraw/zinc/54/44/78/585544478.db2.gz GTNLZQLWKXSLTB-CYBMUJFWSA-N 1 1 221.344 3.518 20 0 BHADMO CC[C@H]1CCC[N@@H+](Cc2cc(C)oc2C)C1 ZINC000768845277 585544465 /nfs/dbraw/zinc/54/44/65/585544465.db2.gz GTNLZQLWKXSLTB-ZDUSSCGKSA-N 1 1 221.344 3.518 20 0 BHADMO C[C@@H]1CC[N@@H+](Cc2ccoc2)[C@@H]2CCCC[C@H]12 ZINC000768848744 585544512 /nfs/dbraw/zinc/54/45/12/585544512.db2.gz DTXDDHLFDKSETA-BPLDGKMQSA-N 1 1 233.355 3.680 20 0 BHADMO C[C@@H]1CC[N@@H+](Cc2ccoc2)[C@H]2CCCC[C@@H]12 ZINC000768848749 585544594 /nfs/dbraw/zinc/54/45/94/585544594.db2.gz DTXDDHLFDKSETA-SNPRPXQTSA-N 1 1 233.355 3.680 20 0 BHADMO C[C@@H]1CC[N@@H+](Cc2ccoc2)[C@@H]2CCCC[C@@H]12 ZINC000768848754 585544743 /nfs/dbraw/zinc/54/47/43/585544743.db2.gz DTXDDHLFDKSETA-VHDGCEQUSA-N 1 1 233.355 3.680 20 0 BHADMO C[C@@H]1CC[N@@H+](Cc2ccoc2)[C@H]2CCCC[C@H]12 ZINC000768848758 585544801 /nfs/dbraw/zinc/54/48/01/585544801.db2.gz DTXDDHLFDKSETA-YUELXQCFSA-N 1 1 233.355 3.680 20 0 BHADMO c1cc(C[N@H+](CC2CCCCC2)C2CC2)co1 ZINC000768920379 585545985 /nfs/dbraw/zinc/54/59/85/585545985.db2.gz OECWIDNTBANEIL-UHFFFAOYSA-N 1 1 233.355 3.824 20 0 BHADMO C[N@@H+](Cc1cncc2ccccc21)CC(C)(C)C ZINC000768936628 585546428 /nfs/dbraw/zinc/54/64/28/585546428.db2.gz GHGARJPKQHOCRE-UHFFFAOYSA-N 1 1 242.366 3.713 20 0 BHADMO Cc1cc(C[N@H+](C)CC(C)(C)C)cnc1Cl ZINC000768937269 585545978 /nfs/dbraw/zinc/54/59/78/585545978.db2.gz OFXMTQQCBYWULQ-UHFFFAOYSA-N 1 1 240.778 3.521 20 0 BHADMO C[N@@H+](Cc1ccoc1)C1CCCCCCC1 ZINC000769005013 585547592 /nfs/dbraw/zinc/54/75/92/585547592.db2.gz LXKINKATARVENZ-UHFFFAOYSA-N 1 1 221.344 3.824 20 0 BHADMO CC[C@H]1CCC[N@H+]1Cc1cncc2ccccc21 ZINC000769005400 585547488 /nfs/dbraw/zinc/54/74/88/585547488.db2.gz CGRGDRGTJJFFSK-HNNXBMFYSA-N 1 1 240.350 3.609 20 0 BHADMO CC[C@@H]1CCC[N@H+]1Cc1cncc2ccccc21 ZINC000769005436 585547462 /nfs/dbraw/zinc/54/74/62/585547462.db2.gz CGRGDRGTJJFFSK-OAHLLOKOSA-N 1 1 240.350 3.609 20 0 BHADMO c1cc(C[N@@H+](Cc2ccsc2)C2CC2)co1 ZINC000769082511 585548681 /nfs/dbraw/zinc/54/86/81/585548681.db2.gz FGOBSYREPDDZCX-UHFFFAOYSA-N 1 1 233.336 3.506 20 0 BHADMO c1cc(C[N@H+](Cc2ccsc2)C2CC2)co1 ZINC000769082511 585548680 /nfs/dbraw/zinc/54/86/80/585548680.db2.gz FGOBSYREPDDZCX-UHFFFAOYSA-N 1 1 233.336 3.506 20 0 BHADMO CC1(C)C[N@@H+](Cc2ccoc2)[C@H]1c1ccccc1 ZINC000769085579 585548894 /nfs/dbraw/zinc/54/88/94/585548894.db2.gz KOBZIOJXZFWUNG-HNNXBMFYSA-N 1 1 241.334 3.863 20 0 BHADMO CC1(C)C[N@@H+](Cc2ccoc2)[C@@H]1c1ccccc1 ZINC000769085581 585548808 /nfs/dbraw/zinc/54/88/08/585548808.db2.gz KOBZIOJXZFWUNG-OAHLLOKOSA-N 1 1 241.334 3.863 20 0 BHADMO Cc1cc(C[N@H+]2CCC[C@@H]3CCC[C@H]32)c(C)o1 ZINC000769101774 585548839 /nfs/dbraw/zinc/54/88/39/585548839.db2.gz HKLOSJXAYOHUMD-DZGCQCFKSA-N 1 1 233.355 3.661 20 0 BHADMO Cc1cc(C[N@H+]2CCC[C@H]3CCC[C@@H]32)c(C)o1 ZINC000769101776 585548767 /nfs/dbraw/zinc/54/87/67/585548767.db2.gz HKLOSJXAYOHUMD-HIFRSBDPSA-N 1 1 233.355 3.661 20 0 BHADMO Cc1cc(C[N@H+]2CCC[C@H]3CCC[C@H]32)c(C)o1 ZINC000769101777 585548923 /nfs/dbraw/zinc/54/89/23/585548923.db2.gz HKLOSJXAYOHUMD-UKRRQHHQSA-N 1 1 233.355 3.661 20 0 BHADMO Cc1cc(C[N@H+]2CCC[C@@H]3CCC[C@@H]32)c(C)o1 ZINC000769101778 585548760 /nfs/dbraw/zinc/54/87/60/585548760.db2.gz HKLOSJXAYOHUMD-ZFWWWQNUSA-N 1 1 233.355 3.661 20 0 BHADMO Cc1cc(C[N@@H+]2CCC[C@@H](C)CC2)c(C)o1 ZINC000769148929 585549969 /nfs/dbraw/zinc/54/99/69/585549969.db2.gz VIDCTSQTOGDITH-LLVKDONJSA-N 1 1 221.344 3.518 20 0 BHADMO Cc1cc(C[N@@H+]2CCC[C@H](C)CC2)c(C)o1 ZINC000769148931 585550202 /nfs/dbraw/zinc/55/02/02/585550202.db2.gz VIDCTSQTOGDITH-NSHDSACASA-N 1 1 221.344 3.518 20 0 BHADMO CC[N@@H+](Cc1ccc2c(c1)COC2)[C@H](C)C(C)C ZINC000769151288 585550363 /nfs/dbraw/zinc/55/03/63/585550363.db2.gz FDDUOMCAKGHHEJ-CYBMUJFWSA-N 1 1 247.382 3.583 20 0 BHADMO CC[N@@H+](Cc1ccc2c(c1)COC2)[C@@H](C)C(C)C ZINC000769151290 585550335 /nfs/dbraw/zinc/55/03/35/585550335.db2.gz FDDUOMCAKGHHEJ-ZDUSSCGKSA-N 1 1 247.382 3.583 20 0 BHADMO CC[N@@H+](Cc1cc(C)oc1C)[C@H](C)C(C)C ZINC000769153855 585550259 /nfs/dbraw/zinc/55/02/59/585550259.db2.gz QNLVRXUMTWVSPU-GFCCVEGCSA-N 1 1 223.360 3.763 20 0 BHADMO CC[N@@H+](Cc1cc(C)oc1C)[C@@H](C)C(C)C ZINC000769153856 585550227 /nfs/dbraw/zinc/55/02/27/585550227.db2.gz QNLVRXUMTWVSPU-LBPRGKRZSA-N 1 1 223.360 3.763 20 0 BHADMO Cc1cc(C[N@@H+](C)CC2CCCC2)c(C)o1 ZINC000769191825 585551027 /nfs/dbraw/zinc/55/10/27/585551027.db2.gz ORUXIDBNOYEKLD-UHFFFAOYSA-N 1 1 221.344 3.518 20 0 BHADMO Cc1ncccc1C[N@H+](C)C1CCCCCCC1 ZINC000769223160 585551280 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585557474 /nfs/dbraw/zinc/55/74/74/585557474.db2.gz ISLJYFOSEIZOMC-AWEZNQCLSA-N 1 1 243.350 3.651 20 0 BHADMO Cc1ccc(C[C@@H](C)[N@@H+](C)Cc2ccoc2)cc1 ZINC000769462611 585557402 /nfs/dbraw/zinc/55/74/02/585557402.db2.gz ISLJYFOSEIZOMC-CQSZACIVSA-N 1 1 243.350 3.651 20 0 BHADMO CC[C@@H]1CCC[N@@H+](Cc2coc(C3CC3)n2)CC1 ZINC000769463940 585557638 /nfs/dbraw/zinc/55/76/38/585557638.db2.gz UQSMBTYOTGGJSC-GFCCVEGCSA-N 1 1 248.370 3.564 20 0 BHADMO CC[C@H]1CCC[N@@H+](Cc2coc(C3CC3)n2)CC1 ZINC000769463941 585557667 /nfs/dbraw/zinc/55/76/67/585557667.db2.gz UQSMBTYOTGGJSC-LBPRGKRZSA-N 1 1 248.370 3.564 20 0 BHADMO CC[N@@H+](Cc1cncc2ccccc21)C1CCC1 ZINC000769465723 585557451 /nfs/dbraw/zinc/55/74/51/585557451.db2.gz CFWWCNWKOXFVQR-UHFFFAOYSA-N 1 1 240.350 3.609 20 0 BHADMO CC[C@H](C)[C@H]1CCCC[N@H+]1Cc1ccoc1 ZINC000769466907 585558104 /nfs/dbraw/zinc/55/81/04/585558104.db2.gz OUHQITJXSPSHJK-GXTWGEPZSA-N 1 1 221.344 3.680 20 0 BHADMO CC[C@H](C)[C@@H]1CCCC[N@H+]1Cc1ccoc1 ZINC000769466908 585557996 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/nfs/dbraw/zinc/55/88/62/585558862.db2.gz RCHGKNHMFXILDI-CQSZACIVSA-N 1 1 221.344 3.518 20 0 BHADMO CC(C)C[N@@H+](Cc1ccoc1)CC(C)(C)C ZINC000769524075 585558868 /nfs/dbraw/zinc/55/88/68/585558868.db2.gz JEXRICZYPOICRH-UHFFFAOYSA-N 1 1 223.360 3.784 20 0 BHADMO C[C@H]1CC[N@@H+](Cc2ccoc2)[C@@H](c2ccco2)C1 ZINC000769527855 585558773 /nfs/dbraw/zinc/55/87/73/585558773.db2.gz SPCQDHYPNHASJT-GXTWGEPZSA-N 1 1 245.322 3.846 20 0 BHADMO C[C@@H]1CC[N@@H+](Cc2ccoc2)[C@@H](c2ccco2)C1 ZINC000769527856 585558852 /nfs/dbraw/zinc/55/88/52/585558852.db2.gz SPCQDHYPNHASJT-TZMCWYRMSA-N 1 1 245.322 3.846 20 0 BHADMO CC[C@@H](C)C[N@@H+](CC)Cc1ccc2c(c1)COC2 ZINC000769537624 585559179 /nfs/dbraw/zinc/55/91/79/585559179.db2.gz NCKUFLHNRDHNFS-CYBMUJFWSA-N 1 1 247.382 3.585 20 0 BHADMO CC[C@H](C)C[N@@H+](CC)Cc1ccc2c(c1)COC2 ZINC000769537626 585559164 /nfs/dbraw/zinc/55/91/64/585559164.db2.gz NCKUFLHNRDHNFS-ZDUSSCGKSA-N 1 1 247.382 3.585 20 0 BHADMO CC(C)CC[C@@H]1CCC[N@H+]1Cc1ccoc1 ZINC000769538052 585559062 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/nfs/dbraw/zinc/55/92/86/585559286.db2.gz LJFXFMNGFDHLLF-UHFFFAOYSA-N 1 1 248.276 3.690 20 0 BHADMO CCCCCC[N@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000769865038 585565461 /nfs/dbraw/zinc/56/54/61/585565461.db2.gz MDARWCAOCXXLEZ-LLVKDONJSA-N 1 1 237.309 3.841 20 0 BHADMO CCCCCC[N@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000769865039 585565530 /nfs/dbraw/zinc/56/55/30/585565530.db2.gz MDARWCAOCXXLEZ-NSHDSACASA-N 1 1 237.309 3.841 20 0 BHADMO CC(C)[N@H+](C/C(Cl)=C\Cl)CC1CCC1 ZINC000769929288 585566617 /nfs/dbraw/zinc/56/66/17/585566617.db2.gz XLJQZGLOZIQZML-IZZDOVSWSA-N 1 1 236.186 3.816 20 0 BHADMO CC(C)[N@H+](C/C(Cl)=C/Cl)CC1CCC1 ZINC000769929294 585566510 /nfs/dbraw/zinc/56/65/10/585566510.db2.gz XLJQZGLOZIQZML-WDZFZDKYSA-N 1 1 236.186 3.816 20 0 BHADMO CC(C)[N@@H+](CCC(=O)C(C)(C)C)CC1CCC1 ZINC000769929510 585566456 /nfs/dbraw/zinc/56/64/56/585566456.db2.gz ZPVZMMWBVMDZCQ-UHFFFAOYSA-N 1 1 239.403 3.502 20 0 BHADMO FCC[N@H+]1CCCC[C@@H]1c1cccc(Cl)c1 ZINC000770001798 585569090 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C[C@H](c1cccc(Cl)c1F)[N@H+]1CC[C@@H]2C[C@@H]21 ZINC000775645927 585682357 /nfs/dbraw/zinc/68/23/57/585682357.db2.gz COQGVEYGYNCEMD-LNLATYFQSA-N 1 1 239.721 3.634 20 0 BHADMO C[C@H](c1cccc(Cl)c1F)[N@@H+]1CC[C@@H]2C[C@@H]21 ZINC000775645927 585682356 /nfs/dbraw/zinc/68/23/56/585682356.db2.gz COQGVEYGYNCEMD-LNLATYFQSA-N 1 1 239.721 3.634 20 0 BHADMO C[C@H](c1cccc(Cl)c1F)[N@H+]1CC[C@H]2C[C@H]21 ZINC000775645930 585681736 /nfs/dbraw/zinc/68/17/36/585681736.db2.gz COQGVEYGYNCEMD-VDDIYKPWSA-N 1 1 239.721 3.634 20 0 BHADMO C[C@H](c1cccc(Cl)c1F)[N@@H+]1CC[C@H]2C[C@H]21 ZINC000775645930 585681735 /nfs/dbraw/zinc/68/17/35/585681735.db2.gz COQGVEYGYNCEMD-VDDIYKPWSA-N 1 1 239.721 3.634 20 0 BHADMO CC[N@@H+](CC(C)(C)c1ccccc1)C(C)C ZINC000775647971 585681619 /nfs/dbraw/zinc/68/16/19/585681619.db2.gz KJMKRDMFMCTPHS-UHFFFAOYSA-N 1 1 219.372 3.695 20 0 BHADMO C[C@@H]1CCCC[N@@H+](Cc2ccc(CF)cc2)C1 ZINC000775731145 585683898 /nfs/dbraw/zinc/68/38/98/585683898.db2.gz FTNJVCSFQCYGKC-CYBMUJFWSA-N 1 1 235.346 3.778 20 0 BHADMO C[C@H]1CCCC[N@@H+](Cc2ccc(CF)cc2)C1 ZINC000775731146 585683698 /nfs/dbraw/zinc/68/36/98/585683698.db2.gz FTNJVCSFQCYGKC-ZDUSSCGKSA-N 1 1 235.346 3.778 20 0 BHADMO CC[C@H]1[C@H](C)CC[N@H+]1Cc1ccc(CF)cc1 ZINC000775784396 585685008 /nfs/dbraw/zinc/68/50/08/585685008.db2.gz CZZYDJYJLNSVFF-DOMZBBRYSA-N 1 1 235.346 3.777 20 0 BHADMO CC[C@@H]1[C@H](C)CC[N@H+]1Cc1ccc(CF)cc1 ZINC000775784397 585684961 /nfs/dbraw/zinc/68/49/61/585684961.db2.gz CZZYDJYJLNSVFF-IUODEOHRSA-N 1 1 235.346 3.777 20 0 BHADMO CC[C@@H]1[C@@H](C)CC[N@H+]1Cc1ccc(CF)cc1 ZINC000775784398 585684914 /nfs/dbraw/zinc/68/49/14/585684914.db2.gz CZZYDJYJLNSVFF-SWLSCSKDSA-N 1 1 235.346 3.777 20 0 BHADMO CC[C@H]1[C@@H](C)CC[N@H+]1Cc1ccc(CF)cc1 ZINC000775784399 585684796 /nfs/dbraw/zinc/68/47/96/585684796.db2.gz CZZYDJYJLNSVFF-WFASDCNBSA-N 1 1 235.346 3.777 20 0 BHADMO CC[C@H]1[C@@H](C)CC[N@H+]1Cc1cc(C)oc1C ZINC000775999902 585689269 /nfs/dbraw/zinc/68/92/69/585689269.db2.gz ISPNSVDCQWYYDH-HZMBPMFUSA-N 1 1 221.344 3.517 20 0 BHADMO CC[C@@H]1[C@@H](C)CC[N@H+]1Cc1cc(C)oc1C ZINC000775999907 585689392 /nfs/dbraw/zinc/68/93/92/585689392.db2.gz ISPNSVDCQWYYDH-IINYFYTJSA-N 1 1 221.344 3.517 20 0 BHADMO CC[C@@H]1[C@H](C)CC[N@H+]1Cc1cc(C)oc1C ZINC000775999910 585689065 /nfs/dbraw/zinc/68/90/65/585689065.db2.gz ISPNSVDCQWYYDH-QMTHXVAHSA-N 1 1 221.344 3.517 20 0 BHADMO CC[C@H]1[C@H](C)CC[N@H+]1Cc1cc(C)oc1C ZINC000775999914 585689095 /nfs/dbraw/zinc/68/90/95/585689095.db2.gz ISPNSVDCQWYYDH-YGRLFVJLSA-N 1 1 221.344 3.517 20 0 BHADMO Cc1cc(C[N@@H+]2CCCC[C@@H](C)C2)c(C)o1 ZINC000776000515 585689293 /nfs/dbraw/zinc/68/92/93/585689293.db2.gz XZDYXGKRKMAMTQ-LLVKDONJSA-N 1 1 221.344 3.518 20 0 BHADMO Cc1cc(C[N@@H+]2CCCC[C@H](C)C2)c(C)o1 ZINC000776000525 585689056 /nfs/dbraw/zinc/68/90/56/585689056.db2.gz XZDYXGKRKMAMTQ-NSHDSACASA-N 1 1 221.344 3.518 20 0 BHADMO Cc1cc[nH+]c(N[C@@H](C)c2ccnc(Cl)c2)c1 ZINC000776772632 585705230 /nfs/dbraw/zinc/70/52/30/585705230.db2.gz QHVOZAGRKTZZGS-JTQLQIEISA-N 1 1 247.729 3.612 20 0 BHADMO Cc1cc[nH+]c(N[C@H](C)c2ccnc(Cl)c2)c1 ZINC000776772633 585705297 /nfs/dbraw/zinc/70/52/97/585705297.db2.gz QHVOZAGRKTZZGS-SNVBAGLBSA-N 1 1 247.729 3.612 20 0 BHADMO FCC[N@H+]1C[C@H](c2ccccc2)[C@@H]2CCCC[C@H]21 ZINC000776849874 585706356 /nfs/dbraw/zinc/70/63/56/585706356.db2.gz BLSLBILJQKBTDA-ARFHVFGLSA-N 1 1 247.357 3.614 20 0 BHADMO FCC[N@H+]1C[C@H](c2ccccc2)[C@H]2CCCC[C@H]21 ZINC000776849875 585706122 /nfs/dbraw/zinc/70/61/22/585706122.db2.gz BLSLBILJQKBTDA-BZUAXINKSA-N 1 1 247.357 3.614 20 0 BHADMO FCC[N@H+]1C[C@H](c2ccccc2)[C@H]2CCCC[C@@H]21 ZINC000776849876 585706273 /nfs/dbraw/zinc/70/62/73/585706273.db2.gz BLSLBILJQKBTDA-OAGGEKHMSA-N 1 1 247.357 3.614 20 0 BHADMO FCC[N@H+]1C[C@H](c2ccccc2)[C@@H]2CCCC[C@@H]21 ZINC000776849877 585706264 /nfs/dbraw/zinc/70/62/64/585706264.db2.gz BLSLBILJQKBTDA-XHSDSOJGSA-N 1 1 247.357 3.614 20 0 BHADMO C[C@H](C1CC1)[N@@H+]1CC=C(c2ccc(F)cc2)CC1 ZINC000777503305 585713741 /nfs/dbraw/zinc/71/37/41/585713741.db2.gz VNXGTXJZQJABIZ-GFCCVEGCSA-N 1 1 245.341 3.713 20 0 BHADMO C[C@@H](C1CC1)[N@@H+]1CC=C(c2ccc(F)cc2)CC1 ZINC000777503306 585713823 /nfs/dbraw/zinc/71/38/23/585713823.db2.gz VNXGTXJZQJABIZ-LBPRGKRZSA-N 1 1 245.341 3.713 20 0 BHADMO CCCC[N@@H+](CC)Cc1ccc(CF)cc1 ZINC000777534795 585714223 /nfs/dbraw/zinc/71/42/23/585714223.db2.gz HLVUTUQOEXVEKZ-UHFFFAOYSA-N 1 1 223.335 3.778 20 0 BHADMO CCC[N@H+](Cc1ccc(CF)cc1)CC1CC1 ZINC000777535367 585714435 /nfs/dbraw/zinc/71/44/35/585714435.db2.gz PLTFLCQWHCWAAR-UHFFFAOYSA-N 1 1 235.346 3.778 20 0 BHADMO C[C@@H]1CCCC[N@H+]1Cc1ccc(CF)cc1 ZINC000777540617 585714613 /nfs/dbraw/zinc/71/46/13/585714613.db2.gz AMWVFUPRQAUXBX-GFCCVEGCSA-N 1 1 221.319 3.531 20 0 BHADMO C[C@H]1CCCC[N@H+]1Cc1ccc(CF)cc1 ZINC000777540627 585714707 /nfs/dbraw/zinc/71/47/07/585714707.db2.gz AMWVFUPRQAUXBX-LBPRGKRZSA-N 1 1 221.319 3.531 20 0 BHADMO C[N@@H+](Cc1ccccc1)Cc1ccc(CF)cc1 ZINC000777540751 585714601 /nfs/dbraw/zinc/71/46/01/585714601.db2.gz AWQUIKPMBKBZKT-UHFFFAOYSA-N 1 1 243.325 3.788 20 0 BHADMO CC[C@@H]1CCC[N@@H+](Cc2ccc(CF)cc2)C1 ZINC000777543955 585714781 /nfs/dbraw/zinc/71/47/81/585714781.db2.gz HRZINGSIZGMMOP-CYBMUJFWSA-N 1 1 235.346 3.778 20 0 BHADMO CC[C@H]1CCC[N@@H+](Cc2ccc(CF)cc2)C1 ZINC000777543958 585714805 /nfs/dbraw/zinc/71/48/05/585714805.db2.gz HRZINGSIZGMMOP-ZDUSSCGKSA-N 1 1 235.346 3.778 20 0 BHADMO C[N@@H+](Cc1ccc(CF)cc1)C1CCCC1 ZINC000777544499 585714825 /nfs/dbraw/zinc/71/48/25/585714825.db2.gz LPZLGAUKFXEDSB-UHFFFAOYSA-N 1 1 221.319 3.531 20 0 BHADMO C[N@@H+](Cc1cccs1)Cc1ccc(CF)cc1 ZINC000777544517 585714843 /nfs/dbraw/zinc/71/48/43/585714843.db2.gz LXLXHDMLLKVNBJ-UHFFFAOYSA-N 1 1 249.354 3.850 20 0 BHADMO C[C@@H]1C[C@H](C)C[N@H+](Cc2ccc(CF)cc2)C1 ZINC000777544750 585714310 /nfs/dbraw/zinc/71/43/10/585714310.db2.gz UWJYCGXNYMVCCU-BETUJISGSA-N 1 1 235.346 3.634 20 0 BHADMO CC[C@H]1CCCC[N@H+]1Cc1ccc(CF)cc1 ZINC000777544777 585714928 /nfs/dbraw/zinc/71/49/28/585714928.db2.gz VHXKDWRFQUHPBA-HNNXBMFYSA-N 1 1 235.346 3.921 20 0 BHADMO CC[C@@H]1CCCC[N@H+]1Cc1ccc(CF)cc1 ZINC000777544778 585714994 /nfs/dbraw/zinc/71/49/94/585714994.db2.gz VHXKDWRFQUHPBA-OAHLLOKOSA-N 1 1 235.346 3.921 20 0 BHADMO C[N@@H+](Cc1ccc(CF)cc1)C1CCCCC1 ZINC000777545008 585714954 /nfs/dbraw/zinc/71/49/54/585714954.db2.gz VZIIJILQTUNPEU-UHFFFAOYSA-N 1 1 235.346 3.921 20 0 BHADMO Cc1ccc(C[N@H+](C)Cc2ccc(CF)cc2)o1 ZINC000777545222 585714830 /nfs/dbraw/zinc/71/48/30/585714830.db2.gz WUEUWCLCWNITLV-UHFFFAOYSA-N 1 1 247.313 3.690 20 0 BHADMO CC(C)[C@@H](C)[N@@H+](C)Cc1ccc(CF)cc1 ZINC000777545486 585714369 /nfs/dbraw/zinc/71/43/69/585714369.db2.gz SKFKRHUPHYFVOU-GFCCVEGCSA-N 1 1 223.335 3.632 20 0 BHADMO CC(C)[C@H](C)[N@@H+](C)Cc1ccc(CF)cc1 ZINC000777545488 585714243 /nfs/dbraw/zinc/71/42/43/585714243.db2.gz SKFKRHUPHYFVOU-LBPRGKRZSA-N 1 1 223.335 3.632 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)Cc1ccc(CF)cc1 ZINC000777551163 585714891 /nfs/dbraw/zinc/71/48/91/585714891.db2.gz ISOGYARNPHYJBF-GFCCVEGCSA-N 1 1 223.335 3.777 20 0 BHADMO CCC[C@H](C)[N@@H+](C)Cc1ccc(CF)cc1 ZINC000777551165 585714786 /nfs/dbraw/zinc/71/47/86/585714786.db2.gz ISOGYARNPHYJBF-LBPRGKRZSA-N 1 1 223.335 3.777 20 0 BHADMO C[N@@H+](Cc1ccsc1)Cc1ccc(CF)cc1 ZINC000777551579 585714773 /nfs/dbraw/zinc/71/47/73/585714773.db2.gz REUMJUIILWTQOW-UHFFFAOYSA-N 1 1 249.354 3.850 20 0 BHADMO CCCC[N@@H+](Cc1ccc(CF)cc1)C1CC1 ZINC000777555675 585715107 /nfs/dbraw/zinc/71/51/07/585715107.db2.gz PPAZOGVWPDXTPS-UHFFFAOYSA-N 1 1 235.346 3.921 20 0 BHADMO CC[N@H+](Cc1ccc(CF)cc1)CC(C)C ZINC000777556335 585715185 /nfs/dbraw/zinc/71/51/85/585715185.db2.gz WNBNUGFEPWLMIF-UHFFFAOYSA-N 1 1 223.335 3.634 20 0 BHADMO CC(C)C[N@@H+](Cc1ccc(CF)cc1)C1CC1 ZINC000777556581 585715182 /nfs/dbraw/zinc/71/51/82/585715182.db2.gz YCGDDJWMHPJBGB-UHFFFAOYSA-N 1 1 235.346 3.777 20 0 BHADMO CC(C)[N@@H+](Cc1ccc(CF)cc1)C1CC1 ZINC000777557522 585715068 /nfs/dbraw/zinc/71/50/68/585715068.db2.gz KHZYYMVMWWCKMW-UHFFFAOYSA-N 1 1 221.319 3.529 20 0 BHADMO C[C@H](C1CC1)[N@@H+](Cc1ccc(CF)cc1)C1CC1 ZINC000777558174 585715163 /nfs/dbraw/zinc/71/51/63/585715163.db2.gz RHAFOESCEUMSFA-GFCCVEGCSA-N 1 1 247.357 3.919 20 0 BHADMO C[C@@H](C1CC1)[N@@H+](Cc1ccc(CF)cc1)C1CC1 ZINC000777558175 585715395 /nfs/dbraw/zinc/71/53/95/585715395.db2.gz RHAFOESCEUMSFA-LBPRGKRZSA-N 1 1 247.357 3.919 20 0 BHADMO CC[N@@H+](Cc1ccc(CF)cc1)C1CCCC1 ZINC000777558234 585715241 /nfs/dbraw/zinc/71/52/41/585715241.db2.gz UPAWTMSQEZZQAD-UHFFFAOYSA-N 1 1 235.346 3.921 20 0 BHADMO CC(C)CC[N@@H+](C)Cc1ccc(CF)cc1 ZINC000777559277 585715420 /nfs/dbraw/zinc/71/54/20/585715420.db2.gz YVDWYRCOBMJLDZ-UHFFFAOYSA-N 1 1 223.335 3.634 20 0 BHADMO Cc1occc1C[N@H+](C)Cc1ccc(CF)cc1 ZINC000777559652 585715263 /nfs/dbraw/zinc/71/52/63/585715263.db2.gz IGZGUQHHQURADA-UHFFFAOYSA-N 1 1 247.313 3.690 20 0 BHADMO C[C@@H]1CCC[N@@H+](Cc2ccc(CF)cc2)CC1 ZINC000777561380 585715366 /nfs/dbraw/zinc/71/53/66/585715366.db2.gz IHZDKCUVEIPTBT-CYBMUJFWSA-N 1 1 235.346 3.778 20 0 BHADMO C[C@H]1CCC[N@@H+](Cc2ccc(CF)cc2)CC1 ZINC000777561383 585715360 /nfs/dbraw/zinc/71/53/60/585715360.db2.gz IHZDKCUVEIPTBT-ZDUSSCGKSA-N 1 1 235.346 3.778 20 0 BHADMO C[C@H](c1ccco1)[N@@H+](C)Cc1ccc(CF)cc1 ZINC000777563575 585715065 /nfs/dbraw/zinc/71/50/65/585715065.db2.gz LTJGPXNDRSXZPH-GFCCVEGCSA-N 1 1 247.313 3.942 20 0 BHADMO C[C@@H](c1ccco1)[N@@H+](C)Cc1ccc(CF)cc1 ZINC000777563576 585715092 /nfs/dbraw/zinc/71/50/92/585715092.db2.gz LTJGPXNDRSXZPH-LBPRGKRZSA-N 1 1 247.313 3.942 20 0 BHADMO CC(C)[C@@H]1CCC[N@H+]1Cc1ccc(CF)cc1 ZINC000777564297 585715025 /nfs/dbraw/zinc/71/50/25/585715025.db2.gz WLMONXYIDSZYSS-HNNXBMFYSA-N 1 1 235.346 3.777 20 0 BHADMO CC(C)[C@H]1CCC[N@H+]1Cc1ccc(CF)cc1 ZINC000777564299 585715332 /nfs/dbraw/zinc/71/53/32/585715332.db2.gz WLMONXYIDSZYSS-OAHLLOKOSA-N 1 1 235.346 3.777 20 0 BHADMO C[N@H+](Cc1ccc(CF)cc1)CC1CCCC1 ZINC000777566706 585715197 /nfs/dbraw/zinc/71/51/97/585715197.db2.gz MYZDHKVJUQPQKH-UHFFFAOYSA-N 1 1 235.346 3.778 20 0 BHADMO C[N@@H+](Cc1ccc(CF)cc1)C(C1CC1)C1CC1 ZINC000777567714 585715063 /nfs/dbraw/zinc/71/50/63/585715063.db2.gz XONZYNUGLWSTAQ-UHFFFAOYSA-N 1 1 247.357 3.777 20 0 BHADMO CC[N@@H+](Cc1ccoc1)Cc1ccc(CF)cc1 ZINC000777569896 585715758 /nfs/dbraw/zinc/71/57/58/585715758.db2.gz GLDKNCUOEJYRNE-UHFFFAOYSA-N 1 1 247.313 3.771 20 0 BHADMO C[N@@H+](Cc1ccc(CF)cc1)CC(C)(C)C ZINC000777569897 585715695 /nfs/dbraw/zinc/71/56/95/585715695.db2.gz GOKGFGGIMVBVBK-UHFFFAOYSA-N 1 1 223.335 3.634 20 0 BHADMO CC[C@H]1CCC[N@H+]1Cc1ccc(CF)cc1 ZINC000777572499 585715810 /nfs/dbraw/zinc/71/58/10/585715810.db2.gz KRLFIOLZNMRICL-AWEZNQCLSA-N 1 1 221.319 3.531 20 0 BHADMO CC[C@@H]1CCC[N@H+]1Cc1ccc(CF)cc1 ZINC000777572501 585715637 /nfs/dbraw/zinc/71/56/37/585715637.db2.gz KRLFIOLZNMRICL-CQSZACIVSA-N 1 1 221.319 3.531 20 0 BHADMO FCc1ccc(C[N@H+]2CCC[C@H]2C2CCC2)cc1 ZINC000777574608 585715684 /nfs/dbraw/zinc/71/56/84/585715684.db2.gz KQALMODYIAHVQZ-INIZCTEOSA-N 1 1 247.357 3.921 20 0 BHADMO FCc1ccc(C[N@H+]2CCC[C@@H]2C2CCC2)cc1 ZINC000777574609 585715706 /nfs/dbraw/zinc/71/57/06/585715706.db2.gz KQALMODYIAHVQZ-MRXNPFEDSA-N 1 1 247.357 3.921 20 0 BHADMO FCc1ccc(C[N@H+]2CCC[C@H]2C2CC2)cc1 ZINC000777577110 585715441 /nfs/dbraw/zinc/71/54/41/585715441.db2.gz BPJHQIDTEZPMLD-HNNXBMFYSA-N 1 1 233.330 3.531 20 0 BHADMO FCc1ccc(C[N@H+]2CCC[C@@H]2C2CC2)cc1 ZINC000777577111 585715532 /nfs/dbraw/zinc/71/55/32/585715532.db2.gz BPJHQIDTEZPMLD-OAHLLOKOSA-N 1 1 233.330 3.531 20 0 BHADMO CCC[N@@H+](Cc1ccc(CF)cc1)C1CC1 ZINC000777578104 585715639 /nfs/dbraw/zinc/71/56/39/585715639.db2.gz ILLOXCZUGGETNK-UHFFFAOYSA-N 1 1 221.319 3.531 20 0 BHADMO CC1(C)CCC[N@H+]1Cc1ccc(CF)cc1 ZINC000777578454 585715431 /nfs/dbraw/zinc/71/54/31/585715431.db2.gz IUVLMCIPXCLWTH-UHFFFAOYSA-N 1 1 221.319 3.531 20 0 BHADMO CC1(C)CCC[N@@H+](Cc2ccc(CF)cc2)C1 ZINC000777581165 585716199 /nfs/dbraw/zinc/71/61/99/585716199.db2.gz BMVOBSFKILRTBD-UHFFFAOYSA-N 1 1 235.346 3.778 20 0 BHADMO CC[C@@H](C)C[N@@H+](C)Cc1ccc(CF)cc1 ZINC000777583093 585716175 /nfs/dbraw/zinc/71/61/75/585716175.db2.gz MBMONDGRASEBJO-GFCCVEGCSA-N 1 1 223.335 3.634 20 0 BHADMO CC[C@H](C)C[N@@H+](C)Cc1ccc(CF)cc1 ZINC000777583095 585716111 /nfs/dbraw/zinc/71/61/11/585716111.db2.gz MBMONDGRASEBJO-LBPRGKRZSA-N 1 1 223.335 3.634 20 0 BHADMO C[C@@H]1CCC[C@H](C)[N@@H+]1Cc1ccc(CF)cc1 ZINC000777583151 585715892 /nfs/dbraw/zinc/71/58/92/585715892.db2.gz MUKJUMXNRZCBET-BETUJISGSA-N 1 1 235.346 3.919 20 0 BHADMO C[C@@H]1CCCCC[N@H+]1Cc1ccc(CF)cc1 ZINC000777583438 585715934 /nfs/dbraw/zinc/71/59/34/585715934.db2.gz BCHLPYXBMLLNSU-CYBMUJFWSA-N 1 1 235.346 3.921 20 0 BHADMO C[C@H]1CCCCC[N@H+]1Cc1ccc(CF)cc1 ZINC000777583439 585716105 /nfs/dbraw/zinc/71/61/05/585716105.db2.gz BCHLPYXBMLLNSU-ZDUSSCGKSA-N 1 1 235.346 3.921 20 0 BHADMO CC[N@@H+](Cc1ccc(CF)cc1)C1CCC1 ZINC000777587131 585715926 /nfs/dbraw/zinc/71/59/26/585715926.db2.gz AKVRPVLWXHWVDB-UHFFFAOYSA-N 1 1 221.319 3.531 20 0 BHADMO FCc1ccc(C[N@H+]2CCC[C@H]3CCC[C@@H]32)cc1 ZINC000777589517 585716594 /nfs/dbraw/zinc/71/65/94/585716594.db2.gz AFWWTRNIFNVOHO-CVEARBPZSA-N 1 1 247.357 3.921 20 0 BHADMO FCc1ccc(C[N@H+]2CCC[C@@H]3CCC[C@@H]32)cc1 ZINC000777589519 585716408 /nfs/dbraw/zinc/71/64/08/585716408.db2.gz AFWWTRNIFNVOHO-HOTGVXAUSA-N 1 1 247.357 3.921 20 0 BHADMO FCc1ccc(C[N@H+]2CCC[C@H]3CCC[C@H]32)cc1 ZINC000777589521 585716378 /nfs/dbraw/zinc/71/63/78/585716378.db2.gz AFWWTRNIFNVOHO-HZPDHXFCSA-N 1 1 247.357 3.921 20 0 BHADMO FCc1ccc(C[N@H+]2CCC[C@@H]3CCC[C@H]32)cc1 ZINC000777589522 585716575 /nfs/dbraw/zinc/71/65/75/585716575.db2.gz AFWWTRNIFNVOHO-JKSUJKDBSA-N 1 1 247.357 3.921 20 0 BHADMO C[C@@H]1CCC[N@@H+](Cc2ccc(CF)cc2)[C@@H]1C ZINC000777590019 585716556 /nfs/dbraw/zinc/71/65/56/585716556.db2.gz FWJBZFANYXMBAA-CHWSQXEVSA-N 1 1 235.346 3.777 20 0 BHADMO C[C@@H]1CCC[N@@H+](Cc2ccc(CF)cc2)[C@H]1C ZINC000777590346 585716461 /nfs/dbraw/zinc/71/64/61/585716461.db2.gz FWJBZFANYXMBAA-OLZOCXBDSA-N 1 1 235.346 3.777 20 0 BHADMO C[C@@H]1[C@@H](C)CCC[N@H+]1Cc1ccc(CF)cc1 ZINC000777590348 585716362 /nfs/dbraw/zinc/71/63/62/585716362.db2.gz FWJBZFANYXMBAA-QWHCGFSZSA-N 1 1 235.346 3.777 20 0 BHADMO C[C@H]1CCC[N@@H+](Cc2ccc(CF)cc2)[C@H]1C ZINC000777590350 585716476 /nfs/dbraw/zinc/71/64/76/585716476.db2.gz FWJBZFANYXMBAA-STQMWFEESA-N 1 1 235.346 3.777 20 0 BHADMO C[C@@H]1CC[C@@H](C)[N@@H+](Cc2ccc(CF)cc2)C1 ZINC000777593245 585716570 /nfs/dbraw/zinc/71/65/70/585716570.db2.gz AXUZXOITKWQBRI-CHWSQXEVSA-N 1 1 235.346 3.777 20 0 BHADMO C[C@@H]1CC[C@H](C)[N@@H+](Cc2ccc(CF)cc2)C1 ZINC000777593246 585716445 /nfs/dbraw/zinc/71/64/45/585716445.db2.gz AXUZXOITKWQBRI-OLZOCXBDSA-N 1 1 235.346 3.777 20 0 BHADMO C[C@@H]1CC[C@H](C)C[N@@H+]1Cc1ccc(CF)cc1 ZINC000777593247 585716626 /nfs/dbraw/zinc/71/66/26/585716626.db2.gz AXUZXOITKWQBRI-QWHCGFSZSA-N 1 1 235.346 3.777 20 0 BHADMO C[C@H]1CC[C@H](C)[N@@H+](Cc2ccc(CF)cc2)C1 ZINC000777593248 585716443 /nfs/dbraw/zinc/71/64/43/585716443.db2.gz AXUZXOITKWQBRI-STQMWFEESA-N 1 1 235.346 3.777 20 0 BHADMO CC[C@H]1C[C@@H](C)C[N@H+]1Cc1ccc(CF)cc1 ZINC000777594477 585716337 /nfs/dbraw/zinc/71/63/37/585716337.db2.gz HGLDBPKMACIQEU-DOMZBBRYSA-N 1 1 235.346 3.777 20 0 BHADMO CC[C@@H]1C[C@@H](C)C[N@H+]1Cc1ccc(CF)cc1 ZINC000777594478 585716581 /nfs/dbraw/zinc/71/65/81/585716581.db2.gz HGLDBPKMACIQEU-IUODEOHRSA-N 1 1 235.346 3.777 20 0 BHADMO CC[C@@H]1C[C@H](C)C[N@H+]1Cc1ccc(CF)cc1 ZINC000777594479 585716376 /nfs/dbraw/zinc/71/63/76/585716376.db2.gz HGLDBPKMACIQEU-SWLSCSKDSA-N 1 1 235.346 3.777 20 0 BHADMO CC[C@H]1C[C@H](C)C[N@H+]1Cc1ccc(CF)cc1 ZINC000777594480 585716631 /nfs/dbraw/zinc/71/66/31/585716631.db2.gz HGLDBPKMACIQEU-WFASDCNBSA-N 1 1 235.346 3.777 20 0 BHADMO C[C@H]1C[N@@H+](Cc2ccc(CF)cc2)C(C)(C)C1 ZINC000777594648 585716495 /nfs/dbraw/zinc/71/64/95/585716495.db2.gz JMPAQRLJNICFER-GFCCVEGCSA-N 1 1 235.346 3.777 20 0 BHADMO C[C@@H]1C[N@@H+](Cc2ccc(CF)cc2)C(C)(C)C1 ZINC000777594651 585716414 /nfs/dbraw/zinc/71/64/14/585716414.db2.gz JMPAQRLJNICFER-LBPRGKRZSA-N 1 1 235.346 3.777 20 0 BHADMO FCc1ccc(C[N@H+]2CCC3(CCCC3)C2)cc1 ZINC000777595564 585716505 /nfs/dbraw/zinc/71/65/05/585716505.db2.gz YSGBAQDRLDAQNH-UHFFFAOYSA-N 1 1 247.357 3.922 20 0 BHADMO FCc1ccc(C[N@@H+]2C[C@@H]3CCCC[C@@H]3C2)cc1 ZINC000777597773 585716754 /nfs/dbraw/zinc/71/67/54/585716754.db2.gz GJMAHMRKCJKYLO-IYBDPMFKSA-N 1 1 247.357 3.778 20 0 BHADMO CC[C@@]1(C)CC[N@@H+](Cc2ccc(CF)cc2)C1 ZINC000777599223 585716990 /nfs/dbraw/zinc/71/69/90/585716990.db2.gz GGPZXEKYSPLPTC-HNNXBMFYSA-N 1 1 235.346 3.778 20 0 BHADMO CC[C@]1(C)CC[N@@H+](Cc2ccc(CF)cc2)C1 ZINC000777599227 585716994 /nfs/dbraw/zinc/71/69/94/585716994.db2.gz GGPZXEKYSPLPTC-OAHLLOKOSA-N 1 1 235.346 3.778 20 0 BHADMO CC(C)[C@H]1CC[N@@H+](Cc2ccc(CF)cc2)C1 ZINC000777601089 585716658 /nfs/dbraw/zinc/71/66/58/585716658.db2.gz VECXITXYIMWHMU-HNNXBMFYSA-N 1 1 235.346 3.634 20 0 BHADMO CC(C)[C@@H]1CC[N@@H+](Cc2ccc(CF)cc2)C1 ZINC000777601092 585716666 /nfs/dbraw/zinc/71/66/66/585716666.db2.gz VECXITXYIMWHMU-OAHLLOKOSA-N 1 1 235.346 3.634 20 0 BHADMO C[C@@H]1CC[C@H](C)[N@@H+]1Cc1ccc(CF)cc1 ZINC000777601130 585716692 /nfs/dbraw/zinc/71/66/92/585716692.db2.gz VPUQUFUFUPQKGW-TXEJJXNPSA-N 1 1 221.319 3.529 20 0 BHADMO FCc1ccc(C[N@H+]2CCC3(CCC3)C2)cc1 ZINC000777601361 585715490 /nfs/dbraw/zinc/71/54/90/585715490.db2.gz XLMCIQWOWPPQGF-UHFFFAOYSA-N 1 1 233.330 3.532 20 0 BHADMO C[C@@H]([N@@H+](C)Cc1ccc(CF)cc1)C1(C)CC1 ZINC000777601897 585716821 /nfs/dbraw/zinc/71/68/21/585716821.db2.gz ZOFXVCNGPBJPRP-GFCCVEGCSA-N 1 1 235.346 3.777 20 0 BHADMO C[C@H]([N@@H+](C)Cc1ccc(CF)cc1)C1(C)CC1 ZINC000777601898 585716958 /nfs/dbraw/zinc/71/69/58/585716958.db2.gz ZOFXVCNGPBJPRP-LBPRGKRZSA-N 1 1 235.346 3.777 20 0 BHADMO CC(C)[N@H+](Cc1ccc(CF)cc1)CC1CC1 ZINC000777605726 585716664 /nfs/dbraw/zinc/71/66/64/585716664.db2.gz WIDMAAHISUAEOX-UHFFFAOYSA-N 1 1 235.346 3.777 20 0 BHADMO CCC(C)(C)[N@@H+](C)Cc1ccc(CF)cc1 ZINC000777615705 585717043 /nfs/dbraw/zinc/71/70/43/585717043.db2.gz NSYAHZYRIGOMHW-UHFFFAOYSA-N 1 1 223.335 3.777 20 0 BHADMO CC(C)[N@@H+](Cc1ccc(CF)cc1)C1CCC1 ZINC000777621414 585717089 /nfs/dbraw/zinc/71/70/89/585717089.db2.gz YEOHBIRVSHFIGA-UHFFFAOYSA-N 1 1 235.346 3.919 20 0 BHADMO Cc1cc([NH2+][C@H](C)C(C)(C)C)ccc1N(C)C ZINC000777642744 585717902 /nfs/dbraw/zinc/71/79/02/585717902.db2.gz DBGQQEGTHOMSIQ-GFCCVEGCSA-N 1 1 234.387 3.908 20 0 BHADMO Cc1cc([NH2+][C@@H](C)C(C)(C)C)ccc1N(C)C ZINC000777642748 585717888 /nfs/dbraw/zinc/71/78/88/585717888.db2.gz DBGQQEGTHOMSIQ-LBPRGKRZSA-N 1 1 234.387 3.908 20 0 BHADMO Cc1cc([NH2+][C@H](C)C2CCC2)ccc1N(C)C ZINC000777643427 585717668 /nfs/dbraw/zinc/71/76/68/585717668.db2.gz OCNQKGCTEFGXPB-GFCCVEGCSA-N 1 1 232.371 3.662 20 0 BHADMO Cc1cc([NH2+][C@@H](C)C2CCC2)ccc1N(C)C ZINC000777643428 585717806 /nfs/dbraw/zinc/71/78/06/585717806.db2.gz OCNQKGCTEFGXPB-LBPRGKRZSA-N 1 1 232.371 3.662 20 0 BHADMO CCC[N@@H+](C)[C@@H]1CCc2cc(Cl)ccc21 ZINC000777644575 585717737 /nfs/dbraw/zinc/71/77/37/585717737.db2.gz INHRGRZAEKQWAN-CYBMUJFWSA-N 1 1 223.747 3.669 20 0 BHADMO CCC[N@@H+](C)[C@H]1CCc2cc(Cl)ccc21 ZINC000777644582 585717905 /nfs/dbraw/zinc/71/79/05/585717905.db2.gz INHRGRZAEKQWAN-ZDUSSCGKSA-N 1 1 223.747 3.669 20 0 BHADMO CC(C)[C@@H](C)[NH2+]c1ccc2c(c1)CCCN2C ZINC000777657523 585718298 /nfs/dbraw/zinc/71/82/98/585718298.db2.gz RMLMTFYFOFNZPB-GFCCVEGCSA-N 1 1 232.371 3.525 20 0 BHADMO CC(C)[C@H](C)[NH2+]c1ccc2c(c1)CCCN2C ZINC000777657526 585718343 /nfs/dbraw/zinc/71/83/43/585718343.db2.gz RMLMTFYFOFNZPB-LBPRGKRZSA-N 1 1 232.371 3.525 20 0 BHADMO C[C@@H]1CC[N@@H+](Cc2ccc(CF)cc2)C[C@H]1C ZINC000777715564 712416274 /nfs/dbraw/zinc/41/62/74/712416274.db2.gz BZWYPPKUWRSLDP-CHWSQXEVSA-N 1 1 235.346 3.634 20 0 BHADMO C[C@@H]1CC[N@@H+](Cc2ccc(CF)cc2)C[C@@H]1C ZINC000777715565 712416284 /nfs/dbraw/zinc/41/62/84/712416284.db2.gz BZWYPPKUWRSLDP-OLZOCXBDSA-N 1 1 235.346 3.634 20 0 BHADMO C[C@H]1CC[N@@H+](Cc2ccc(CF)cc2)C[C@H]1C ZINC000777715566 585718493 /nfs/dbraw/zinc/71/84/93/585718493.db2.gz BZWYPPKUWRSLDP-QWHCGFSZSA-N 1 1 235.346 3.634 20 0 BHADMO C[C@H]1C[N@H+](Cc2ccc(CF)cc2)CC[C@@H]1C ZINC000777715567 585718711 /nfs/dbraw/zinc/71/87/11/585718711.db2.gz BZWYPPKUWRSLDP-STQMWFEESA-N 1 1 235.346 3.634 20 0 BHADMO CC[C@H]1CC[C@@H](C)[N@H+]1Cc1ccc(CF)cc1 ZINC000777719295 585719228 /nfs/dbraw/zinc/71/92/28/585719228.db2.gz BDPIPOPODVDEIL-DOMZBBRYSA-N 1 1 235.346 3.919 20 0 BHADMO CC[C@@H]1CC[C@@H](C)[N@H+]1Cc1ccc(CF)cc1 ZINC000777719298 585719433 /nfs/dbraw/zinc/71/94/33/585719433.db2.gz BDPIPOPODVDEIL-IUODEOHRSA-N 1 1 235.346 3.919 20 0 BHADMO CC[C@@H]1CC[C@H](C)[N@H+]1Cc1ccc(CF)cc1 ZINC000777719299 585719388 /nfs/dbraw/zinc/71/93/88/585719388.db2.gz BDPIPOPODVDEIL-SWLSCSKDSA-N 1 1 235.346 3.919 20 0 BHADMO CC[C@H]1CC[C@H](C)[N@H+]1Cc1ccc(CF)cc1 ZINC000777719301 585719368 /nfs/dbraw/zinc/71/93/68/585719368.db2.gz BDPIPOPODVDEIL-WFASDCNBSA-N 1 1 235.346 3.919 20 0 BHADMO C[N@@H+](CC1CC1)[C@H]1CCc2cc(Cl)ccc21 ZINC000777870638 585721936 /nfs/dbraw/zinc/72/19/36/585721936.db2.gz QPMSDJVDAVXEKD-AWEZNQCLSA-N 1 1 235.758 3.669 20 0 BHADMO C[N@@H+](CC1CC1)[C@@H]1CCc2cc(Cl)ccc21 ZINC000777870641 585721547 /nfs/dbraw/zinc/72/15/47/585721547.db2.gz QPMSDJVDAVXEKD-CQSZACIVSA-N 1 1 235.758 3.669 20 0 BHADMO Cc1ccccc1C[C@H](C)[N@@H+](C)Cc1ccoc1 ZINC000777910387 585723658 /nfs/dbraw/zinc/72/36/58/585723658.db2.gz IGUASJKBZSGLEI-AWEZNQCLSA-N 1 1 243.350 3.651 20 0 BHADMO Cc1ccccc1C[C@@H](C)[N@@H+](C)Cc1ccoc1 ZINC000777910388 585723776 /nfs/dbraw/zinc/72/37/76/585723776.db2.gz IGUASJKBZSGLEI-CQSZACIVSA-N 1 1 243.350 3.651 20 0 BHADMO C[C@H](C1CCCCC1)[N@@H+](C)Cc1ccoc1 ZINC000777920695 585723845 /nfs/dbraw/zinc/72/38/45/585723845.db2.gz RIRQEVVVUAFNTB-GFCCVEGCSA-N 1 1 221.344 3.680 20 0 BHADMO C[C@H]1CC[N@H+]([C@H]2CCc3cc(Cl)ccc32)C1 ZINC000777948982 585724121 /nfs/dbraw/zinc/72/41/21/585724121.db2.gz DWKCJYHPUYITAL-HZMBPMFUSA-N 1 1 235.758 3.669 20 0 BHADMO C[C@H]1CC[N@H+]([C@@H]2CCc3cc(Cl)ccc32)C1 ZINC000777948983 585724210 /nfs/dbraw/zinc/72/42/10/585724210.db2.gz DWKCJYHPUYITAL-IINYFYTJSA-N 1 1 235.758 3.669 20 0 BHADMO C[C@@H]1CC[N@H+]([C@@H]2CCc3cc(Cl)ccc32)C1 ZINC000777948985 585724309 /nfs/dbraw/zinc/72/43/09/585724309.db2.gz DWKCJYHPUYITAL-QMTHXVAHSA-N 1 1 235.758 3.669 20 0 BHADMO C[C@@H]1CC[N@H+]([C@H]2CCc3cc(Cl)ccc32)C1 ZINC000777948987 585724293 /nfs/dbraw/zinc/72/42/93/585724293.db2.gz DWKCJYHPUYITAL-YGRLFVJLSA-N 1 1 235.758 3.669 20 0 BHADMO CC(C)CCC[N@@H+](C)Cc1ccc(Cl)nc1 ZINC000778360723 585732118 /nfs/dbraw/zinc/73/21/18/585732118.db2.gz SAQISVDHOJGVSV-UHFFFAOYSA-N 1 1 240.778 3.603 20 0 BHADMO Fc1ccc(C[N@@H+](C2CC2)C2CCCCC2)cn1 ZINC000779153732 585746123 /nfs/dbraw/zinc/74/61/23/585746123.db2.gz JZCZAUSKXQPNRL-UHFFFAOYSA-N 1 1 248.345 3.518 20 0 BHADMO C[C@H]1C[N@@H+](CCC(F)(F)F)Cc2ccccc21 ZINC000779459968 585755249 /nfs/dbraw/zinc/75/52/49/585755249.db2.gz JBHHMPVTSBSSMI-JTQLQIEISA-N 1 1 243.272 3.558 20 0 BHADMO C[C@@H]1C[N@@H+](CCC(F)(F)F)Cc2ccccc21 ZINC000779459972 585755383 /nfs/dbraw/zinc/75/53/83/585755383.db2.gz JBHHMPVTSBSSMI-SNVBAGLBSA-N 1 1 243.272 3.558 20 0 BHADMO CCCCC[N@@H+]1Cc2ccccc2[C@H](C)C1 ZINC000779460228 585755344 /nfs/dbraw/zinc/75/53/44/585755344.db2.gz MINRNSGDGDFZPH-CYBMUJFWSA-N 1 1 217.356 3.796 20 0 BHADMO CCCCC[N@@H+]1Cc2ccccc2[C@@H](C)C1 ZINC000779460250 585755226 /nfs/dbraw/zinc/75/52/26/585755226.db2.gz MINRNSGDGDFZPH-ZDUSSCGKSA-N 1 1 217.356 3.796 20 0 BHADMO Cc1ccc(NCc2ccc(Cl)c(C)c2)[nH+]c1 ZINC000779743066 585760477 /nfs/dbraw/zinc/76/04/77/585760477.db2.gz OTENEZWHFHVMJW-UHFFFAOYSA-N 1 1 246.741 3.964 20 0 BHADMO CC(C)c1[nH+]ccn1Cc1ccc(CF)cc1 ZINC000779774393 585762235 /nfs/dbraw/zinc/76/22/35/585762235.db2.gz WCHOLCUADOPKNQ-UHFFFAOYSA-N 1 1 232.302 3.524 20 0 BHADMO CC1(C)CCC[N@H+]1C[C@@H]1CCc2ccccc21 ZINC000780283906 585776925 /nfs/dbraw/zinc/77/69/25/585776925.db2.gz BDULLXLPSLUDEO-AWEZNQCLSA-N 1 1 229.367 3.591 20 0 BHADMO CC1(C)CCC[N@H+]1C[C@H]1CCc2ccccc21 ZINC000780283918 585776920 /nfs/dbraw/zinc/77/69/20/585776920.db2.gz BDULLXLPSLUDEO-CQSZACIVSA-N 1 1 229.367 3.591 20 0 BHADMO CC(C)[N@@H+](C[C@@H]1CCc2ccccc21)C1CC1 ZINC000780285687 585776726 /nfs/dbraw/zinc/77/67/26/585776726.db2.gz KMWUGUSLZFBURH-AWEZNQCLSA-N 1 1 229.367 3.589 20 0 BHADMO CC(C)[N@@H+](C[C@H]1CCc2ccccc21)C1CC1 ZINC000780285690 582827228 /nfs/dbraw/zinc/82/72/28/582827228.db2.gz KMWUGUSLZFBURH-CQSZACIVSA-N 1 1 229.367 3.589 20 0 BHADMO CC[N@@H+](C[C@@H]1CCc2ccccc21)C1CCC1 ZINC000780289759 585777022 /nfs/dbraw/zinc/77/70/22/585777022.db2.gz GFPKMLCWJCCYBN-AWEZNQCLSA-N 1 1 229.367 3.591 20 0 BHADMO CC[N@@H+](C[C@H]1CCc2ccccc21)C1CCC1 ZINC000780289760 585776944 /nfs/dbraw/zinc/77/69/44/585776944.db2.gz GFPKMLCWJCCYBN-CQSZACIVSA-N 1 1 229.367 3.591 20 0 BHADMO C[C@H]1CCCC[N@H+]1C[C@H]1CCc2ccccc21 ZINC000780289813 585776818 /nfs/dbraw/zinc/77/68/18/585776818.db2.gz UFJZNJRANRTZNP-DZGCQCFKSA-N 1 1 229.367 3.591 20 0 BHADMO C[C@@H]1CCCC[N@H+]1C[C@@H]1CCc2ccccc21 ZINC000780289814 585777032 /nfs/dbraw/zinc/77/70/32/585777032.db2.gz UFJZNJRANRTZNP-HIFRSBDPSA-N 1 1 229.367 3.591 20 0 BHADMO C[C@@H]1CCCC[N@H+]1C[C@H]1CCc2ccccc21 ZINC000780289815 585776946 /nfs/dbraw/zinc/77/69/46/585776946.db2.gz UFJZNJRANRTZNP-UKRRQHHQSA-N 1 1 229.367 3.591 20 0 BHADMO C[C@H]1CCCC[N@H+]1C[C@@H]1CCc2ccccc21 ZINC000780290212 585776754 /nfs/dbraw/zinc/77/67/54/585776754.db2.gz UFJZNJRANRTZNP-ZFWWWQNUSA-N 1 1 229.367 3.591 20 0 BHADMO CC[C@H]1CCC[N@H+]1C[C@H]1CCc2ccccc21 ZINC000780293289 585777128 /nfs/dbraw/zinc/77/71/28/585777128.db2.gz QYUADCLLKRKJLK-CABCVRRESA-N 1 1 229.367 3.591 20 0 BHADMO CC[C@H]1CCC[N@H+]1C[C@@H]1CCc2ccccc21 ZINC000780293290 585777194 /nfs/dbraw/zinc/77/71/94/585777194.db2.gz QYUADCLLKRKJLK-GJZGRUSLSA-N 1 1 229.367 3.591 20 0 BHADMO CC[C@@H]1CCC[N@H+]1C[C@H]1CCc2ccccc21 ZINC000780293291 585777293 /nfs/dbraw/zinc/77/72/93/585777293.db2.gz QYUADCLLKRKJLK-HUUCEWRRSA-N 1 1 229.367 3.591 20 0 BHADMO CC[C@@H]1CCC[N@H+]1C[C@@H]1CCc2ccccc21 ZINC000780293293 585777299 /nfs/dbraw/zinc/77/72/99/585777299.db2.gz QYUADCLLKRKJLK-LSDHHAIUSA-N 1 1 229.367 3.591 20 0 BHADMO CCC[N@@H+](C[C@@H]1CCc2ccccc21)C1CC1 ZINC000780294155 585777092 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C[C@H](C1CC1)[N@H+]1CC[C@H](c2ccc(Cl)cc2)C1 ZINC000782183159 585810850 /nfs/dbraw/zinc/81/08/50/585810850.db2.gz WADWQZFEQNWEHN-RISCZKNCSA-N 1 1 249.785 3.928 20 0 BHADMO C[C@@H](C1CC1)[N@H+]1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC000782183161 585810830 /nfs/dbraw/zinc/81/08/30/585810830.db2.gz WADWQZFEQNWEHN-SMDDNHRTSA-N 1 1 249.785 3.928 20 0 BHADMO Cc1ccccc1[C@@H]1CC[N@H+]([C@@H](C)C2CC2)C1 ZINC000782183639 585810487 /nfs/dbraw/zinc/81/04/87/585810487.db2.gz OIOXWBGTUUZZBP-DZGCQCFKSA-N 1 1 229.367 3.583 20 0 BHADMO Cc1ccccc1[C@H]1CC[N@H+]([C@H](C)C2CC2)C1 ZINC000782183640 585810879 /nfs/dbraw/zinc/81/08/79/585810879.db2.gz OIOXWBGTUUZZBP-HIFRSBDPSA-N 1 1 229.367 3.583 20 0 BHADMO Cc1ccccc1[C@@H]1CC[N@H+]([C@H](C)C2CC2)C1 ZINC000782183641 585810512 /nfs/dbraw/zinc/81/05/12/585810512.db2.gz OIOXWBGTUUZZBP-UKRRQHHQSA-N 1 1 229.367 3.583 20 0 BHADMO Cc1ccccc1[C@H]1CC[N@H+]([C@@H](C)C2CC2)C1 ZINC000782183642 585810922 /nfs/dbraw/zinc/81/09/22/585810922.db2.gz OIOXWBGTUUZZBP-ZFWWWQNUSA-N 1 1 229.367 3.583 20 0 BHADMO CC(C)C[C@H]1CCC[N@H+]([C@H](C)C2CC2)C1 ZINC000782188034 585811003 /nfs/dbraw/zinc/81/10/03/585811003.db2.gz PHYPRQPGBBHRJD-CHWSQXEVSA-N 1 1 209.377 3.543 20 0 BHADMO CC(C)C[C@@H]1CCC[N@H+]([C@H](C)C2CC2)C1 ZINC000782188042 585811172 /nfs/dbraw/zinc/81/11/72/585811172.db2.gz PHYPRQPGBBHRJD-OLZOCXBDSA-N 1 1 209.377 3.543 20 0 BHADMO CC(C)C[C@H]1CCC[N@H+]([C@@H](C)C2CC2)C1 ZINC000782188044 585811146 /nfs/dbraw/zinc/81/11/46/585811146.db2.gz PHYPRQPGBBHRJD-QWHCGFSZSA-N 1 1 209.377 3.543 20 0 BHADMO CC(C)C[C@@H]1CCC[N@H+]([C@@H](C)C2CC2)C1 ZINC000782188047 585811212 /nfs/dbraw/zinc/81/12/12/585811212.db2.gz PHYPRQPGBBHRJD-STQMWFEESA-N 1 1 209.377 3.543 20 0 BHADMO C[C@H](C1CC1)[N@H+]1CC[C@@H](c2ccccc2)[C@H](C)C1 ZINC000782190012 585811124 /nfs/dbraw/zinc/81/11/24/585811124.db2.gz SXBVXSBDKGFCOE-CKEIUWERSA-N 1 1 243.394 3.911 20 0 BHADMO C[C@H](C1CC1)[N@H+]1CC[C@H](c2ccccc2)[C@H](C)C1 ZINC000782190017 632503176 /nfs/dbraw/zinc/50/31/76/632503176.db2.gz SXBVXSBDKGFCOE-CPUCHLNUSA-N 1 1 243.394 3.911 20 0 BHADMO C[C@@H](C1CC1)[N@H+]1CC[C@@H](c2ccccc2)[C@H](C)C1 ZINC000782190028 632502979 /nfs/dbraw/zinc/50/29/79/632502979.db2.gz SXBVXSBDKGFCOE-JKIFEVAISA-N 1 1 243.394 3.911 20 0 BHADMO C[C@@H](C1CC1)[N@H+]1CC[C@H](c2ccccc2)[C@H](C)C1 ZINC000782190037 632504275 /nfs/dbraw/zinc/50/42/75/632504275.db2.gz SXBVXSBDKGFCOE-KEYYUXOJSA-N 1 1 243.394 3.911 20 0 BHADMO Clc1ccc2c(c1)CC[C@@H]2[N@@H+]1CC=CCC1 ZINC000782190802 585811836 /nfs/dbraw/zinc/81/18/36/585811836.db2.gz NHWWLBQVXBNRJB-AWEZNQCLSA-N 1 1 233.742 3.589 20 0 BHADMO Clc1ccc2c(c1)CC[C@H]2[N@@H+]1CC=CCC1 ZINC000782190803 585811477 /nfs/dbraw/zinc/81/14/77/585811477.db2.gz NHWWLBQVXBNRJB-CQSZACIVSA-N 1 1 233.742 3.589 20 0 BHADMO CCCC[C@@H](C)[N@@H+](C)CCc1cccs1 ZINC000782191486 585811792 /nfs/dbraw/zinc/81/17/92/585811792.db2.gz WJXBLHICPQENFX-GFCCVEGCSA-N 1 1 225.401 3.801 20 0 BHADMO CCCC[C@H](C)[N@@H+](C)CCc1cccs1 ZINC000782191495 585811807 /nfs/dbraw/zinc/81/18/07/585811807.db2.gz WJXBLHICPQENFX-LBPRGKRZSA-N 1 1 225.401 3.801 20 0 BHADMO C[C@H](C1CC1)[N@H+]1CCSC2(CCCCC2)C1 ZINC000782192219 585811466 /nfs/dbraw/zinc/81/14/66/585811466.db2.gz ZAWORRJVMXZSPP-GFCCVEGCSA-N 1 1 239.428 3.537 20 0 BHADMO C[C@@H](C1CC1)[N@H+]1CCSC2(CCCCC2)C1 ZINC000782192223 585811824 /nfs/dbraw/zinc/81/18/24/585811824.db2.gz ZAWORRJVMXZSPP-LBPRGKRZSA-N 1 1 239.428 3.537 20 0 BHADMO Cc1ccc([C@H]2CC[N@H+]([C@@H](C)C3CC3)C2)cc1 ZINC000782193376 585811697 /nfs/dbraw/zinc/81/16/97/585811697.db2.gz MEHNEJRDZBGCOM-BBRMVZONSA-N 1 1 229.367 3.583 20 0 BHADMO Cc1ccc([C@H]2CC[N@H+]([C@H](C)C3CC3)C2)cc1 ZINC000782193379 585811451 /nfs/dbraw/zinc/81/14/51/585811451.db2.gz MEHNEJRDZBGCOM-CJNGLKHVSA-N 1 1 229.367 3.583 20 0 BHADMO Cc1ccc([C@@H]2CC[N@H+]([C@H](C)C3CC3)C2)cc1 ZINC000782193380 585811706 /nfs/dbraw/zinc/81/17/06/585811706.db2.gz MEHNEJRDZBGCOM-CZUORRHYSA-N 1 1 229.367 3.583 20 0 BHADMO Cc1ccc([C@@H]2CC[N@H+]([C@@H](C)C3CC3)C2)cc1 ZINC000782193382 585811664 /nfs/dbraw/zinc/81/16/64/585811664.db2.gz MEHNEJRDZBGCOM-XJKSGUPXSA-N 1 1 229.367 3.583 20 0 BHADMO Cc1cccc([C@H]2CC[N@H+]([C@@H](C)C3CC3)C2)c1 ZINC000782193427 585811560 /nfs/dbraw/zinc/81/15/60/585811560.db2.gz MXUAZMPAYSVUEP-BBRMVZONSA-N 1 1 229.367 3.583 20 0 BHADMO Cc1cccc([C@H]2CC[N@H+]([C@H](C)C3CC3)C2)c1 ZINC000782193429 585811548 /nfs/dbraw/zinc/81/15/48/585811548.db2.gz MXUAZMPAYSVUEP-CJNGLKHVSA-N 1 1 229.367 3.583 20 0 BHADMO Cc1cccc([C@@H]2CC[N@H+]([C@H](C)C3CC3)C2)c1 ZINC000782193430 585811631 /nfs/dbraw/zinc/81/16/31/585811631.db2.gz MXUAZMPAYSVUEP-CZUORRHYSA-N 1 1 229.367 3.583 20 0 BHADMO Cc1cccc([C@@H]2CC[N@H+]([C@@H](C)C3CC3)C2)c1 ZINC000782193432 585811593 /nfs/dbraw/zinc/81/15/93/585811593.db2.gz MXUAZMPAYSVUEP-XJKSGUPXSA-N 1 1 229.367 3.583 20 0 BHADMO Cc1cccc(C2=CC[N@@H+]([C@@H](C)C3CC3)CC2)c1 ZINC000782194369 585811995 /nfs/dbraw/zinc/81/19/95/585811995.db2.gz XJWYLDXYTUYSSD-AWEZNQCLSA-N 1 1 241.378 3.883 20 0 BHADMO CO[C@H](C)C[N@@H+](C)[C@@H](C)c1c(C)cc(C)cc1C ZINC000782464988 585818654 /nfs/dbraw/zinc/81/86/54/585818654.db2.gz VYPUCGSKSDMDPK-CABCVRRESA-N 1 1 249.398 3.640 20 0 BHADMO CO[C@@H](C)C[N@@H+](C)[C@@H](C)c1c(C)cc(C)cc1C ZINC000782464989 585818757 /nfs/dbraw/zinc/81/87/57/585818757.db2.gz VYPUCGSKSDMDPK-GJZGRUSLSA-N 1 1 249.398 3.640 20 0 BHADMO CO[C@H](C)C[N@@H+](C)[C@H](C)c1c(C)cc(C)cc1C ZINC000782464990 585818648 /nfs/dbraw/zinc/81/86/48/585818648.db2.gz VYPUCGSKSDMDPK-HUUCEWRRSA-N 1 1 249.398 3.640 20 0 BHADMO CO[C@@H](C)C[N@@H+](C)[C@H](C)c1c(C)cc(C)cc1C ZINC000782464991 585818893 /nfs/dbraw/zinc/81/88/93/585818893.db2.gz VYPUCGSKSDMDPK-LSDHHAIUSA-N 1 1 249.398 3.640 20 0 BHADMO C[C@@H]1C[N@@H+](CCc2cccs2)[C@@H]2CCCC[C@@H]21 ZINC000782502508 585819297 /nfs/dbraw/zinc/81/92/97/585819297.db2.gz HKSWUPGKBKLAIR-BPLDGKMQSA-N 1 1 249.423 3.801 20 0 BHADMO C[C@@H]1C[N@@H+](CCc2cccs2)[C@H]2CCCC[C@@H]12 ZINC000782502525 585819352 /nfs/dbraw/zinc/81/93/52/585819352.db2.gz HKSWUPGKBKLAIR-SNPRPXQTSA-N 1 1 249.423 3.801 20 0 BHADMO C[C@@H]1C[N@@H+](CCc2cccs2)[C@@H]2CCCC[C@H]21 ZINC000782502528 585819173 /nfs/dbraw/zinc/81/91/73/585819173.db2.gz HKSWUPGKBKLAIR-VHDGCEQUSA-N 1 1 249.423 3.801 20 0 BHADMO C[C@@H]1C[N@@H+](CCc2cccs2)[C@H]2CCCC[C@H]12 ZINC000782502531 585819402 /nfs/dbraw/zinc/81/94/02/585819402.db2.gz HKSWUPGKBKLAIR-YUELXQCFSA-N 1 1 249.423 3.801 20 0 BHADMO C[C@@H]1C[N@@H+](C/C(Cl)=C/Cl)[C@@H]2CCCC[C@H]21 ZINC000782505220 585819372 /nfs/dbraw/zinc/81/93/72/585819372.db2.gz WLIWMHUUJSEZPF-AXIQDABYSA-N 1 1 248.197 3.816 20 0 BHADMO C[C@@H]1C[N@@H+](C/C(Cl)=C/Cl)[C@@H]2CCCC[C@@H]21 ZINC000782505221 585819369 /nfs/dbraw/zinc/81/93/69/585819369.db2.gz WLIWMHUUJSEZPF-LXUHNGFDSA-N 1 1 248.197 3.816 20 0 BHADMO C[C@@H]1C[N@@H+](C/C(Cl)=C\Cl)[C@@H]2CCCC[C@H]21 ZINC000782505222 585819140 /nfs/dbraw/zinc/81/91/40/585819140.db2.gz WLIWMHUUJSEZPF-NCWOZAGMSA-N 1 1 248.197 3.816 20 0 BHADMO C[C@@H]1C[N@@H+](C/C(Cl)=C\Cl)[C@@H]2CCCC[C@@H]21 ZINC000782505223 585819321 /nfs/dbraw/zinc/81/93/21/585819321.db2.gz WLIWMHUUJSEZPF-XWXGRMNFSA-N 1 1 248.197 3.816 20 0 BHADMO CC(C)c1ccccc1C[NH2+]Cc1nccs1 ZINC000782539948 585819999 /nfs/dbraw/zinc/81/99/99/585819999.db2.gz QYDFUUSUSLEEAK-UHFFFAOYSA-N 1 1 246.379 3.556 20 0 BHADMO Cl/C=C(/Cl)C[N@H+]1CCCC2(CCCC2)C1 ZINC000782636694 585823671 /nfs/dbraw/zinc/82/36/71/585823671.db2.gz HYKVNAVQXQOVTH-DHZHZOJOSA-N 1 1 248.197 3.962 20 0 BHADMO Cl/C=C(/Cl)C[N@@H+]1CCCC2(CCCC2)C1 ZINC000782636694 585823670 /nfs/dbraw/zinc/82/36/70/585823670.db2.gz HYKVNAVQXQOVTH-DHZHZOJOSA-N 1 1 248.197 3.962 20 0 BHADMO Cl/C=C(\Cl)C[N@H+]1CCCC2(CCCC2)C1 ZINC000782636695 585823658 /nfs/dbraw/zinc/82/36/58/585823658.db2.gz HYKVNAVQXQOVTH-FLIBITNWSA-N 1 1 248.197 3.962 20 0 BHADMO Cl/C=C(\Cl)C[N@@H+]1CCCC2(CCCC2)C1 ZINC000782636695 585823657 /nfs/dbraw/zinc/82/36/57/585823657.db2.gz HYKVNAVQXQOVTH-FLIBITNWSA-N 1 1 248.197 3.962 20 0 BHADMO c1csc(CC[N@H+]2CCCC3(CCCC3)C2)c1 ZINC000782637264 585823839 /nfs/dbraw/zinc/82/38/39/585823839.db2.gz PBDYRRJMPJDHCG-UHFFFAOYSA-N 1 1 249.423 3.947 20 0 BHADMO C[C@@H](c1ccncc1)[N@H+]1CCCC2(CCCC2)C1 ZINC000782637709 585823815 /nfs/dbraw/zinc/82/38/15/585823815.db2.gz UQMSJKJIFLYWLB-AWEZNQCLSA-N 1 1 244.382 3.799 20 0 BHADMO C[C@H](c1ccncc1)[N@H+]1CCCC2(CCCC2)C1 ZINC000782637717 585823874 /nfs/dbraw/zinc/82/38/74/585823874.db2.gz UQMSJKJIFLYWLB-CQSZACIVSA-N 1 1 244.382 3.799 20 0 BHADMO Cc1ccc(NCc2cccc3cnccc32)[nH+]c1 ZINC000782891928 585825772 /nfs/dbraw/zinc/82/57/72/585825772.db2.gz MZUMZCYTPWMYBN-UHFFFAOYSA-N 1 1 249.317 3.550 20 0 BHADMO c1cc(CCC[N@H+]2CCC3(CCCC3)C2)cs1 ZINC000782939070 585826345 /nfs/dbraw/zinc/82/63/45/585826345.db2.gz DGUZENKJFNAQGH-UHFFFAOYSA-N 1 1 249.423 3.947 20 0 BHADMO C[C@H](Cc1ccsc1)[N@H+]1CCC2(CCCC2)C1 ZINC000783471535 585835493 /nfs/dbraw/zinc/83/54/93/585835493.db2.gz OQRXXYYEINUQIR-CYBMUJFWSA-N 1 1 249.423 3.945 20 0 BHADMO C[C@@H](Cc1ccsc1)[N@H+]1CCC2(CCCC2)C1 ZINC000783471767 585835546 /nfs/dbraw/zinc/83/55/46/585835546.db2.gz OQRXXYYEINUQIR-ZDUSSCGKSA-N 1 1 249.423 3.945 20 0 BHADMO Cc1ccc(NCc2ncc(C(C)C)s2)[nH+]c1 ZINC000783826006 585844136 /nfs/dbraw/zinc/84/41/36/585844136.db2.gz HPZGHGLHFVNUNQ-UHFFFAOYSA-N 1 1 247.367 3.582 20 0 BHADMO CO[C@@H]1CC[N@H+]([C@H](C)c2ccc(C(C)C)cc2)C1 ZINC000784162902 585852091 /nfs/dbraw/zinc/85/20/91/585852091.db2.gz XVWCHDAWKBLWAJ-CZUORRHYSA-N 1 1 247.382 3.592 20 0 BHADMO CO[C@@H]1CC[N@H+]([C@@H](C)c2ccc(C(C)C)cc2)C1 ZINC000784162904 585852107 /nfs/dbraw/zinc/85/21/07/585852107.db2.gz XVWCHDAWKBLWAJ-XJKSGUPXSA-N 1 1 247.382 3.592 20 0 BHADMO CC(C)c1ccc([C@H](C)[N@H+]2CC[C@@H]3C[C@@H]32)cc1 ZINC000784223658 585853163 /nfs/dbraw/zinc/85/31/63/585853163.db2.gz RJDZDEPIIOVLJA-MAZHCROVSA-N 1 1 229.367 3.965 20 0 BHADMO CC(C)c1ccc([C@H](C)[N@H+]2CC[C@H]3C[C@H]32)cc1 ZINC000784223660 585853019 /nfs/dbraw/zinc/85/30/19/585853019.db2.gz RJDZDEPIIOVLJA-VBNZEHGJSA-N 1 1 229.367 3.965 20 0 BHADMO C[C@H]1C[N@@H+](C/C(Cl)=C/Cl)CC(C)(C)C1 ZINC000784350161 585856634 /nfs/dbraw/zinc/85/66/34/585856634.db2.gz IRLZEGOEDWTILY-JRZFIGEHSA-N 1 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1 1 236.186 3.673 20 0 BHADMO C[C@@H]1C[N@H+](C/C(Cl)=C\Cl)CC(C)(C)C1 ZINC000784350172 585856636 /nfs/dbraw/zinc/85/66/36/585856636.db2.gz IRLZEGOEDWTILY-UMYFRRCYSA-N 1 1 236.186 3.673 20 0 BHADMO C[N@H+](Cc1ccc(CF)cc1)C[C@H]1CC=CCC1 ZINC000784385126 585857910 /nfs/dbraw/zinc/85/79/10/585857910.db2.gz KCDONDWCLROXQS-HNNXBMFYSA-N 1 1 247.357 3.944 20 0 BHADMO C[N@H+](Cc1ccc(CF)cc1)C[C@@H]1CC=CCC1 ZINC000784385127 585858025 /nfs/dbraw/zinc/85/80/25/585858025.db2.gz KCDONDWCLROXQS-OAHLLOKOSA-N 1 1 247.357 3.944 20 0 BHADMO C[N@H+](C/C(Cl)=C/Cl)C[C@@H]1CC=CCC1 ZINC000784385390 585857934 /nfs/dbraw/zinc/85/79/34/585857934.db2.gz LWJYAVSVKIWECS-PAKSIRSJSA-N 1 1 234.170 3.594 20 0 BHADMO C[N@H+](C/C(Cl)=C/Cl)C[C@H]1CC=CCC1 ZINC000784385391 585857937 /nfs/dbraw/zinc/85/79/37/585857937.db2.gz LWJYAVSVKIWECS-QBQSQJOESA-N 1 1 234.170 3.594 20 0 BHADMO C[N@H+](C/C(Cl)=C\Cl)C[C@@H]1CC=CCC1 ZINC000784385392 585857896 /nfs/dbraw/zinc/85/78/96/585857896.db2.gz LWJYAVSVKIWECS-UEUZTHOGSA-N 1 1 234.170 3.594 20 0 BHADMO C[N@H+](C/C(Cl)=C\Cl)C[C@H]1CC=CCC1 ZINC000784385393 585857980 /nfs/dbraw/zinc/85/79/80/585857980.db2.gz LWJYAVSVKIWECS-VUBLIPMDSA-N 1 1 234.170 3.594 20 0 BHADMO CC(C)c1cnc(C[N@@H+](C)C[C@@H]2CC=CCC2)o1 ZINC000784385701 585857746 /nfs/dbraw/zinc/85/77/46/585857746.db2.gz OPWKLHOEIZPRMB-CYBMUJFWSA-N 1 1 248.370 3.586 20 0 BHADMO CC(C)c1cnc(C[N@@H+](C)C[C@H]2CC=CCC2)o1 ZINC000784385702 585857940 /nfs/dbraw/zinc/85/79/40/585857940.db2.gz OPWKLHOEIZPRMB-ZDUSSCGKSA-N 1 1 248.370 3.586 20 0 BHADMO Cc1ccc([C@@H]2CC[N@@H+](C/C=C/Cl)C2)cc1 ZINC000784476672 585861027 /nfs/dbraw/zinc/86/10/27/585861027.db2.gz KDHYKLSEQAGFSB-JPFFYJABSA-N 1 1 235.758 3.537 20 0 BHADMO Cc1ccc([C@H]2CC[N@@H+](C/C=C/Cl)C2)cc1 ZINC000784476701 585861061 /nfs/dbraw/zinc/86/10/61/585861061.db2.gz KDHYKLSEQAGFSB-LPSTVZDBSA-N 1 1 235.758 3.537 20 0 BHADMO Cc1ccc([C@H]2CC[N@@H+](C/C=C\Cl)C2)cc1 ZINC000784476705 585861080 /nfs/dbraw/zinc/86/10/80/585861080.db2.gz KDHYKLSEQAGFSB-OLUUIJGHSA-N 1 1 235.758 3.537 20 0 BHADMO Cc1ccc([C@@H]2CC[N@@H+](C/C=C\Cl)C2)cc1 ZINC000784476709 585861146 /nfs/dbraw/zinc/86/11/46/585861146.db2.gz KDHYKLSEQAGFSB-UCEWNTHNSA-N 1 1 235.758 3.537 20 0 BHADMO Cc1cccc([C@@H]2CC[N@@H+](C/C=C\Cl)C2)c1 ZINC000784479630 585860977 /nfs/dbraw/zinc/86/09/77/585860977.db2.gz VDZWHXXJVBGIAW-NMNMAYGDSA-N 1 1 235.758 3.537 20 0 BHADMO Cc1cccc([C@H]2CC[N@@H+](C/C=C/Cl)C2)c1 ZINC000784479631 585861032 /nfs/dbraw/zinc/86/10/32/585861032.db2.gz VDZWHXXJVBGIAW-RRFAQUSLSA-N 1 1 235.758 3.537 20 0 BHADMO Cc1cccc([C@@H]2CC[N@@H+](C/C=C/Cl)C2)c1 ZINC000784479632 585861008 /nfs/dbraw/zinc/86/10/08/585861008.db2.gz VDZWHXXJVBGIAW-UFZAZABTSA-N 1 1 235.758 3.537 20 0 BHADMO Cc1cccc([C@H]2CC[N@@H+](C/C=C\Cl)C2)c1 ZINC000784479633 585861131 /nfs/dbraw/zinc/86/11/31/585861131.db2.gz VDZWHXXJVBGIAW-UMSKNGNOSA-N 1 1 235.758 3.537 20 0 BHADMO CC(C)(C)[C@@H]1CC[N@@H+](CCc2cccs2)C1 ZINC000784507929 585861658 /nfs/dbraw/zinc/86/16/58/585861658.db2.gz BWIGQJULLYXRSJ-GFCCVEGCSA-N 1 1 237.412 3.659 20 0 BHADMO CC(C)(C)[C@H]1CC[N@@H+](CCc2cccs2)C1 ZINC000784507930 585861686 /nfs/dbraw/zinc/86/16/86/585861686.db2.gz BWIGQJULLYXRSJ-LBPRGKRZSA-N 1 1 237.412 3.659 20 0 BHADMO CC(C)(C)[C@H]1CC[N@@H+](C/C(Cl)=C\Cl)C1 ZINC000784509195 585861838 /nfs/dbraw/zinc/86/18/38/585861838.db2.gz GDWVCMQRSBBNMB-CMWXKVOJSA-N 1 1 236.186 3.673 20 0 BHADMO CC(C)(C)[C@H]1CC[N@@H+](C/C(Cl)=C/Cl)C1 ZINC000784509333 585861882 /nfs/dbraw/zinc/86/18/82/585861882.db2.gz GDWVCMQRSBBNMB-LKJZUNMESA-N 1 1 236.186 3.673 20 0 BHADMO CC(C)(C)[C@@H]1CC[N@@H+](C/C(Cl)=C/Cl)C1 ZINC000784509335 585861763 /nfs/dbraw/zinc/86/17/63/585861763.db2.gz GDWVCMQRSBBNMB-WPVMNKCKSA-N 1 1 236.186 3.673 20 0 BHADMO CC(C)(C)[C@@H]1CC[N@@H+](C/C(Cl)=C\Cl)C1 ZINC000784509339 585861751 /nfs/dbraw/zinc/86/17/51/585861751.db2.gz GDWVCMQRSBBNMB-ZFZMKPAXSA-N 1 1 236.186 3.673 20 0 BHADMO Cc1cncc(C[N@H+](C)C2CCCCCCC2)c1 ZINC000785445237 585874068 /nfs/dbraw/zinc/87/40/68/585874068.db2.gz ZKMXEPAAYGEEHR-UHFFFAOYSA-N 1 1 246.398 3.935 20 0 BHADMO Cc1ccc([C@@H]2C[C@H](C)[N@H+](C/C=C/Cl)C2)cc1 ZINC000786124429 585887840 /nfs/dbraw/zinc/88/78/40/585887840.db2.gz DPPKCPCEFRMBOV-JGAQIUESSA-N 1 1 249.785 3.925 20 0 BHADMO Cc1ccc([C@@H]2C[C@@H](C)[N@H+](C/C=C/Cl)C2)cc1 ZINC000786124432 585887835 /nfs/dbraw/zinc/88/78/35/585887835.db2.gz DPPKCPCEFRMBOV-OLBOPLKTSA-N 1 1 249.785 3.925 20 0 BHADMO Cc1ccc([C@@H]2C[C@@H](C)[N@H+](C/C=C\Cl)C2)cc1 ZINC000786124434 585887813 /nfs/dbraw/zinc/88/78/13/585887813.db2.gz DPPKCPCEFRMBOV-QMVQRKLUSA-N 1 1 249.785 3.925 20 0 BHADMO Cc1ccc([C@@H]2C[C@H](C)[N@H+](C/C=C\Cl)C2)cc1 ZINC000786124435 585887817 /nfs/dbraw/zinc/88/78/17/585887817.db2.gz DPPKCPCEFRMBOV-SUXGKNLPSA-N 1 1 249.785 3.925 20 0 BHADMO CC(C)c1cnc(C[N@@H+](C)C2(C)CCCC2)o1 ZINC000786214540 585888720 /nfs/dbraw/zinc/88/87/20/585888720.db2.gz OFFSYWIOUQNEOS-UHFFFAOYSA-N 1 1 236.359 3.563 20 0 BHADMO C[N@@H+](Cc1ccc(CF)cc1)C1(C)CCCC1 ZINC000786217158 585888701 /nfs/dbraw/zinc/88/87/01/585888701.db2.gz ITSCHQYXVPQWRO-UHFFFAOYSA-N 1 1 235.346 3.921 20 0 BHADMO C[N@@H+](CCc1cccs1)C1(C)CCCC1 ZINC000786217539 585888789 /nfs/dbraw/zinc/88/87/89/585888789.db2.gz NGVKFWRQQJVXCX-UHFFFAOYSA-N 1 1 223.385 3.555 20 0 BHADMO CC(C)CC[N@@H+](C)Cc1cc(Cl)cs1 ZINC000787087519 585901102 /nfs/dbraw/zinc/90/11/02/585901102.db2.gz QBJHMDQFSYKHET-UHFFFAOYSA-N 1 1 231.792 3.879 20 0 BHADMO C[N@@H+](C[C@H]1CCSC1)C1CCCCCCC1 ZINC000787144589 585901908 /nfs/dbraw/zinc/90/19/08/585901908.db2.gz PMBNKJPMZZBVAD-CYBMUJFWSA-N 1 1 241.444 3.784 20 0 BHADMO C[N@@H+](C[C@@H]1CCSC1)C1CCCCCCC1 ZINC000787144590 585902140 /nfs/dbraw/zinc/90/21/40/585902140.db2.gz PMBNKJPMZZBVAD-ZDUSSCGKSA-N 1 1 241.444 3.784 20 0 BHADMO Clc1csc(C[N@H+]2CCC[C@@H]2C2CC2)c1 ZINC000787150591 585902281 /nfs/dbraw/zinc/90/22/81/585902281.db2.gz SOSFGKDUZUKNMA-GFCCVEGCSA-N 1 1 241.787 3.776 20 0 BHADMO Clc1csc(C[N@H+]2CCC[C@H]2C2CC2)c1 ZINC000787150592 585902311 /nfs/dbraw/zinc/90/23/11/585902311.db2.gz SOSFGKDUZUKNMA-LBPRGKRZSA-N 1 1 241.787 3.776 20 0 BHADMO Fc1ccc(C[N@@H+](C2CC2)C2CCCCC2)nc1 ZINC000787168303 585902550 /nfs/dbraw/zinc/90/25/50/585902550.db2.gz IWAYPMSNCNTMAL-UHFFFAOYSA-N 1 1 248.345 3.518 20 0 BHADMO C[N@@H+](CC[C@@H]1CCCO1)C1CCCCCCC1 ZINC000787203965 585902745 /nfs/dbraw/zinc/90/27/45/585902745.db2.gz BSMSFCVYFDKRAD-HNNXBMFYSA-N 1 1 239.403 3.600 20 0 BHADMO C[N@@H+](CC[C@H]1CCCO1)C1CCCCCCC1 ZINC000787203966 585902784 /nfs/dbraw/zinc/90/27/84/585902784.db2.gz BSMSFCVYFDKRAD-OAHLLOKOSA-N 1 1 239.403 3.600 20 0 BHADMO COC(C)(C)CC[N@@H+](C)C1CCCCCCC1 ZINC000787204249 585902926 /nfs/dbraw/zinc/90/29/26/585902926.db2.gz GHPCBICPTUQINV-UHFFFAOYSA-N 1 1 241.419 3.846 20 0 BHADMO Cc1cc(C[N@H+](C)C2(C)CCCC2)c(C)o1 ZINC000787337930 585907076 /nfs/dbraw/zinc/90/70/76/585907076.db2.gz UFLVURQJGOVDNC-UHFFFAOYSA-N 1 1 221.344 3.661 20 0 BHADMO CCCCC[N@H+]1CCn2c(Cl)ccc2[C@H]1C ZINC000787648801 585913535 /nfs/dbraw/zinc/91/35/35/585913535.db2.gz DHFJKOWBELRYMW-LLVKDONJSA-N 1 1 240.778 3.708 20 0 BHADMO CCCCC[N@H+]1CCn2c(Cl)ccc2[C@@H]1C ZINC000787648819 585913638 /nfs/dbraw/zinc/91/36/38/585913638.db2.gz DHFJKOWBELRYMW-NSHDSACASA-N 1 1 240.778 3.708 20 0 BHADMO CC(C)CC[N@H+]1CCn2c(Cl)ccc2[C@H]1C ZINC000787650287 585913666 /nfs/dbraw/zinc/91/36/66/585913666.db2.gz IUEUHCDLSFVDAD-LLVKDONJSA-N 1 1 240.778 3.564 20 0 BHADMO CC(C)CC[N@H+]1CCn2c(Cl)ccc2[C@@H]1C ZINC000787650292 585913613 /nfs/dbraw/zinc/91/36/13/585913613.db2.gz IUEUHCDLSFVDAD-NSHDSACASA-N 1 1 240.778 3.564 20 0 BHADMO CC[C@@H](C)C[N@H+]1CCn2c(Cl)ccc2[C@H]1C ZINC000787651327 585913454 /nfs/dbraw/zinc/91/34/54/585913454.db2.gz KLCWPZWNSPTEGX-GHMZBOCLSA-N 1 1 240.778 3.564 20 0 BHADMO CC[C@@H](C)C[N@H+]1CCn2c(Cl)ccc2[C@@H]1C ZINC000787651330 585913584 /nfs/dbraw/zinc/91/35/84/585913584.db2.gz KLCWPZWNSPTEGX-MNOVXSKESA-N 1 1 240.778 3.564 20 0 BHADMO CC[C@H](C)C[N@H+]1CCn2c(Cl)ccc2[C@@H]1C ZINC000787651332 585913651 /nfs/dbraw/zinc/91/36/51/585913651.db2.gz KLCWPZWNSPTEGX-QWRGUYRKSA-N 1 1 240.778 3.564 20 0 BHADMO CC[C@H](C)C[N@H+]1CCn2c(Cl)ccc2[C@H]1C ZINC000787651334 585913488 /nfs/dbraw/zinc/91/34/88/585913488.db2.gz KLCWPZWNSPTEGX-WDEREUQCSA-N 1 1 240.778 3.564 20 0 BHADMO CC(C)=CCC[C@H](C)CC[N@@H+](C)Cc1ncc[nH]1 ZINC000788832597 585930963 /nfs/dbraw/zinc/93/09/63/585930963.db2.gz RIDPEYLBKWQDQY-AWEZNQCLSA-N 1 1 249.402 3.614 20 0 BHADMO CC(C)=CCC[C@H](C)CC[N@H+](C)Cc1ncc[nH]1 ZINC000788832597 585930962 /nfs/dbraw/zinc/93/09/62/585930962.db2.gz RIDPEYLBKWQDQY-AWEZNQCLSA-N 1 1 249.402 3.614 20 0 BHADMO CC(C)=CCC[C@@H](C)CC[N@@H+](C)Cc1ncc[nH]1 ZINC000788832598 585930927 /nfs/dbraw/zinc/93/09/27/585930927.db2.gz RIDPEYLBKWQDQY-CQSZACIVSA-N 1 1 249.402 3.614 20 0 BHADMO CC(C)=CCC[C@@H](C)CC[N@H+](C)Cc1ncc[nH]1 ZINC000788832598 585930926 /nfs/dbraw/zinc/93/09/26/585930926.db2.gz RIDPEYLBKWQDQY-CQSZACIVSA-N 1 1 249.402 3.614 20 0 BHADMO C[C@H]1CC[C@H](C[N@@H+](C)C2CCCCCCC2)O1 ZINC000789316209 585939469 /nfs/dbraw/zinc/93/94/69/585939469.db2.gz FQJPHGAISTUCNG-DZGCQCFKSA-N 1 1 239.403 3.599 20 0 BHADMO C[C@@H]1CC[C@@H](C[N@@H+](C)C2CCCCCCC2)O1 ZINC000789316210 585939540 /nfs/dbraw/zinc/93/95/40/585939540.db2.gz FQJPHGAISTUCNG-HIFRSBDPSA-N 1 1 239.403 3.599 20 0 BHADMO C[C@@H]1CC[C@H](C[N@@H+](C)C2CCCCCCC2)O1 ZINC000789316211 585939393 /nfs/dbraw/zinc/93/93/93/585939393.db2.gz FQJPHGAISTUCNG-UKRRQHHQSA-N 1 1 239.403 3.599 20 0 BHADMO C[C@H]1CC[C@@H](C[N@@H+](C)C2CCCCCCC2)O1 ZINC000789316212 585939583 /nfs/dbraw/zinc/93/95/83/585939583.db2.gz FQJPHGAISTUCNG-ZFWWWQNUSA-N 1 1 239.403 3.599 20 0 BHADMO C[C@@H]1C[C@H](C)[C@H](C)[N@@H+](C/C(Cl)=C/Cl)C1 ZINC000789452113 644788529 /nfs/dbraw/zinc/78/85/29/644788529.db2.gz QBBTWXWXQVSCTL-JYILAWLKSA-N 1 1 236.186 3.672 20 0 BHADMO C[C@@H]1C[C@H](C)[C@@H](C)[N@@H+](C/C(Cl)=C\Cl)C1 ZINC000789452114 644788576 /nfs/dbraw/zinc/78/85/76/644788576.db2.gz QBBTWXWXQVSCTL-TXXFAWKFSA-N 1 1 236.186 3.672 20 0 BHADMO C[C@@H]1C[C@H](C)[C@H](C)[N@@H+](C/C(Cl)=C\Cl)C1 ZINC000789452115 644788234 /nfs/dbraw/zinc/78/82/34/644788234.db2.gz QBBTWXWXQVSCTL-ULQZIGKOSA-N 1 1 236.186 3.672 20 0 BHADMO C[C@@H]1C[C@H](C)[C@@H](C)[N@@H+](C/C(Cl)=C/Cl)C1 ZINC000789452116 644788043 /nfs/dbraw/zinc/78/80/43/644788043.db2.gz QBBTWXWXQVSCTL-VTRZNIIMSA-N 1 1 236.186 3.672 20 0 BHADMO NC(=[NH+]OCCCCCF)C1CCCCCC1 ZINC000789597730 585945503 /nfs/dbraw/zinc/94/55/03/585945503.db2.gz UOTMPDOSSQNPPS-UHFFFAOYSA-N 1 1 244.354 3.595 20 0 BHADMO C/C(=C\Cl)CSCC[C@H]1CCCC[N@@H+]1C ZINC000789983071 585955511 /nfs/dbraw/zinc/95/55/11/585955511.db2.gz UILUHAUAFFFBDW-LMMOQWNQSA-N 1 1 247.835 3.737 20 0 BHADMO C/C(=C/Cl)CSCC[C@@H]1CCCC[N@@H+]1C ZINC000789983072 585955453 /nfs/dbraw/zinc/95/54/53/585955453.db2.gz UILUHAUAFFFBDW-MMRAYRKESA-N 1 1 247.835 3.737 20 0 BHADMO C/C(=C/Cl)CSCC[C@H]1CCCC[N@@H+]1C ZINC000789983073 585955577 /nfs/dbraw/zinc/95/55/77/585955577.db2.gz UILUHAUAFFFBDW-UCQJPZFISA-N 1 1 247.835 3.737 20 0 BHADMO C/C(=C\Cl)CSCC[C@@H]1CCCC[N@@H+]1C ZINC000789983074 585955447 /nfs/dbraw/zinc/95/54/47/585955447.db2.gz UILUHAUAFFFBDW-ZKQHCESOSA-N 1 1 247.835 3.737 20 0 BHADMO CCCCCC[N@H+]1CC[C@@H](C(F)(F)F)[C@H]1C ZINC000791585121 585984840 /nfs/dbraw/zinc/98/48/40/585984840.db2.gz QTIDVTZEEYPSTE-GHMZBOCLSA-N 1 1 237.309 3.839 20 0 BHADMO CCCCCC[N@H+]1CC[C@H](C(F)(F)F)[C@H]1C ZINC000791585123 585984808 /nfs/dbraw/zinc/98/48/08/585984808.db2.gz QTIDVTZEEYPSTE-MNOVXSKESA-N 1 1 237.309 3.839 20 0 BHADMO CCCCCC[N@H+]1CC[C@H](C(F)(F)F)[C@@H]1C ZINC000791585124 585984912 /nfs/dbraw/zinc/98/49/12/585984912.db2.gz QTIDVTZEEYPSTE-QWRGUYRKSA-N 1 1 237.309 3.839 20 0 BHADMO CCCCCC[N@H+]1CC[C@@H](C(F)(F)F)[C@@H]1C ZINC000791585125 585984931 /nfs/dbraw/zinc/98/49/31/585984931.db2.gz QTIDVTZEEYPSTE-WDEREUQCSA-N 1 1 237.309 3.839 20 0 BHADMO CSc1ccccc1C[N@@H+](C)C/C=C/Cl ZINC000791603666 585985145 /nfs/dbraw/zinc/98/51/45/585985145.db2.gz VCWNZNIYXWDEEP-VMPITWQZSA-N 1 1 241.787 3.593 20 0 BHADMO CSc1ccccc1C[N@H+](C)C/C=C/Cl ZINC000791603666 585985144 /nfs/dbraw/zinc/98/51/44/585985144.db2.gz VCWNZNIYXWDEEP-VMPITWQZSA-N 1 1 241.787 3.593 20 0 BHADMO CSc1ccccc1C[N@@H+](C)C/C=C\Cl ZINC000791603668 585985051 /nfs/dbraw/zinc/98/50/51/585985051.db2.gz VCWNZNIYXWDEEP-YVMONPNESA-N 1 1 241.787 3.593 20 0 BHADMO CSc1ccccc1C[N@H+](C)C/C=C\Cl ZINC000791603668 585985050 /nfs/dbraw/zinc/98/50/50/585985050.db2.gz VCWNZNIYXWDEEP-YVMONPNESA-N 1 1 241.787 3.593 20 0 BHADMO Cc1ccc([C@@H]2CC[N@@H+](C/C=C\Cl)C2)c(C)c1 ZINC000791607874 585985161 /nfs/dbraw/zinc/98/51/61/585985161.db2.gz VWCAIQYADKRFLD-NMNMAYGDSA-N 1 1 249.785 3.845 20 0 BHADMO Cc1ccc([C@H]2CC[N@@H+](C/C=C/Cl)C2)c(C)c1 ZINC000791607875 585985076 /nfs/dbraw/zinc/98/50/76/585985076.db2.gz VWCAIQYADKRFLD-RRFAQUSLSA-N 1 1 249.785 3.845 20 0 BHADMO Cc1ccc([C@@H]2CC[N@@H+](C/C=C/Cl)C2)c(C)c1 ZINC000791607876 585985061 /nfs/dbraw/zinc/98/50/61/585985061.db2.gz VWCAIQYADKRFLD-UFZAZABTSA-N 1 1 249.785 3.845 20 0 BHADMO Cc1ccc([C@H]2CC[N@@H+](C/C=C\Cl)C2)c(C)c1 ZINC000791607877 585985104 /nfs/dbraw/zinc/98/51/04/585985104.db2.gz VWCAIQYADKRFLD-UMSKNGNOSA-N 1 1 249.785 3.845 20 0 BHADMO Cc1ccnc(C[N@H+](C)C2CCCCCCC2)c1 ZINC000792214144 585998139 /nfs/dbraw/zinc/99/81/39/585998139.db2.gz AUGQARDTQOMBNW-UHFFFAOYSA-N 1 1 246.398 3.935 20 0 BHADMO Cc1ccnc(C[N@H+]2CCCC3(CCCC3)C2)c1 ZINC000792297303 585999352 /nfs/dbraw/zinc/99/93/52/585999352.db2.gz OIMBSQKQUINACF-UHFFFAOYSA-N 1 1 244.382 3.546 20 0 BHADMO CCCCCC[N@@H+](C)Cc1ccn(CC)c1 ZINC000792312510 585999719 /nfs/dbraw/zinc/99/97/19/585999719.db2.gz FJLKTHLUVUGUJC-UHFFFAOYSA-N 1 1 222.376 3.520 20 0 BHADMO Cc1ccc(C2=CC[N@@H+](CC3(F)CC3)CC2)cc1 ZINC000792778376 586005115 /nfs/dbraw/zinc/00/51/15/586005115.db2.gz OYUWBLVOMQKSGS-UHFFFAOYSA-N 1 1 245.341 3.586 20 0 BHADMO C[N@@H+](CC1(F)CC1)C1CCCCCCC1 ZINC000792798996 586005497 /nfs/dbraw/zinc/00/54/97/586005497.db2.gz WAFZCUQLNDDAJS-UHFFFAOYSA-N 1 1 213.340 3.533 20 0 BHADMO FC1(CNc2ccc([NH+]3CCCCC3)cc2)CC1 ZINC000792840012 586005747 /nfs/dbraw/zinc/00/57/47/586005747.db2.gz CPYQMTFOPDNRSS-UHFFFAOYSA-N 1 1 248.345 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586160555 /nfs/dbraw/zinc/16/05/55/586160555.db2.gz SKTGTDYZLMNFBY-OAHLLOKOSA-N 1 1 248.414 3.628 20 0 BHADMO CCCCCC[N@H+]1CCCC[C@H]1c1ccnn1C ZINC000799183682 586165338 /nfs/dbraw/zinc/16/53/38/586165338.db2.gz YOLHABZJQNHDSQ-HNNXBMFYSA-N 1 1 249.402 3.527 20 0 BHADMO CCCCCC[N@H+]1CCCC[C@@H]1c1ccnn1C ZINC000799183683 586165618 /nfs/dbraw/zinc/16/56/18/586165618.db2.gz YOLHABZJQNHDSQ-OAHLLOKOSA-N 1 1 249.402 3.527 20 0 BHADMO CC(C)C[C@@H](C)C[N@H+]1CC[C@H](c2ccccn2)C1 ZINC000799193865 586166381 /nfs/dbraw/zinc/16/63/81/586166381.db2.gz BLZSZHLLXLDHDZ-CABCVRRESA-N 1 1 246.398 3.553 20 0 BHADMO CC(C)C[C@H](C)C[N@H+]1CC[C@H](c2ccccn2)C1 ZINC000799193866 586166075 /nfs/dbraw/zinc/16/60/75/586166075.db2.gz BLZSZHLLXLDHDZ-GJZGRUSLSA-N 1 1 246.398 3.553 20 0 BHADMO CC(C)C[C@@H](C)C[N@H+]1CC[C@@H](c2ccccn2)C1 ZINC000799193867 586166676 /nfs/dbraw/zinc/16/66/76/586166676.db2.gz BLZSZHLLXLDHDZ-HUUCEWRRSA-N 1 1 246.398 3.553 20 0 BHADMO CC(C)C[C@H](C)C[N@H+]1CC[C@@H](c2ccccn2)C1 ZINC000799193868 586166838 /nfs/dbraw/zinc/16/68/38/586166838.db2.gz BLZSZHLLXLDHDZ-LSDHHAIUSA-N 1 1 246.398 3.553 20 0 BHADMO CCC(C)(C)CC[N@H+]1CC[C@H](c2ccccn2)C1 ZINC000799195552 586167312 /nfs/dbraw/zinc/16/73/12/586167312.db2.gz DOHWYUHCPLZKBQ-AWEZNQCLSA-N 1 1 246.398 3.697 20 0 BHADMO CCC(C)(C)CC[N@H+]1CC[C@@H](c2ccccn2)C1 ZINC000799195553 586167272 /nfs/dbraw/zinc/16/72/72/586167272.db2.gz DOHWYUHCPLZKBQ-CQSZACIVSA-N 1 1 246.398 3.697 20 0 BHADMO CC(C)(C)CCC[N@H+]1CC[C@H](c2ccccn2)C1 ZINC000799195656 586167103 /nfs/dbraw/zinc/16/71/03/586167103.db2.gz ZMLQDAYRPQJXKQ-AWEZNQCLSA-N 1 1 246.398 3.697 20 0 BHADMO CC(C)(C)CCC[N@H+]1CC[C@@H](c2ccccn2)C1 ZINC000799195657 586167048 /nfs/dbraw/zinc/16/70/48/586167048.db2.gz ZMLQDAYRPQJXKQ-CQSZACIVSA-N 1 1 246.398 3.697 20 0 BHADMO CCCCCC[N@@H+](C)Cc1cnc(C(C)C)nc1 ZINC000799334072 586171912 /nfs/dbraw/zinc/17/19/12/586171912.db2.gz OIVKFMIOSAGKIY-UHFFFAOYSA-N 1 1 249.402 3.612 20 0 BHADMO CCC[C@@H](C)[N@@H+]1Cc2ccccc2[C@H](C)C1 ZINC000800330596 586212051 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ZINC000800347109 586212997 /nfs/dbraw/zinc/21/29/97/586212997.db2.gz UEWLMHLNVOKKCW-HOCLYGCPSA-N 1 1 249.398 3.539 20 0 BHADMO CCC[C@@H](C)[N@@H+](CC)C[C@H](O)c1ccc(C)cc1 ZINC000800347110 586212982 /nfs/dbraw/zinc/21/29/82/586212982.db2.gz UEWLMHLNVOKKCW-ZBFHGGJFSA-N 1 1 249.398 3.539 20 0 BHADMO FC(F)C1([NH2+][C@@H]2CC[C@H]3CCCC[C@H]3C2)CC1 ZINC000800503245 586223651 /nfs/dbraw/zinc/22/36/51/586223651.db2.gz QFKJWTYYTRYEET-GRYCIOLGSA-N 1 1 243.341 3.733 20 0 BHADMO FC(F)C1([NH2+][C@@H]2CC[C@H]3CCCC[C@@H]3C2)CC1 ZINC000800503246 586223819 /nfs/dbraw/zinc/22/38/19/586223819.db2.gz QFKJWTYYTRYEET-IJLUTSLNSA-N 1 1 243.341 3.733 20 0 BHADMO FC(F)C1([NH2+][C@@H]2CC[C@@H]3CCCC[C@@H]3C2)CC1 ZINC000800503247 586223908 /nfs/dbraw/zinc/22/39/08/586223908.db2.gz QFKJWTYYTRYEET-QJPTWQEYSA-N 1 1 243.341 3.733 20 0 BHADMO FC(F)C1([NH2+][C@@H]2CC[C@@H]3CCCC[C@H]3C2)CC1 ZINC000800503248 586223948 /nfs/dbraw/zinc/22/39/48/586223948.db2.gz QFKJWTYYTRYEET-SDDRHHMPSA-N 1 1 243.341 3.733 20 0 BHADMO CC(C)SCC[N@@H+]1Cc2ccccc2[C@H](C)C1 ZINC000801508953 586259850 /nfs/dbraw/zinc/25/98/50/586259850.db2.gz WTDSSZAQOAJMCO-CYBMUJFWSA-N 1 1 249.423 3.747 20 0 BHADMO CC(C)SCC[N@@H+]1Cc2ccccc2[C@@H](C)C1 ZINC000801508958 586260068 /nfs/dbraw/zinc/26/00/68/586260068.db2.gz WTDSSZAQOAJMCO-ZDUSSCGKSA-N 1 1 249.423 3.747 20 0 BHADMO C[C@H](C1CCCCC1)[N@@H+](C)C/C=C\Cl ZINC000801600796 586266103 /nfs/dbraw/zinc/26/61/03/586266103.db2.gz OKVHLGXHAPQSCR-DHHDDZJSSA-N 1 1 215.768 3.640 20 0 BHADMO C[C@H](C1CCCCC1)[N@@H+](C)C/C=C/Cl ZINC000801600797 586265750 /nfs/dbraw/zinc/26/57/50/586265750.db2.gz OKVHLGXHAPQSCR-OALRPVAKSA-N 1 1 215.768 3.640 20 0 BHADMO CC1=C(c2ccco2)C[N@@H+](C/C=C\Cl)CC1 ZINC000801602343 586266129 /nfs/dbraw/zinc/26/61/29/586266129.db2.gz CSJCWGPCIDGANE-UTCJRWHESA-N 1 1 237.730 3.511 20 0 BHADMO CC1=C(c2ccco2)C[N@@H+](C/C=C/Cl)CC1 ZINC000801602344 586266260 /nfs/dbraw/zinc/26/62/60/586266260.db2.gz CSJCWGPCIDGANE-ZZXKWVIFSA-N 1 1 237.730 3.511 20 0 BHADMO CC(C)(C)SCC[N@H+]1CCc2ccccc2C1 ZINC000801909462 710873672 /nfs/dbraw/zinc/87/36/72/710873672.db2.gz CJYUIGGLMZILFB-UHFFFAOYSA-N 1 1 249.423 3.576 20 0 BHADMO CCC[N@@H+](CCSC(C)(C)C)CC1CC1 ZINC000801910343 710874318 /nfs/dbraw/zinc/87/43/18/710874318.db2.gz PBBOXPYXXMUAHT-UHFFFAOYSA-N 1 1 229.433 3.640 20 0 BHADMO CCCC[N@@H+](CC)CCSC(C)(C)C ZINC000801910751 710874005 /nfs/dbraw/zinc/87/40/05/710874005.db2.gz WQNYUXXGODGDPE-UHFFFAOYSA-N 1 1 217.422 3.640 20 0 BHADMO CC[C@@H]1CCC[N@@H+](CCSC(C)(C)C)C1 ZINC000801910924 710873461 /nfs/dbraw/zinc/87/34/61/710873461.db2.gz DGKUFIPNOIADAZ-GFCCVEGCSA-N 1 1 229.433 3.640 20 0 BHADMO CC[C@H]1CCC[N@@H+](CCSC(C)(C)C)C1 ZINC000801910925 710873889 /nfs/dbraw/zinc/87/38/89/710873889.db2.gz DGKUFIPNOIADAZ-LBPRGKRZSA-N 1 1 229.433 3.640 20 0 BHADMO Cc1ccc(C[N@@H+](C)CCSC(C)(C)C)o1 ZINC000801911316 710874433 /nfs/dbraw/zinc/87/44/33/710874433.db2.gz JMPXOKGPSGFHJC-UHFFFAOYSA-N 1 1 241.400 3.552 20 0 BHADMO CC[C@@H]1CCCC[N@H+]1CCSC(C)(C)C ZINC000801911519 710874060 /nfs/dbraw/zinc/87/40/60/710874060.db2.gz KXGWHIBZTQMHMF-GFCCVEGCSA-N 1 1 229.433 3.783 20 0 BHADMO CC[C@H]1CCCC[N@H+]1CCSC(C)(C)C ZINC000801911520 710874099 /nfs/dbraw/zinc/87/40/99/710874099.db2.gz KXGWHIBZTQMHMF-LBPRGKRZSA-N 1 1 229.433 3.783 20 0 BHADMO C[N@@H+](CCSC(C)(C)C)Cc1cccs1 ZINC000801911562 644845131 /nfs/dbraw/zinc/84/51/31/644845131.db2.gz MMEOUSYWSCVMMJ-UHFFFAOYSA-N 1 1 243.441 3.712 20 0 BHADMO C[N@@H+](CCSC(C)(C)C)Cc1ccccc1 ZINC000801911812 644846157 /nfs/dbraw/zinc/84/61/57/644846157.db2.gz UAANTULLBRPQFM-UHFFFAOYSA-N 1 1 237.412 3.650 20 0 BHADMO C[N@@H+](CCSC(C)(C)C)C1CCCCC1 ZINC000801911834 644845928 /nfs/dbraw/zinc/84/59/28/644845928.db2.gz UKOSVWKSAJSMPT-UHFFFAOYSA-N 1 1 229.433 3.783 20 0 BHADMO C[N@@H+](CCSC(C)(C)C)Cc1ccsc1 ZINC000801911882 644845578 /nfs/dbraw/zinc/84/55/78/644845578.db2.gz VMYNCFAQPILUHZ-UHFFFAOYSA-N 1 1 243.441 3.712 20 0 BHADMO C[C@@H]1CCC[N@@H+](CCSC(C)(C)C)CC1 ZINC000801913427 586276977 /nfs/dbraw/zinc/27/69/77/586276977.db2.gz 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241.400 3.552 20 0 BHADMO C[C@H](C1CC1)[N@@H+](CCSC(C)(C)C)C1CC1 ZINC000801914527 586276459 /nfs/dbraw/zinc/27/64/59/586276459.db2.gz JWSKYJFVUHIJRP-LLVKDONJSA-N 1 1 241.444 3.781 20 0 BHADMO C[C@@H](C1CC1)[N@@H+](CCSC(C)(C)C)C1CC1 ZINC000801914528 586276814 /nfs/dbraw/zinc/27/68/14/586276814.db2.gz JWSKYJFVUHIJRP-NSHDSACASA-N 1 1 241.444 3.781 20 0 BHADMO CC[N@@H+](CCSC(C)(C)C)C1CCCC1 ZINC000801915301 586276799 /nfs/dbraw/zinc/27/67/99/586276799.db2.gz PNTJRQYUGCXOBM-UHFFFAOYSA-N 1 1 229.433 3.783 20 0 BHADMO CC(C)[C@H]1CCC[N@H+]1CCSC(C)(C)C ZINC000801916562 586276278 /nfs/dbraw/zinc/27/62/78/586276278.db2.gz XYAXBXVPLSXMKB-GFCCVEGCSA-N 1 1 229.433 3.639 20 0 BHADMO CC(C)[C@@H]1CCC[N@H+]1CCSC(C)(C)C ZINC000801916563 586276511 /nfs/dbraw/zinc/27/65/11/586276511.db2.gz XYAXBXVPLSXMKB-LBPRGKRZSA-N 1 1 229.433 3.639 20 0 BHADMO CC[N@@H+](CCSC(C)(C)C)Cc1ccoc1 ZINC000801917476 586276845 /nfs/dbraw/zinc/27/68/45/586276845.db2.gz DSXADESPXPINNS-UHFFFAOYSA-N 1 1 241.400 3.633 20 0 BHADMO 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C[C@@H]1CC[C@@H](C)[N@@H+](CCSC(C)(C)C)C1 ZINC000801925604 644844986 /nfs/dbraw/zinc/84/49/86/644844986.db2.gz OIXCYTINXQRWQJ-VXGBXAGGSA-N 1 1 229.433 3.639 20 0 BHADMO CC(C)(C)SCC[N@H+]1CCC2(CCCC2)C1 ZINC000801925855 644845458 /nfs/dbraw/zinc/84/54/58/644845458.db2.gz RXCSYCMWOGNSGN-UHFFFAOYSA-N 1 1 241.444 3.784 20 0 BHADMO CC(C)(C)SCC[N@@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC000801926441 644847006 /nfs/dbraw/zinc/84/70/06/644847006.db2.gz QOEBOECLLUKTAS-BETUJISGSA-N 1 1 241.444 3.640 20 0 BHADMO CC[C@]1(C)CC[N@@H+](CCSC(C)(C)C)C1 ZINC000801927311 644846860 /nfs/dbraw/zinc/84/68/60/644846860.db2.gz MJDFUIBPNFSFOU-CYBMUJFWSA-N 1 1 229.433 3.640 20 0 BHADMO CC[C@@]1(C)CC[N@@H+](CCSC(C)(C)C)C1 ZINC000801927312 644846526 /nfs/dbraw/zinc/84/65/26/644846526.db2.gz MJDFUIBPNFSFOU-ZDUSSCGKSA-N 1 1 229.433 3.640 20 0 BHADMO CC(C)[N@@H+](CCSC(C)(C)C)CC1CC1 ZINC000801930136 586278972 /nfs/dbraw/zinc/27/89/72/586278972.db2.gz GUOHUHPMJYAQLK-UHFFFAOYSA-N 1 1 229.433 3.639 20 0 BHADMO 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586430415 /nfs/dbraw/zinc/43/04/15/586430415.db2.gz BXEQOAHMEPPUHZ-UTCJRWHESA-N 1 1 230.138 3.524 20 0 BHADMO CC(C)CC[N@@H+]1Cc2ccccc2[C@H](C)C1 ZINC000807262985 586431080 /nfs/dbraw/zinc/43/10/80/586431080.db2.gz BGNTUFHGEOCJKX-CYBMUJFWSA-N 1 1 217.356 3.652 20 0 BHADMO CC(C)CC[N@@H+]1Cc2ccccc2[C@@H](C)C1 ZINC000807262986 586431156 /nfs/dbraw/zinc/43/11/56/586431156.db2.gz BGNTUFHGEOCJKX-ZDUSSCGKSA-N 1 1 217.356 3.652 20 0 BHADMO C[N@@H+](C/C=C/Cl)[C@@H]1CCCc2ccccc21 ZINC000807266803 586431279 /nfs/dbraw/zinc/43/12/79/586431279.db2.gz GOULCHSSQPKDBL-AZWQULSGSA-N 1 1 235.758 3.748 20 0 BHADMO C[N@@H+](C/C=C\Cl)[C@H]1CCCc2ccccc21 ZINC000807266804 586430889 /nfs/dbraw/zinc/43/08/89/586430889.db2.gz GOULCHSSQPKDBL-MFNCVGGLSA-N 1 1 235.758 3.748 20 0 BHADMO C[N@@H+](C/C=C/Cl)[C@H]1CCCc2ccccc21 ZINC000807266805 586431303 /nfs/dbraw/zinc/43/13/03/586431303.db2.gz GOULCHSSQPKDBL-SEIPJRMCSA-N 1 1 235.758 3.748 20 0 BHADMO C[N@@H+](C/C=C\Cl)[C@@H]1CCCc2ccccc21 ZINC000807266806 586431274 /nfs/dbraw/zinc/43/12/74/586431274.db2.gz GOULCHSSQPKDBL-XTXQVDMPSA-N 1 1 235.758 3.748 20 0 BHADMO Fc1ccc(C[N@@H+](C/C=C\Cl)C2CC2)cc1 ZINC000807277432 586431582 /nfs/dbraw/zinc/43/15/82/586431582.db2.gz QWRWPRHOJQFAIJ-QPIMQUGISA-N 1 1 239.721 3.543 20 0 BHADMO Fc1ccc(C[N@H+](C/C=C\Cl)C2CC2)cc1 ZINC000807277432 586431581 /nfs/dbraw/zinc/43/15/81/586431581.db2.gz QWRWPRHOJQFAIJ-QPIMQUGISA-N 1 1 239.721 3.543 20 0 BHADMO CC[C@H]1c2ccsc2CC[N@@H+]1C/C=C\Cl ZINC000807278544 586431776 /nfs/dbraw/zinc/43/17/76/586431776.db2.gz STYGXEWZGQQMEJ-UUSYTGMJSA-N 1 1 241.787 3.810 20 0 BHADMO CC[C@@H]1c2ccsc2CC[N@@H+]1C/C=C\Cl ZINC000807278545 586431899 /nfs/dbraw/zinc/43/18/99/586431899.db2.gz STYGXEWZGQQMEJ-ZTYXWKCZSA-N 1 1 241.787 3.810 20 0 BHADMO C[C@@H](c1ccc(F)cc1)[N@@H+](C)C/C=C\Cl ZINC000807279501 586431750 /nfs/dbraw/zinc/43/17/50/586431750.db2.gz NNASSNQFROGLJO-GJQXAKHRSA-N 1 1 227.710 3.571 20 0 BHADMO C[C@H](c1ccc(F)cc1)[N@@H+](C)C/C=C\Cl ZINC000807279502 586431621 /nfs/dbraw/zinc/43/16/21/586431621.db2.gz NNASSNQFROGLJO-WPKZPIIRSA-N 1 1 227.710 3.571 20 0 BHADMO CCC[N@@H+](CCC(=O)C(C)C)Cc1ccccc1 ZINC000808705235 586483398 /nfs/dbraw/zinc/48/33/98/586483398.db2.gz BQZPWKMNRHPJDF-UHFFFAOYSA-N 1 1 247.382 3.514 20 0 BHADMO Cc1ccc([C@H](C)[N@H+](C)CCC(=O)C(C)C)cc1 ZINC000808708219 586483213 /nfs/dbraw/zinc/48/32/13/586483213.db2.gz DFCLCSCDQGIXCM-AWEZNQCLSA-N 1 1 247.382 3.603 20 0 BHADMO Cc1ccc([C@@H](C)[N@H+](C)CCC(=O)C(C)C)cc1 ZINC000808708225 586483134 /nfs/dbraw/zinc/48/31/34/586483134.db2.gz DFCLCSCDQGIXCM-CQSZACIVSA-N 1 1 247.382 3.603 20 0 BHADMO CCCCC[N@@H+](CCC(=O)C(C)C)C(C)C ZINC000808710024 586484149 /nfs/dbraw/zinc/48/41/49/586484149.db2.gz WQFRIDQOHNNNNM-UHFFFAOYSA-N 1 1 227.392 3.502 20 0 BHADMO CC(C)C(=O)CC[N@@H+](Cc1ccccc1)C(C)C ZINC000808710288 586483617 /nfs/dbraw/zinc/48/36/17/586483617.db2.gz OVPLHFBRUDGTIP-UHFFFAOYSA-N 1 1 247.382 3.512 20 0 BHADMO CC(C)C(=O)CC[N@@H+](C)C1CCCCCCC1 ZINC000808716056 586483813 /nfs/dbraw/zinc/48/38/13/586483813.db2.gz QQOZDGPNCOHOTL-UHFFFAOYSA-N 1 1 239.403 3.646 20 0 BHADMO CC(C)C(=O)CC[N@H+]1CCC[C@@H]1CC(C)(C)C ZINC000808716500 586483596 /nfs/dbraw/zinc/48/35/96/586483596.db2.gz XOEZIUWWWDNXOQ-CYBMUJFWSA-N 1 1 239.403 3.502 20 0 BHADMO CC(C)C(=O)CC[N@H+]1CCC[C@H]1CC(C)(C)C ZINC000808716502 586484156 /nfs/dbraw/zinc/48/41/56/586484156.db2.gz XOEZIUWWWDNXOQ-ZDUSSCGKSA-N 1 1 239.403 3.502 20 0 BHADMO CC(C)C(=O)CC[N@@H+](C)CCC1CCCCC1 ZINC000808718740 586484657 /nfs/dbraw/zinc/48/46/57/586484657.db2.gz PILWPVFJWXOQBL-UHFFFAOYSA-N 1 1 239.403 3.504 20 0 BHADMO CC[C@@H](C)[C@@H](C)[N@@H+](CCC(=O)C(C)C)C1CC1 ZINC000808720268 586484587 /nfs/dbraw/zinc/48/45/87/586484587.db2.gz RHJGFSOBXIJPGP-CHWSQXEVSA-N 1 1 239.403 3.501 20 0 BHADMO CC[C@@H](C)[C@H](C)[N@@H+](CCC(=O)C(C)C)C1CC1 ZINC000808720269 586484249 /nfs/dbraw/zinc/48/42/49/586484249.db2.gz RHJGFSOBXIJPGP-OLZOCXBDSA-N 1 1 239.403 3.501 20 0 BHADMO CC[C@H](C)[C@@H](C)[N@@H+](CCC(=O)C(C)C)C1CC1 ZINC000808720270 586484434 /nfs/dbraw/zinc/48/44/34/586484434.db2.gz RHJGFSOBXIJPGP-QWHCGFSZSA-N 1 1 239.403 3.501 20 0 BHADMO CC[C@H](C)[C@H](C)[N@@H+](CCC(=O)C(C)C)C1CC1 ZINC000808720271 586484487 /nfs/dbraw/zinc/48/44/87/586484487.db2.gz RHJGFSOBXIJPGP-STQMWFEESA-N 1 1 239.403 3.501 20 0 BHADMO CC[C@H](C)[C@@H]1CCCC[N@H+]1CCC(=O)C(C)C ZINC000808729180 586485166 /nfs/dbraw/zinc/48/51/66/586485166.db2.gz VOWDCCOLOLZOCM-KBPBESRZSA-N 1 1 239.403 3.502 20 0 BHADMO CC[C@@H](C)[C@@H]1CCCC[N@H+]1CCC(=O)C(C)C ZINC000808729181 586485168 /nfs/dbraw/zinc/48/51/68/586485168.db2.gz VOWDCCOLOLZOCM-KGLIPLIRSA-N 1 1 239.403 3.502 20 0 BHADMO CC[C@H](C)[C@H]1CCCC[N@H+]1CCC(=O)C(C)C ZINC000808729183 586485328 /nfs/dbraw/zinc/48/53/28/586485328.db2.gz VOWDCCOLOLZOCM-UONOGXRCSA-N 1 1 239.403 3.502 20 0 BHADMO CC[C@@H](C)[C@H]1CCCC[N@H+]1CCC(=O)C(C)C ZINC000808729184 586484825 /nfs/dbraw/zinc/48/48/25/586484825.db2.gz VOWDCCOLOLZOCM-ZIAGYGMSSA-N 1 1 239.403 3.502 20 0 BHADMO CCC1CCC([N@@H+](C)CCC(=O)C(C)C)CC1 ZINC000808732095 586268290 /nfs/dbraw/zinc/26/82/90/586268290.db2.gz ARZLPFMSOUEFFW-UHFFFAOYSA-N 1 1 239.403 3.502 20 0 BHADMO CC(C)C(=O)CC[N@@H+](C)C1CCC(C)(C)CC1 ZINC000808732839 586485553 /nfs/dbraw/zinc/48/55/53/586485553.db2.gz UIHPUQRAOXHCBP-UHFFFAOYSA-N 1 1 239.403 3.502 20 0 BHADMO CCC[C@@]1(C)CCC[N@@H+](CCC(=O)C(C)C)C1 ZINC000808732884 586486223 /nfs/dbraw/zinc/48/62/23/586486223.db2.gz OBQXLAKOOVSLMQ-HNNXBMFYSA-N 1 1 239.403 3.504 20 0 BHADMO CCC[C@]1(C)CCC[N@@H+](CCC(=O)C(C)C)C1 ZINC000808732885 586485861 /nfs/dbraw/zinc/48/58/61/586485861.db2.gz OBQXLAKOOVSLMQ-OAHLLOKOSA-N 1 1 239.403 3.504 20 0 BHADMO CCC[C@H](C)[C@@H]1CCC[N@H+]1CCC(=O)C(C)C ZINC000808734624 586485960 /nfs/dbraw/zinc/48/59/60/586485960.db2.gz ARONIZHGXQHVAA-KBPBESRZSA-N 1 1 239.403 3.502 20 0 BHADMO CCC[C@@H](C)[C@@H]1CCC[N@H+]1CCC(=O)C(C)C ZINC000808734625 586485933 /nfs/dbraw/zinc/48/59/33/586485933.db2.gz ARONIZHGXQHVAA-KGLIPLIRSA-N 1 1 239.403 3.502 20 0 BHADMO CCC[C@H](C)[C@H]1CCC[N@H+]1CCC(=O)C(C)C ZINC000808734626 586485607 /nfs/dbraw/zinc/48/56/07/586485607.db2.gz ARONIZHGXQHVAA-UONOGXRCSA-N 1 1 239.403 3.502 20 0 BHADMO CCC[C@@H](C)[C@H]1CCC[N@H+]1CCC(=O)C(C)C ZINC000808734627 586486097 /nfs/dbraw/zinc/48/60/97/586486097.db2.gz ARONIZHGXQHVAA-ZIAGYGMSSA-N 1 1 239.403 3.502 20 0 BHADMO CCCCC[C@H]1CCC[N@H+]1CCC(=O)C(C)C ZINC000808735590 586486249 /nfs/dbraw/zinc/48/62/49/586486249.db2.gz SOMXSWGMKVLCLN-AWEZNQCLSA-N 1 1 239.403 3.646 20 0 BHADMO CCCCC[C@@H]1CCC[N@H+]1CCC(=O)C(C)C ZINC000808735591 586486145 /nfs/dbraw/zinc/48/61/45/586486145.db2.gz SOMXSWGMKVLCLN-CQSZACIVSA-N 1 1 239.403 3.646 20 0 BHADMO CC(C)CC[C@@H]1CCC[N@H+]1CCC(=O)C(C)C ZINC000808735735 586486126 /nfs/dbraw/zinc/48/61/26/586486126.db2.gz ZEOCSBIBLMIRFU-AWEZNQCLSA-N 1 1 239.403 3.502 20 0 BHADMO CC(C)CC[C@H]1CCC[N@H+]1CCC(=O)C(C)C ZINC000808735736 586485948 /nfs/dbraw/zinc/48/59/48/586485948.db2.gz ZEOCSBIBLMIRFU-CQSZACIVSA-N 1 1 239.403 3.502 20 0 BHADMO CC(C)C[C@@H]1CCCC[N@H+]1CCC(=O)C(C)C ZINC000808737849 586485546 /nfs/dbraw/zinc/48/55/46/586485546.db2.gz HISJDHNFPNBIGI-AWEZNQCLSA-N 1 1 239.403 3.502 20 0 BHADMO CC(C)C[C@H]1CCCC[N@H+]1CCC(=O)C(C)C ZINC000808737851 586486106 /nfs/dbraw/zinc/48/61/06/586486106.db2.gz HISJDHNFPNBIGI-CQSZACIVSA-N 1 1 239.403 3.502 20 0 BHADMO CCC[C@H]1[C@@H](C)CCC[N@H+]1CCC(=O)C(C)C ZINC000808737993 586485557 /nfs/dbraw/zinc/48/55/57/586485557.db2.gz SYQPMUDTUVKYJQ-KBPBESRZSA-N 1 1 239.403 3.502 20 0 BHADMO CCC[C@H]1[C@H](C)CCC[N@H+]1CCC(=O)C(C)C ZINC000808737994 586485954 /nfs/dbraw/zinc/48/59/54/586485954.db2.gz SYQPMUDTUVKYJQ-KGLIPLIRSA-N 1 1 239.403 3.502 20 0 BHADMO CCC[C@@H]1[C@@H](C)CCC[N@H+]1CCC(=O)C(C)C ZINC000808737995 586485887 /nfs/dbraw/zinc/48/58/87/586485887.db2.gz SYQPMUDTUVKYJQ-UONOGXRCSA-N 1 1 239.403 3.502 20 0 BHADMO CCC[C@@H]1[C@H](C)CCC[N@H+]1CCC(=O)C(C)C ZINC000808737996 586485798 /nfs/dbraw/zinc/48/57/98/586485798.db2.gz SYQPMUDTUVKYJQ-ZIAGYGMSSA-N 1 1 239.403 3.502 20 0 BHADMO CC(C)C(=O)CC[N@@H+](C)[C@@H](C)C1CCCCC1 ZINC000808754631 586488805 /nfs/dbraw/zinc/48/88/05/586488805.db2.gz WBRLPUPCUAUZKY-ZDUSSCGKSA-N 1 1 239.403 3.502 20 0 BHADMO CC(C)C(=O)CC[N@@H+](C)[C@H](C)C1CCCCC1 ZINC000808757932 586489076 /nfs/dbraw/zinc/48/90/76/586489076.db2.gz WBRLPUPCUAUZKY-CYBMUJFWSA-N 1 1 239.403 3.502 20 0 BHADMO FCc1ccc(C[N@H+]2CCC[C@H](C3CC3)C2)cc1 ZINC000808777167 586488783 /nfs/dbraw/zinc/48/87/83/586488783.db2.gz ZOZRAWURXPIWIX-INIZCTEOSA-N 1 1 247.357 3.778 20 0 BHADMO FCc1ccc(C[N@H+]2CCC[C@@H](C3CC3)C2)cc1 ZINC000808777168 586489264 /nfs/dbraw/zinc/48/92/64/586489264.db2.gz ZOZRAWURXPIWIX-MRXNPFEDSA-N 1 1 247.357 3.778 20 0 BHADMO CC(C)(C)SCC[N@H+]1CCC[C@@H](C2CC2)C1 ZINC000808778146 586489661 /nfs/dbraw/zinc/48/96/61/586489661.db2.gz NYEXVIBROHYSOP-CYBMUJFWSA-N 1 1 241.444 3.640 20 0 BHADMO CC(C)(C)SCC[N@H+]1CCC[C@H](C2CC2)C1 ZINC000808778147 586489394 /nfs/dbraw/zinc/48/93/94/586489394.db2.gz NYEXVIBROHYSOP-ZDUSSCGKSA-N 1 1 241.444 3.640 20 0 BHADMO CCC(CC)[N@@H+](CC)Cc1ccnc(Cl)c1 ZINC000808781761 586489794 /nfs/dbraw/zinc/48/97/94/586489794.db2.gz OSFLESQEKGWFMD-UHFFFAOYSA-N 1 1 240.778 3.746 20 0 BHADMO CCC(CC)[N@@H+](CC)Cc1ccc2c(c1)COC2 ZINC000808781997 586489908 /nfs/dbraw/zinc/48/99/08/586489908.db2.gz AVVLQVDENZNFQF-UHFFFAOYSA-N 1 1 247.382 3.727 20 0 BHADMO CCC(CC)[N@@H+](CC)CCC(=O)C(C)(C)C ZINC000808782102 586489369 /nfs/dbraw/zinc/48/93/69/586489369.db2.gz FQBYVIPEMOMONO-UHFFFAOYSA-N 1 1 227.392 3.502 20 0 BHADMO CCC(CC)[N@@H+](CC)C[C@H]1CC1(Cl)Cl ZINC000808782134 586489915 /nfs/dbraw/zinc/48/99/15/586489915.db2.gz GWIQYTULSDBANS-SECBINFHSA-N 1 1 238.202 3.691 20 0 BHADMO CCC(CC)[N@@H+](CC)C[C@@H]1CC1(Cl)Cl ZINC000808782135 586489511 /nfs/dbraw/zinc/48/95/11/586489511.db2.gz GWIQYTULSDBANS-VIFPVBQESA-N 1 1 238.202 3.691 20 0 BHADMO CCC(CC)[N@@H+](CC)Cc1cccnc1Cl ZINC000808782193 586489969 /nfs/dbraw/zinc/48/99/69/586489969.db2.gz JDKWPRXUKIJURU-UHFFFAOYSA-N 1 1 240.778 3.746 20 0 BHADMO CCC(CC)[N@@H+](CC)CC[C@H](O)c1ccccc1 ZINC000808782280 586489590 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3.791 20 0 BHADMO CCc1ccc([C@H]2CC[N@@H+](C/C=C/Cl)C2)cc1 ZINC000814641283 586627039 /nfs/dbraw/zinc/62/70/39/586627039.db2.gz DRPGTCZICSERQY-RUFWOKOUSA-N 1 1 249.785 3.791 20 0 BHADMO CCc1ccc([C@@H]2CC[N@@H+](C/C=C/Cl)C2)cc1 ZINC000814641284 586627287 /nfs/dbraw/zinc/62/72/87/586627287.db2.gz DRPGTCZICSERQY-RUGXIKGKSA-N 1 1 249.785 3.791 20 0 BHADMO CCc1ccc([C@H]2CC[N@@H+](C/C=C\Cl)C2)cc1 ZINC000814641285 586626849 /nfs/dbraw/zinc/62/68/49/586626849.db2.gz DRPGTCZICSERQY-YHTRPRNISA-N 1 1 249.785 3.791 20 0 BHADMO Cl/C=C/C[N@H+]1CCC[C@H](c2ccccc2)C1 ZINC000814642495 586626614 /nfs/dbraw/zinc/62/66/14/586626614.db2.gz QYTVTOGAVONPSU-KVEVGEHQSA-N 1 1 235.758 3.619 20 0 BHADMO Cl/C=C\C[N@H+]1CCC[C@H](c2ccccc2)C1 ZINC000814642501 586626968 /nfs/dbraw/zinc/62/69/68/586626968.db2.gz QYTVTOGAVONPSU-UQYHUFHVSA-N 1 1 235.758 3.619 20 0 BHADMO Cl/C=C\C[N@H+]1CCC[C@@H](c2ccccc2)C1 ZINC000814642502 586627091 /nfs/dbraw/zinc/62/70/91/586627091.db2.gz QYTVTOGAVONPSU-VYLZPFMQSA-N 1 1 235.758 3.619 20 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C[C@@H]1C[N@@H+](Cc2csc3ccccc23)[C@H]1C ZINC000815162573 586671232 /nfs/dbraw/zinc/67/12/32/586671232.db2.gz KWWBUSOOCXXPML-MNOVXSKESA-N 1 1 231.364 3.742 20 0 BHADMO C[C@H]1C[N@@H+](Cc2csc3ccccc23)[C@H]1C ZINC000815162575 586671662 /nfs/dbraw/zinc/67/16/62/586671662.db2.gz KWWBUSOOCXXPML-QWRGUYRKSA-N 1 1 231.364 3.742 20 0 BHADMO C[C@@H]1[C@@H](C)C[N@H+]1Cc1csc2ccccc12 ZINC000815162577 586671511 /nfs/dbraw/zinc/67/15/11/586671511.db2.gz KWWBUSOOCXXPML-WDEREUQCSA-N 1 1 231.364 3.742 20 0 BHADMO CC(C)COc1ccccc1C[N@H+]1C[C@H](C)[C@@H]1C ZINC000815163561 586671899 /nfs/dbraw/zinc/67/18/99/586671899.db2.gz STTVFCZORPDLLF-KBPBESRZSA-N 1 1 247.382 3.562 20 0 BHADMO CC(C)COc1ccccc1C[N@H+]1C[C@@H](C)[C@@H]1C ZINC000815163563 586671208 /nfs/dbraw/zinc/67/12/08/586671208.db2.gz STTVFCZORPDLLF-KGLIPLIRSA-N 1 1 247.382 3.562 20 0 BHADMO CC(C)COc1ccccc1C[N@H+]1C[C@H](C)[C@H]1C ZINC000815163565 586671728 /nfs/dbraw/zinc/67/17/28/586671728.db2.gz STTVFCZORPDLLF-UONOGXRCSA-N 1 1 247.382 3.562 20 0 BHADMO CC(C)COc1ccccc1C[N@H+]1C[C@@H](C)[C@H]1C ZINC000815163572 586671816 /nfs/dbraw/zinc/67/18/16/586671816.db2.gz STTVFCZORPDLLF-ZIAGYGMSSA-N 1 1 247.382 3.562 20 0 BHADMO C[C@@H]1C[N@H+]([C@H]2CCc3cc(Cl)ccc32)[C@H]1C ZINC000815163748 586671620 /nfs/dbraw/zinc/67/16/20/586671620.db2.gz UWZBLDFKPZLHAJ-BFVZDQMLSA-N 1 1 235.758 3.668 20 0 BHADMO C[C@@H]1C[N@H+]([C@@H]2CCc3cc(Cl)ccc32)[C@@H]1C ZINC000815163755 586671711 /nfs/dbraw/zinc/67/17/11/586671711.db2.gz UWZBLDFKPZLHAJ-GPCCPHFNSA-N 1 1 235.758 3.668 20 0 BHADMO C[C@@H]1C[N@H+]([C@@H]2CCc3cc(Cl)ccc32)[C@H]1C ZINC000815163756 586671932 /nfs/dbraw/zinc/67/19/32/586671932.db2.gz UWZBLDFKPZLHAJ-ISTVAULSSA-N 1 1 235.758 3.668 20 0 BHADMO C[C@@H]1C[N@H+]([C@H]2CCc3cc(Cl)ccc32)[C@@H]1C ZINC000815163757 586671630 /nfs/dbraw/zinc/67/16/30/586671630.db2.gz UWZBLDFKPZLHAJ-RULNRJAQSA-N 1 1 235.758 3.668 20 0 BHADMO C[C@H](C[N@H+]1C[C@@H](C)[C@H]1C)c1cccc(Cl)c1 ZINC000815164089 586672591 /nfs/dbraw/zinc/67/25/91/586672591.db2.gz YLICSIWHZSXBMP-IJLUTSLNSA-N 1 1 237.774 3.784 20 0 BHADMO C[C@H](C[N@H+]1C[C@H](C)[C@H]1C)c1cccc(Cl)c1 ZINC000815164098 586672283 /nfs/dbraw/zinc/67/22/83/586672283.db2.gz YLICSIWHZSXBMP-QJPTWQEYSA-N 1 1 237.774 3.784 20 0 BHADMO C[C@H](C[N@H+]1C[C@H](C)[C@@H]1C)c1cccc(Cl)c1 ZINC000815164100 586672234 /nfs/dbraw/zinc/67/22/34/586672234.db2.gz YLICSIWHZSXBMP-TUAOUCFPSA-N 1 1 237.774 3.784 20 0 BHADMO C[C@H](C[N@H+]1C[C@@H](C)[C@@H]1C)c1cccc(Cl)c1 ZINC000815164101 586672194 /nfs/dbraw/zinc/67/21/94/586672194.db2.gz YLICSIWHZSXBMP-UTUOFQBUSA-N 1 1 237.774 3.784 20 0 BHADMO C[C@@H]1C[N@@H+](Cc2cc3ccccc3s2)[C@@H]1C ZINC000815166037 586672438 /nfs/dbraw/zinc/67/24/38/586672438.db2.gz YFAQJWIFGGDJQR-GHMZBOCLSA-N 1 1 231.364 3.742 20 0 BHADMO C[C@@H]1C[N@@H+](Cc2cc3ccccc3s2)[C@H]1C ZINC000815166038 586672421 /nfs/dbraw/zinc/67/24/21/586672421.db2.gz YFAQJWIFGGDJQR-MNOVXSKESA-N 1 1 231.364 3.742 20 0 BHADMO C[C@H]1C[N@@H+](Cc2cc3ccccc3s2)[C@H]1C ZINC000815166039 586672191 /nfs/dbraw/zinc/67/21/91/586672191.db2.gz YFAQJWIFGGDJQR-QWRGUYRKSA-N 1 1 231.364 3.742 20 0 BHADMO C[C@@H]1[C@@H](C)C[N@H+]1Cc1cc2ccccc2s1 ZINC000815166040 586672246 /nfs/dbraw/zinc/67/22/46/586672246.db2.gz YFAQJWIFGGDJQR-WDEREUQCSA-N 1 1 231.364 3.742 20 0 BHADMO CCCC[N@@H+](CCF)[C@@H]1CCC[C@@H](C)C1 ZINC000815196077 586673398 /nfs/dbraw/zinc/67/33/98/586673398.db2.gz CYLULXHUMZCRLW-CHWSQXEVSA-N 1 1 215.356 3.637 20 0 BHADMO CCCC[N@@H+](CCF)[C@H]1CCC[C@@H](C)C1 ZINC000815196078 586673537 /nfs/dbraw/zinc/67/35/37/586673537.db2.gz CYLULXHUMZCRLW-OLZOCXBDSA-N 1 1 215.356 3.637 20 0 BHADMO CCCC[N@@H+](CCF)[C@@H]1CCC[C@H](C)C1 ZINC000815196079 586673276 /nfs/dbraw/zinc/67/32/76/586673276.db2.gz CYLULXHUMZCRLW-QWHCGFSZSA-N 1 1 215.356 3.637 20 0 BHADMO CCCC[N@@H+](CCF)[C@H]1CCC[C@H](C)C1 ZINC000815196080 586673451 /nfs/dbraw/zinc/67/34/51/586673451.db2.gz CYLULXHUMZCRLW-STQMWFEESA-N 1 1 215.356 3.637 20 0 BHADMO CCCC[N@@H+](CCC(C)=O)[C@@H]1CCC[C@H](C)C1 ZINC000815197790 586673353 /nfs/dbraw/zinc/67/33/53/586673353.db2.gz SGDHWAZBEJFJCY-DZGCQCFKSA-N 1 1 239.403 3.646 20 0 BHADMO CCCC[N@@H+](CCC(C)=O)[C@H]1CCC[C@@H](C)C1 ZINC000815197849 586673380 /nfs/dbraw/zinc/67/33/80/586673380.db2.gz SGDHWAZBEJFJCY-HIFRSBDPSA-N 1 1 239.403 3.646 20 0 BHADMO CCCC[N@@H+](CCC(C)=O)[C@@H]1CCC[C@@H](C)C1 ZINC000815197850 586673506 /nfs/dbraw/zinc/67/35/06/586673506.db2.gz SGDHWAZBEJFJCY-UKRRQHHQSA-N 1 1 239.403 3.646 20 0 BHADMO CCCC[N@@H+](CCC(C)=O)[C@H]1CCC[C@H](C)C1 ZINC000815197851 586673513 /nfs/dbraw/zinc/67/35/13/586673513.db2.gz SGDHWAZBEJFJCY-ZFWWWQNUSA-N 1 1 239.403 3.646 20 0 BHADMO CCCC[C@@H](C)[N@@H+](CCF)CCCC ZINC000815201335 586673764 /nfs/dbraw/zinc/67/37/64/586673764.db2.gz OYROYLRPCJSNDU-GFCCVEGCSA-N 1 1 203.345 3.637 20 0 BHADMO CCCC[C@H](C)[N@@H+](CCF)CCCC ZINC000815201339 586673811 /nfs/dbraw/zinc/67/38/11/586673811.db2.gz OYROYLRPCJSNDU-LBPRGKRZSA-N 1 1 203.345 3.637 20 0 BHADMO CCCC[C@@H](C)[N@@H+](CCCC)CCC(C)=O ZINC000815202760 586673807 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/nfs/dbraw/zinc/34/70/30/587347030.db2.gz PPZPSIDXQSBEGW-RDBSUJKOSA-N 1 1 228.339 3.560 20 0 BHADMO C[N@@H+](CCF)Cc1ccc(-c2cccs2)cc1 ZINC000826013494 587348403 /nfs/dbraw/zinc/34/84/03/587348403.db2.gz VQSNVUKZXRRSID-UHFFFAOYSA-N 1 1 249.354 3.816 20 0 BHADMO C[N@H+](CCF)Cc1ccc(-c2cccs2)cc1 ZINC000826013494 587348402 /nfs/dbraw/zinc/34/84/02/587348402.db2.gz VQSNVUKZXRRSID-UHFFFAOYSA-N 1 1 249.354 3.816 20 0 BHADMO Clc1csc(C[N@H+]2C[C@@H]3CCCC[C@@H]32)c1 ZINC000826539488 587354279 /nfs/dbraw/zinc/35/42/79/587354279.db2.gz UZGWQLFUSBNDLD-CABZTGNLSA-N 1 1 241.787 3.776 20 0 BHADMO CCCC[N@@H+](CC)C[C@]1(C)CC1(Cl)Cl ZINC000827303232 587375897 /nfs/dbraw/zinc/37/58/97/587375897.db2.gz DFHVTYLPTTVVJF-JTQLQIEISA-N 1 1 238.202 3.692 20 0 BHADMO CCCC[N@@H+](CC)C[C@@]1(C)CC1(Cl)Cl ZINC000827303233 587376143 /nfs/dbraw/zinc/37/61/43/587376143.db2.gz DFHVTYLPTTVVJF-SNVBAGLBSA-N 1 1 238.202 3.692 20 0 BHADMO CC(C)[C@@H](C)[N@@H+](C)C[C@@]1(C)CC1(Cl)Cl ZINC000827350777 587377885 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ZINC000827400053 587379825 /nfs/dbraw/zinc/37/98/25/587379825.db2.gz AGPLUYUOBOSJGV-VHSXEESVSA-N 1 1 238.202 3.691 20 0 BHADMO CCC[C@@H](C)[N@@H+](C)C[C@]1(C)CC1(Cl)Cl ZINC000827400054 587379985 /nfs/dbraw/zinc/37/99/85/587379985.db2.gz AGPLUYUOBOSJGV-ZJUUUORDSA-N 1 1 238.202 3.691 20 0 BHADMO Cc1noc(C)c1C[N@@H+](C)CCC1=CCCCC1 ZINC000827400340 587380029 /nfs/dbraw/zinc/38/00/29/587380029.db2.gz HLLMLKCPVBNGST-UHFFFAOYSA-N 1 1 248.370 3.614 20 0 BHADMO CC[N@@H+](CC(C)C)C[C@]1(C)CC1(Cl)Cl ZINC000827400498 587379971 /nfs/dbraw/zinc/37/99/71/587379971.db2.gz NMNSYVHLYZQCLV-JTQLQIEISA-N 1 1 238.202 3.548 20 0 BHADMO CC[N@@H+](CC(C)C)C[C@@]1(C)CC1(Cl)Cl ZINC000827400499 587379819 /nfs/dbraw/zinc/37/98/19/587379819.db2.gz NMNSYVHLYZQCLV-SNVBAGLBSA-N 1 1 238.202 3.548 20 0 BHADMO FC1(F)CC(C[N@@H+](C2CC2)C2CCCCC2)C1 ZINC000827415245 587380436 /nfs/dbraw/zinc/38/04/36/587380436.db2.gz CLUHSNZDBJAYBV-UHFFFAOYSA-N 1 1 243.341 3.829 20 0 BHADMO CC(C)CC[N@@H+](C)C[C@]1(C)CC1(Cl)Cl ZINC000827441886 587381123 /nfs/dbraw/zinc/38/11/23/587381123.db2.gz FSBNOGFJTYOSRY-JTQLQIEISA-N 1 1 238.202 3.548 20 0 BHADMO CC(C)CC[N@@H+](C)C[C@@]1(C)CC1(Cl)Cl ZINC000827441887 587381408 /nfs/dbraw/zinc/38/14/08/587381408.db2.gz FSBNOGFJTYOSRY-SNVBAGLBSA-N 1 1 238.202 3.548 20 0 BHADMO CC(C)CC(=O)CC[N@@H+](C)[C@@H](C)c1ccccc1 ZINC000827713478 587398383 /nfs/dbraw/zinc/39/83/83/587398383.db2.gz ZIABYVKAVPIXTB-AWEZNQCLSA-N 1 1 247.382 3.685 20 0 BHADMO CC(C)CC(=O)CC[N@@H+](C)[C@H](C)c1ccccc1 ZINC000827713479 587398582 /nfs/dbraw/zinc/39/85/82/587398582.db2.gz ZIABYVKAVPIXTB-CQSZACIVSA-N 1 1 247.382 3.685 20 0 BHADMO CC[C@@H](C)C[N@@H+](C)C[C@@]1(C)CC1(Cl)Cl ZINC000827794376 587402397 /nfs/dbraw/zinc/40/23/97/587402397.db2.gz MCICSTKUDWYDBW-NXEZZACHSA-N 1 1 238.202 3.548 20 0 BHADMO CC[C@H](C)C[N@@H+](C)C[C@]1(C)CC1(Cl)Cl ZINC000827794378 587402446 /nfs/dbraw/zinc/40/24/46/587402446.db2.gz MCICSTKUDWYDBW-UWVGGRQHSA-N 1 1 238.202 3.548 20 0 BHADMO CC[C@H](C)C[N@@H+](C)C[C@@]1(C)CC1(Cl)Cl 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ZINC000828307262 587433592 /nfs/dbraw/zinc/43/35/92/587433592.db2.gz WWVMDEMWNYJZTQ-SNVBAGLBSA-N 1 1 238.202 3.691 20 0 BHADMO FC(F)(F)[C@@H]1CC[N@@H+](CCC2=CCCCC2)C1 ZINC000828529325 587448076 /nfs/dbraw/zinc/44/80/76/587448076.db2.gz LVOMZBBTYFYRJY-GFCCVEGCSA-N 1 1 247.304 3.761 20 0 BHADMO FC(F)(F)[C@H]1CC[N@@H+](CCC2=CCCCC2)C1 ZINC000828529326 587446863 /nfs/dbraw/zinc/44/68/63/587446863.db2.gz LVOMZBBTYFYRJY-LBPRGKRZSA-N 1 1 247.304 3.761 20 0 BHADMO CC(C)c1cnc(C[N@H+]2CC[C@@H]3CCCC[C@@H]32)o1 ZINC000829029682 587480390 /nfs/dbraw/zinc/48/03/90/587480390.db2.gz YGIKYCLJNZDMCV-STQMWFEESA-N 1 1 248.370 3.563 20 0 BHADMO C[C@@]1(C[N@H+]2CCCC23CCC3)CC1(Cl)Cl ZINC000829282974 587491084 /nfs/dbraw/zinc/49/10/84/587491084.db2.gz GPXZUSVADYMEDY-JTQLQIEISA-N 1 1 248.197 3.589 20 0 BHADMO C[C@]1(C[N@H+]2CCCC23CCC3)CC1(Cl)Cl ZINC000829282975 587491280 /nfs/dbraw/zinc/49/12/80/587491280.db2.gz GPXZUSVADYMEDY-SNVBAGLBSA-N 1 1 248.197 3.589 20 0 BHADMO CC(C)c1[nH+]ccn1C[C@]1(C)CC1(Cl)Cl ZINC000829384863 587495306 /nfs/dbraw/zinc/49/53/06/587495306.db2.gz MVLQLNACDOGTRZ-JTQLQIEISA-N 1 1 247.169 3.590 20 0 BHADMO CC(C)c1[nH+]ccn1C[C@@]1(C)CC1(Cl)Cl ZINC000829384865 587495383 /nfs/dbraw/zinc/49/53/83/587495383.db2.gz MVLQLNACDOGTRZ-SNVBAGLBSA-N 1 1 247.169 3.590 20 0 BHADMO CC1=C(C)C[N@@H+](C[C@@]2(C)CC2(Cl)Cl)CC1 ZINC000829390486 587495278 /nfs/dbraw/zinc/49/52/78/587495278.db2.gz LIKZCICWHCVDBK-LLVKDONJSA-N 1 1 248.197 3.612 20 0 BHADMO CC1=C(C)C[N@@H+](C[C@]2(C)CC2(Cl)Cl)CC1 ZINC000829390487 587495291 /nfs/dbraw/zinc/49/52/91/587495291.db2.gz LIKZCICWHCVDBK-NSHDSACASA-N 1 1 248.197 3.612 20 0 BHADMO Cl/C=C\C[NH2+]C1(c2ccccc2Cl)CC1 ZINC000829475184 587499763 /nfs/dbraw/zinc/49/97/63/587499763.db2.gz HLFOJDPGODOHDC-BAQGIRSFSA-N 1 1 242.149 3.671 20 0 BHADMO Cl/C=C/C[NH2+]C1(c2ccccc2Cl)CC1 ZINC000829475185 587499739 /nfs/dbraw/zinc/49/97/39/587499739.db2.gz HLFOJDPGODOHDC-FPYGCLRLSA-N 1 1 242.149 3.671 20 0 BHADMO C[N@@H+](CCC(C)(C)C)C[C@H]1CC1(Cl)Cl ZINC000829922727 587528117 /nfs/dbraw/zinc/52/81/17/587528117.db2.gz UAFBHKPGORWVGO-SECBINFHSA-N 1 1 238.202 3.548 20 0 BHADMO C[N@@H+](CCC(C)(C)C)C[C@@H]1CC1(Cl)Cl ZINC000829922729 587528145 /nfs/dbraw/zinc/52/81/45/587528145.db2.gz UAFBHKPGORWVGO-VIFPVBQESA-N 1 1 238.202 3.548 20 0 BHADMO CCC(CC)[N@@H+](CC)Cc1csc(Cl)n1 ZINC000829926672 587528732 /nfs/dbraw/zinc/52/87/32/587528732.db2.gz CKXJEMPXKSTSLR-UHFFFAOYSA-N 1 1 246.807 3.807 20 0 BHADMO CC(C)c1cnc(C[N@@H+](C)CCC(C)(C)C)o1 ZINC000829932348 587528805 /nfs/dbraw/zinc/52/88/05/587528805.db2.gz GBSIRYGYLLGDRH-UHFFFAOYSA-N 1 1 238.375 3.666 20 0 BHADMO CC(C)c1cnc(C[N@H+](C)CCC(C)(C)C)o1 ZINC000829932348 587528803 /nfs/dbraw/zinc/52/88/03/587528803.db2.gz GBSIRYGYLLGDRH-UHFFFAOYSA-N 1 1 238.375 3.666 20 0 BHADMO C[N@@H+](CCC(C)(C)C)Cc1ccc2c(c1)COC2 ZINC000829947642 587529641 /nfs/dbraw/zinc/52/96/41/587529641.db2.gz ZRLVZRCERNJYEA-UHFFFAOYSA-N 1 1 247.382 3.585 20 0 BHADMO Cc1ccc(SCC[C@H]2CCC[N@@H+]2C)s1 ZINC000830051571 587533911 /nfs/dbraw/zinc/53/39/11/587533911.db2.gz BBROMZXJGBHFJK-LLVKDONJSA-N 1 1 241.425 3.633 20 0 BHADMO Cc1ccc(SCC[C@@H]2CCC[N@@H+]2C)s1 ZINC000830051572 587533728 /nfs/dbraw/zinc/53/37/28/587533728.db2.gz BBROMZXJGBHFJK-NSHDSACASA-N 1 1 241.425 3.633 20 0 BHADMO C[N@@H+](Cc1cc(Cl)nc(Cl)c1)C(C)(C)C ZINC000830546247 587557210 /nfs/dbraw/zinc/55/72/10/587557210.db2.gz UVXSNUNSFSFVII-UHFFFAOYSA-N 1 1 247.169 3.619 20 0 BHADMO FC1(F)CC(C[N@H+]2CCCC[C@@H]2C2CCC2)C1 ZINC000830994410 587580605 /nfs/dbraw/zinc/58/06/05/587580605.db2.gz OJFFSXONAZHHFH-CYBMUJFWSA-N 1 1 243.341 3.686 20 0 BHADMO FC1(F)CC(C[N@H+]2CCCC[C@H]2C2CCC2)C1 ZINC000830994415 587580337 /nfs/dbraw/zinc/58/03/37/587580337.db2.gz OJFFSXONAZHHFH-ZDUSSCGKSA-N 1 1 243.341 3.686 20 0 BHADMO CCC[C@@H]([NH2+]CC(F)(F)C(F)F)C(C)(C)C ZINC000831170235 587589065 /nfs/dbraw/zinc/58/90/65/587589065.db2.gz OXELEKPRXLHQNY-MRVPVSSYSA-N 1 1 243.288 3.691 20 0 BHADMO CCC[C@H]([NH2+]CC(F)(F)C(F)F)C(C)(C)C ZINC000831170237 587589074 /nfs/dbraw/zinc/58/90/74/587589074.db2.gz OXELEKPRXLHQNY-QMMMGPOBSA-N 1 1 243.288 3.691 20 0 BHADMO FCC[N@H+]1CCCC[C@@H]1c1ccc(Cl)cc1 ZINC000831982135 587641462 /nfs/dbraw/zinc/64/14/62/587641462.db2.gz UAZMKPHDUZLUAV-CYBMUJFWSA-N 1 1 241.737 3.837 20 0 BHADMO FCC[N@@H+]1CCCC[C@@H]1c1ccc(Cl)cc1 ZINC000831982135 587641461 /nfs/dbraw/zinc/64/14/61/587641461.db2.gz UAZMKPHDUZLUAV-CYBMUJFWSA-N 1 1 241.737 3.837 20 0 BHADMO FCC[N@H+]1CCCC[C@H]1c1ccc(Cl)cc1 ZINC000831982136 587641476 /nfs/dbraw/zinc/64/14/76/587641476.db2.gz UAZMKPHDUZLUAV-ZDUSSCGKSA-N 1 1 241.737 3.837 20 0 BHADMO FCC[N@@H+]1CCCC[C@H]1c1ccc(Cl)cc1 ZINC000831982136 587641474 /nfs/dbraw/zinc/64/14/74/587641474.db2.gz UAZMKPHDUZLUAV-ZDUSSCGKSA-N 1 1 241.737 3.837 20 0 BHADMO C[C@H]1CCC(C)(C)[N@H+]1C/C(Cl)=C\Cl ZINC000832564305 587666651 /nfs/dbraw/zinc/66/66/51/587666651.db2.gz FCYJGYJKXFZUPA-CYXIBPNKSA-N 1 1 222.159 3.568 20 0 BHADMO C[C@@H]1CCC(C)(C)[N@H+]1C/C(Cl)=C\Cl ZINC000832564310 587666406 /nfs/dbraw/zinc/66/64/06/587666406.db2.gz FCYJGYJKXFZUPA-GTUWVTDSSA-N 1 1 222.159 3.568 20 0 BHADMO C[C@H]1CCC(C)(C)[N@H+]1C/C(Cl)=C/Cl ZINC000832564311 587666682 /nfs/dbraw/zinc/66/66/82/587666682.db2.gz FCYJGYJKXFZUPA-HWPCKVLBSA-N 1 1 222.159 3.568 20 0 BHADMO C[C@@H]1CCC(C)(C)[N@H+]1C/C(Cl)=C/Cl ZINC000832564313 587666552 /nfs/dbraw/zinc/66/65/52/587666552.db2.gz FCYJGYJKXFZUPA-WSQKDGNHSA-N 1 1 222.159 3.568 20 0 BHADMO C[C@@H]1CCC(C)(C)[N@H+]1Cc1csc(Cl)n1 ZINC000832565405 587667291 /nfs/dbraw/zinc/66/72/91/587667291.db2.gz SRCPCWBYFPBTPG-MRVPVSSYSA-N 1 1 244.791 3.559 20 0 BHADMO C[C@@H]1CCC(C)(C)[N@@H+]1Cc1csc(Cl)n1 ZINC000832565405 587667289 /nfs/dbraw/zinc/66/72/89/587667289.db2.gz SRCPCWBYFPBTPG-MRVPVSSYSA-N 1 1 244.791 3.559 20 0 BHADMO C[C@H]1CCC(C)(C)[N@H+]1Cc1csc(Cl)n1 ZINC000832565414 587667023 /nfs/dbraw/zinc/66/70/23/587667023.db2.gz SRCPCWBYFPBTPG-QMMMGPOBSA-N 1 1 244.791 3.559 20 0 BHADMO C[C@H]1CCC(C)(C)[N@@H+]1Cc1csc(Cl)n1 ZINC000832565414 587667021 /nfs/dbraw/zinc/66/70/21/587667021.db2.gz SRCPCWBYFPBTPG-QMMMGPOBSA-N 1 1 244.791 3.559 20 0 BHADMO C[C@@H]1CCC(C)(C)[N@H+]1CCc1cccs1 ZINC000832565506 587667057 /nfs/dbraw/zinc/66/70/57/587667057.db2.gz UMLUIQGERXNQRP-LLVKDONJSA-N 1 1 223.385 3.554 20 0 BHADMO C[C@H]1CCC(C)(C)[N@H+]1CCc1cccs1 ZINC000832565507 587666928 /nfs/dbraw/zinc/66/69/28/587666928.db2.gz UMLUIQGERXNQRP-NSHDSACASA-N 1 1 223.385 3.554 20 0 BHADMO CC(C)c1cnc(C[N@H+]2[C@H](C)CCC2(C)C)o1 ZINC000832565517 587666899 /nfs/dbraw/zinc/66/68/99/587666899.db2.gz UPQSOQCFIVCPEE-LLVKDONJSA-N 1 1 236.359 3.561 20 0 BHADMO CC(C)c1cnc(C[N@H+]2[C@@H](C)CCC2(C)C)o1 ZINC000832565519 587666931 /nfs/dbraw/zinc/66/69/31/587666931.db2.gz UPQSOQCFIVCPEE-NSHDSACASA-N 1 1 236.359 3.561 20 0 BHADMO C[C@@H]1CCC(C)(C)[N@H+]1Cc1cnc(Cl)s1 ZINC000832566137 587666568 /nfs/dbraw/zinc/66/65/68/587666568.db2.gz ZTPREVLFLGLMOL-MRVPVSSYSA-N 1 1 244.791 3.559 20 0 BHADMO C[C@H]1CCC(C)(C)[N@H+]1Cc1cnc(Cl)s1 ZINC000832566139 587666473 /nfs/dbraw/zinc/66/64/73/587666473.db2.gz ZTPREVLFLGLMOL-QMMMGPOBSA-N 1 1 244.791 3.559 20 0 BHADMO CC(C)[N@@H+](C/C=C/Cl)C1CC(C)(C)C1 ZINC000832761925 587685652 /nfs/dbraw/zinc/68/56/52/587685652.db2.gz XRLZCOWBIRQNGQ-AATRIKPKSA-N 1 1 215.768 3.638 20 0 BHADMO CC(C)[N@@H+](C/C=C\Cl)C1CC(C)(C)C1 ZINC000832761926 587685507 /nfs/dbraw/zinc/68/55/07/587685507.db2.gz XRLZCOWBIRQNGQ-WAYWQWQTSA-N 1 1 215.768 3.638 20 0 BHADMO FCC[N@H+]1CC2(CCCC2)[C@@H]1c1ccccc1 ZINC000839127640 585093492 /nfs/dbraw/zinc/09/34/92/585093492.db2.gz WEHBVPJWOFIYFW-AWEZNQCLSA-N 1 1 233.330 3.573 20 0 BHADMO FCC[N@@H+]1CC2(CCCC2)[C@@H]1c1ccccc1 ZINC000839127640 585093491 /nfs/dbraw/zinc/09/34/91/585093491.db2.gz WEHBVPJWOFIYFW-AWEZNQCLSA-N 1 1 233.330 3.573 20 0 BHADMO FCC[N@H+]1CC2(CCCC2)[C@H]1c1ccccc1 ZINC000839127641 585093502 /nfs/dbraw/zinc/09/35/02/585093502.db2.gz WEHBVPJWOFIYFW-CQSZACIVSA-N 1 1 233.330 3.573 20 0 BHADMO FCC[N@@H+]1CC2(CCCC2)[C@H]1c1ccccc1 ZINC000839127641 585093501 /nfs/dbraw/zinc/09/35/01/585093501.db2.gz WEHBVPJWOFIYFW-CQSZACIVSA-N 1 1 233.330 3.573 20 0 BHADMO Cl/C=C\C[N@H+]1CCC[C@H]1c1ccccc1 ZINC000839272237 585100857 /nfs/dbraw/zinc/10/08/57/585100857.db2.gz GUCAKZNATBWXFW-QGOGUYACSA-N 1 1 221.731 3.576 20 0 BHADMO Cl/C=C\C[N@H+]1CCC[C@@H]1c1ccccc1 ZINC000839272241 585100902 /nfs/dbraw/zinc/10/09/02/585100902.db2.gz GUCAKZNATBWXFW-WYOARUQKSA-N 1 1 221.731 3.576 20 0 BHADMO C[N@@H+](CCF)[C@H]1CCCC[C@@H]1c1ccccc1 ZINC000839651556 585333470 /nfs/dbraw/zinc/33/34/70/585333470.db2.gz UTNMFNHIESDTFO-CABCVRRESA-N 1 1 235.346 3.614 20 0 BHADMO C[N@@H+](CCF)[C@H]1CCCC[C@H]1c1ccccc1 ZINC000839651557 585333400 /nfs/dbraw/zinc/33/34/00/585333400.db2.gz UTNMFNHIESDTFO-GJZGRUSLSA-N 1 1 235.346 3.614 20 0 BHADMO C[N@@H+](CCF)[C@@H]1CCCC[C@@H]1c1ccccc1 ZINC000839651558 585333307 /nfs/dbraw/zinc/33/33/07/585333307.db2.gz UTNMFNHIESDTFO-HUUCEWRRSA-N 1 1 235.346 3.614 20 0 BHADMO C[N@@H+](CCF)[C@@H]1CCCC[C@H]1c1ccccc1 ZINC000839651559 585333392 /nfs/dbraw/zinc/33/33/92/585333392.db2.gz UTNMFNHIESDTFO-LSDHHAIUSA-N 1 1 235.346 3.614 20 0 BHADMO CCC(CC)(CC)SCCc1c[nH+]cn1C ZINC000840208430 586546069 /nfs/dbraw/zinc/54/60/69/586546069.db2.gz ZNNVAKHBWNHZGQ-UHFFFAOYSA-N 1 1 240.416 3.665 20 0 BHADMO CC[N@@H+](Cc1coc(C2CC2)n1)C1CC(C)(C)C1 ZINC000840971269 587933275 /nfs/dbraw/zinc/93/32/75/587933275.db2.gz KSMPRPZPMCRFOO-UHFFFAOYSA-N 1 1 248.370 3.563 20 0 BHADMO CCCCC(N)=[NH+]OCC1CCC(F)(F)CC1 ZINC000842024534 587990056 /nfs/dbraw/zinc/99/00/56/587990056.db2.gz GCBLWQLEIIBKAW-UHFFFAOYSA-N 1 1 248.317 3.501 20 0 BHADMO CCCCC(N)=[NH+]OC[C@@H]1CCCCC1(F)F ZINC000842025944 587989815 /nfs/dbraw/zinc/98/98/15/587989815.db2.gz ZRTVJGRRMXUCSP-JTQLQIEISA-N 1 1 248.317 3.501 20 0 BHADMO CCCCC(N)=[NH+]OC[C@H]1CCCCC1(F)F ZINC000842025945 587987693 /nfs/dbraw/zinc/98/76/93/587987693.db2.gz ZRTVJGRRMXUCSP-SNVBAGLBSA-N 1 1 248.317 3.501 20 0 BHADMO Clc1ccccc1C1([NH2+]Cc2ccoc2)CC1 ZINC000842725224 588055928 /nfs/dbraw/zinc/05/59/28/588055928.db2.gz UHIZOTWERBZCRK-UHFFFAOYSA-N 1 1 247.725 3.712 20 0 BHADMO Fc1ccccc1C1([NH2+]Cc2ccoc2)CCC1 ZINC000842748482 588059042 /nfs/dbraw/zinc/05/90/42/588059042.db2.gz QTRPBQGVOOSRQU-UHFFFAOYSA-N 1 1 245.297 3.588 20 0 BHADMO CC[C@H]1C[C@@H](C[N@@H+](C)CCC(C)(C)C)CCO1 ZINC000843425154 588108269 /nfs/dbraw/zinc/10/82/69/588108269.db2.gz GERZDOFFGZSWAT-KBPBESRZSA-N 1 1 241.419 3.560 20 0 BHADMO CC[C@H]1C[C@H](C[N@@H+](C)CCC(C)(C)C)CCO1 ZINC000843425155 588108276 /nfs/dbraw/zinc/10/82/76/588108276.db2.gz GERZDOFFGZSWAT-KGLIPLIRSA-N 1 1 241.419 3.560 20 0 BHADMO CC[C@@H]1C[C@@H](C[N@@H+](C)CCC(C)(C)C)CCO1 ZINC000843425156 588108271 /nfs/dbraw/zinc/10/82/71/588108271.db2.gz GERZDOFFGZSWAT-UONOGXRCSA-N 1 1 241.419 3.560 20 0 BHADMO CC[C@@H]1C[C@H](C[N@@H+](C)CCC(C)(C)C)CCO1 ZINC000843425157 588108244 /nfs/dbraw/zinc/10/82/44/588108244.db2.gz GERZDOFFGZSWAT-ZIAGYGMSSA-N 1 1 241.419 3.560 20 0 BHADMO COc1cccc2cc(C[N@@H+](C)C(C)(C)C)oc21 ZINC000843430615 588108926 /nfs/dbraw/zinc/10/89/26/588108926.db2.gz BJUROFGYNHRWNT-UHFFFAOYSA-N 1 1 247.338 3.672 20 0 BHADMO C[N@@H+](Cc1ccnc(Cl)c1Cl)C(C)(C)C ZINC000843432685 588109414 /nfs/dbraw/zinc/10/94/14/588109414.db2.gz HOLGPNRYAQVCSD-UHFFFAOYSA-N 1 1 247.169 3.619 20 0 BHADMO CC[N@@H+](CCSC)Cc1cc(Cl)cs1 ZINC000843437341 588110135 /nfs/dbraw/zinc/11/01/35/588110135.db2.gz CNAMMXBZVKDNMD-UHFFFAOYSA-N 1 1 249.832 3.586 20 0 BHADMO ClC1(Cl)C[C@@H]1CC[N@H+]1CCC12CCCC2 ZINC000844355700 588187270 /nfs/dbraw/zinc/18/72/70/588187270.db2.gz BOKKXBZBSMMKAR-JTQLQIEISA-N 1 1 248.197 3.589 20 0 BHADMO ClC1(Cl)C[C@H]1CC[N@H+]1CCC12CCCC2 ZINC000844355725 588187408 /nfs/dbraw/zinc/18/74/08/588187408.db2.gz BOKKXBZBSMMKAR-SNVBAGLBSA-N 1 1 248.197 3.589 20 0 BHADMO CC(C)(C)SCC[N@H+]1CCC12CCCC2 ZINC000844359309 588187201 /nfs/dbraw/zinc/18/72/01/588187201.db2.gz JAVCKCAJYMDGJR-UHFFFAOYSA-N 1 1 227.417 3.537 20 0 BHADMO C[C@@]1(C[N@H+]2CCC23CCCC3)CC1(Cl)Cl ZINC000844360213 645322920 /nfs/dbraw/zinc/32/29/20/645322920.db2.gz PANQLHIJVJMHSQ-JTQLQIEISA-N 1 1 248.197 3.589 20 0 BHADMO C[C@]1(C[N@H+]2CCC23CCCC3)CC1(Cl)Cl ZINC000844360215 645321674 /nfs/dbraw/zinc/32/16/74/645321674.db2.gz PANQLHIJVJMHSQ-SNVBAGLBSA-N 1 1 248.197 3.589 20 0 BHADMO FCc1ccc(C[N@H+]2CCC23CCCC3)cc1 ZINC000844361408 588187807 /nfs/dbraw/zinc/18/78/07/588187807.db2.gz ZWTCPMUVLWUQJK-UHFFFAOYSA-N 1 1 233.330 3.675 20 0 BHADMO FC1(F)C[C@@]12CCC[N@@H+](CC1CCCCC1)C2 ZINC000844433977 588192093 /nfs/dbraw/zinc/19/20/93/588192093.db2.gz IHXMNVLRFICRER-CYBMUJFWSA-N 1 1 243.341 3.688 20 0 BHADMO FC1(F)C[C@]12CCC[N@@H+](CC1CCCCC1)C2 ZINC000844433979 588192352 /nfs/dbraw/zinc/19/23/52/588192352.db2.gz IHXMNVLRFICRER-ZDUSSCGKSA-N 1 1 243.341 3.688 20 0 BHADMO CCCCCC[N@H+]1CCC[C@@]2(CC2(F)F)C1 ZINC000844436530 588193186 /nfs/dbraw/zinc/19/31/86/588193186.db2.gz INYYLZVAQBJEMS-GFCCVEGCSA-N 1 1 231.330 3.688 20 0 BHADMO CCCCCC[N@H+]1CCC[C@]2(CC2(F)F)C1 ZINC000844436532 588192755 /nfs/dbraw/zinc/19/27/55/588192755.db2.gz INYYLZVAQBJEMS-LBPRGKRZSA-N 1 1 231.330 3.688 20 0 BHADMO CC(C)(C)CCC[N@H+]1CCC[C@@]2(CC2(F)F)C1 ZINC000844438473 588192759 /nfs/dbraw/zinc/19/27/59/588192759.db2.gz DEKUDBQZQALBBL-CYBMUJFWSA-N 1 1 245.357 3.934 20 0 BHADMO CC(C)(C)CCC[N@H+]1CCC[C@]2(CC2(F)F)C1 ZINC000844438484 645330118 /nfs/dbraw/zinc/33/01/18/645330118.db2.gz DEKUDBQZQALBBL-ZDUSSCGKSA-N 1 1 245.357 3.934 20 0 BHADMO CC(C)(C)CC[N@H+]1CCC[C@@]2(CC2(F)F)C1 ZINC000844439060 588193839 /nfs/dbraw/zinc/19/38/39/588193839.db2.gz MTUZZWXNAVZCAB-GFCCVEGCSA-N 1 1 231.330 3.544 20 0 BHADMO CC(C)(C)CC[N@H+]1CCC[C@]2(CC2(F)F)C1 ZINC000844439062 588194015 /nfs/dbraw/zinc/19/40/15/588194015.db2.gz MTUZZWXNAVZCAB-LBPRGKRZSA-N 1 1 231.330 3.544 20 0 BHADMO FC1(F)C[C@@]12CCC[N@@H+](CCC1CCCC1)C2 ZINC000844439135 588193635 /nfs/dbraw/zinc/19/36/35/588193635.db2.gz NGROGTUZLACVFB-CYBMUJFWSA-N 1 1 243.341 3.688 20 0 BHADMO FC1(F)C[C@]12CCC[N@@H+](CCC1CCCC1)C2 ZINC000844439137 588193560 /nfs/dbraw/zinc/19/35/60/588193560.db2.gz NGROGTUZLACVFB-ZDUSSCGKSA-N 1 1 243.341 3.688 20 0 BHADMO CCC(C)(C)CC[N@H+]1CCC[C@@]2(CC2(F)F)C1 ZINC000844439623 588193763 /nfs/dbraw/zinc/19/37/63/588193763.db2.gz PJARKCKOCCSYHZ-CYBMUJFWSA-N 1 1 245.357 3.934 20 0 BHADMO CCC(C)(C)CC[N@H+]1CCC[C@]2(CC2(F)F)C1 ZINC000844439626 588194030 /nfs/dbraw/zinc/19/40/30/588194030.db2.gz PJARKCKOCCSYHZ-ZDUSSCGKSA-N 1 1 245.357 3.934 20 0 BHADMO CC(C)C[C@@H](C)C[N@H+]1CCC[C@@]2(CC2(F)F)C1 ZINC000844440094 588193977 /nfs/dbraw/zinc/19/39/77/588193977.db2.gz BFJTUAKZDSVDIR-CHWSQXEVSA-N 1 1 245.357 3.790 20 0 BHADMO CC(C)C[C@@H](C)C[N@H+]1CCC[C@]2(CC2(F)F)C1 ZINC000844440095 645329912 /nfs/dbraw/zinc/32/99/12/645329912.db2.gz BFJTUAKZDSVDIR-OLZOCXBDSA-N 1 1 245.357 3.790 20 0 BHADMO CC(C)C[C@H](C)C[N@H+]1CCC[C@@]2(CC2(F)F)C1 ZINC000844440097 645330234 /nfs/dbraw/zinc/33/02/34/645330234.db2.gz BFJTUAKZDSVDIR-QWHCGFSZSA-N 1 1 245.357 3.790 20 0 BHADMO CC(C)C[C@H](C)C[N@H+]1CCC[C@]2(CC2(F)F)C1 ZINC000844440099 645330911 /nfs/dbraw/zinc/33/09/11/645330911.db2.gz BFJTUAKZDSVDIR-STQMWFEESA-N 1 1 245.357 3.790 20 0 BHADMO CC(C)CCC[N@H+]1CCC[C@@]2(CC2(F)F)C1 ZINC000844441725 588194098 /nfs/dbraw/zinc/19/40/98/588194098.db2.gz RMIMIESICPHEGB-GFCCVEGCSA-N 1 1 231.330 3.544 20 0 BHADMO CC(C)CCC[N@H+]1CCC[C@]2(CC2(F)F)C1 ZINC000844441726 588193748 /nfs/dbraw/zinc/19/37/48/588193748.db2.gz RMIMIESICPHEGB-LBPRGKRZSA-N 1 1 231.330 3.544 20 0 BHADMO CC(C)C[C@@H](C)[N@H+]1CCC[C@]2(CC2(F)F)C1 ZINC000844445348 645334518 /nfs/dbraw/zinc/33/45/18/645334518.db2.gz XZTVESOAHBADPV-NEPJUHHUSA-N 1 1 231.330 3.542 20 0 BHADMO CC(C)C[C@H](C)[N@H+]1CCC[C@@]2(CC2(F)F)C1 ZINC000844445351 645334438 /nfs/dbraw/zinc/33/44/38/645334438.db2.gz XZTVESOAHBADPV-NWDGAFQWSA-N 1 1 231.330 3.542 20 0 BHADMO CC(C)C[C@H](C)[N@H+]1CCC[C@]2(CC2(F)F)C1 ZINC000844445352 645334705 /nfs/dbraw/zinc/33/47/05/645334705.db2.gz XZTVESOAHBADPV-RYUDHWBXSA-N 1 1 231.330 3.542 20 0 BHADMO CC(C)C[C@@H](C)[N@H+]1CCC[C@@]2(CC2(F)F)C1 ZINC000844445353 645334345 /nfs/dbraw/zinc/33/43/45/645334345.db2.gz XZTVESOAHBADPV-VXGBXAGGSA-N 1 1 231.330 3.542 20 0 BHADMO Clc1csc(C[N@H+]2CCC23CCCC3)c1 ZINC000845998294 588253047 /nfs/dbraw/zinc/25/30/47/588253047.db2.gz BIXIIGXKMQAOPO-UHFFFAOYSA-N 1 1 241.787 3.920 20 0 BHADMO C[C@@H](C[N@H+]1CCC[C@]2(CC2(F)F)C1)C(C)(C)C ZINC000846104908 588256691 /nfs/dbraw/zinc/25/66/91/588256691.db2.gz MZFCGXHEHORSGY-AAEUAGOBSA-N 1 1 245.357 3.790 20 0 BHADMO C[C@H](C[N@H+]1CCC[C@@]2(CC2(F)F)C1)C(C)(C)C ZINC000846104910 588256707 /nfs/dbraw/zinc/25/67/07/588256707.db2.gz MZFCGXHEHORSGY-DGCLKSJQSA-N 1 1 245.357 3.790 20 0 BHADMO C[C@@H](C[N@H+]1CCC[C@@]2(CC2(F)F)C1)C(C)(C)C ZINC000846104912 588256630 /nfs/dbraw/zinc/25/66/30/588256630.db2.gz MZFCGXHEHORSGY-WCQYABFASA-N 1 1 245.357 3.790 20 0 BHADMO C[C@H](C[N@H+]1CCC[C@]2(CC2(F)F)C1)C(C)(C)C ZINC000846104915 588256671 /nfs/dbraw/zinc/25/66/71/588256671.db2.gz MZFCGXHEHORSGY-YPMHNXCESA-N 1 1 245.357 3.790 20 0 BHADMO CCC[C@@H](C)C[N@H+]1CCC[C@]2(CC2(F)F)C1 ZINC000846105142 588256829 /nfs/dbraw/zinc/25/68/29/588256829.db2.gz QKRZGISCJJMLQE-NEPJUHHUSA-N 1 1 231.330 3.544 20 0 BHADMO CCC[C@H](C)C[N@H+]1CCC[C@@]2(CC2(F)F)C1 ZINC000846105144 588256553 /nfs/dbraw/zinc/25/65/53/588256553.db2.gz QKRZGISCJJMLQE-NWDGAFQWSA-N 1 1 231.330 3.544 20 0 BHADMO CCC[C@H](C)C[N@H+]1CCC[C@]2(CC2(F)F)C1 ZINC000846105146 588256661 /nfs/dbraw/zinc/25/66/61/588256661.db2.gz QKRZGISCJJMLQE-RYUDHWBXSA-N 1 1 231.330 3.544 20 0 BHADMO CCC[C@@H](C)C[N@H+]1CCC[C@@]2(CC2(F)F)C1 ZINC000846105148 588256693 /nfs/dbraw/zinc/25/66/93/588256693.db2.gz QKRZGISCJJMLQE-VXGBXAGGSA-N 1 1 231.330 3.544 20 0 BHADMO CCC(CC)C[N@H+]1CCC[C@@]2(CC2(F)F)C1 ZINC000846107110 588256929 /nfs/dbraw/zinc/25/69/29/588256929.db2.gz FKYSZQZWIAASDQ-GFCCVEGCSA-N 1 1 231.330 3.544 20 0 BHADMO CCC(CC)C[N@H+]1CCC[C@]2(CC2(F)F)C1 ZINC000846107111 588257118 /nfs/dbraw/zinc/25/71/18/588257118.db2.gz FKYSZQZWIAASDQ-LBPRGKRZSA-N 1 1 231.330 3.544 20 0 BHADMO FC1(F)[C@H]2C[N@@H+](CCC3CCCCCC3)C[C@H]21 ZINC000846112009 588257217 /nfs/dbraw/zinc/25/72/17/588257217.db2.gz ARCGTUJXRSANGQ-BETUJISGSA-N 1 1 243.341 3.544 20 0 BHADMO FC1(F)[C@H]2C[N@@H+](CCCC3CCCCC3)C[C@H]21 ZINC000846112127 582650749 /nfs/dbraw/zinc/65/07/49/582650749.db2.gz PQTFPPJMKCCRAT-BETUJISGSA-N 1 1 243.341 3.544 20 0 BHADMO CC(C)(CC[N@H+]1CC[C@@H](C(F)(F)F)C1)C1CC1 ZINC000846837837 588292404 /nfs/dbraw/zinc/29/24/04/588292404.db2.gz QVMCOPNDEHWBMY-LLVKDONJSA-N 1 1 249.320 3.697 20 0 BHADMO CC(C)(CC[N@H+]1CC[C@H](C(F)(F)F)C1)C1CC1 ZINC000846837841 588292313 /nfs/dbraw/zinc/29/23/13/588292313.db2.gz QVMCOPNDEHWBMY-NSHDSACASA-N 1 1 249.320 3.697 20 0 BHADMO CCC[N@@H+](C[C@]1(C)CC1(Cl)Cl)C(C)C ZINC000847023238 588303381 /nfs/dbraw/zinc/30/33/81/588303381.db2.gz BATVVYCZZVZLFU-JTQLQIEISA-N 1 1 238.202 3.691 20 0 BHADMO CCC[N@@H+](C[C@@]1(C)CC1(Cl)Cl)C(C)C ZINC000847023241 588303433 /nfs/dbraw/zinc/30/34/33/588303433.db2.gz BATVVYCZZVZLFU-SNVBAGLBSA-N 1 1 238.202 3.691 20 0 BHADMO CCC[N@@H+](Cc1cncc2ccccc21)C(C)C ZINC000847028069 645420610 /nfs/dbraw/zinc/42/06/10/645420610.db2.gz QVNBDGQOMQHNAW-UHFFFAOYSA-N 1 1 242.366 3.855 20 0 BHADMO CCC[N@@H+](Cc1ccc(CF)cc1)C(C)C ZINC000847028123 645419948 /nfs/dbraw/zinc/41/99/48/645419948.db2.gz RGSFZWXPPXRKGZ-UHFFFAOYSA-N 1 1 223.335 3.777 20 0 BHADMO CCC[N@@H+](CC[C@H]1CC1(Cl)Cl)C(C)C ZINC000847029063 588304245 /nfs/dbraw/zinc/30/42/45/588304245.db2.gz VUGNGEKLUGSHAY-JTQLQIEISA-N 1 1 238.202 3.691 20 0 BHADMO CCC[N@@H+](CC[C@@H]1CC1(Cl)Cl)C(C)C ZINC000847029065 588304206 /nfs/dbraw/zinc/30/42/06/588304206.db2.gz VUGNGEKLUGSHAY-SNVBAGLBSA-N 1 1 238.202 3.691 20 0 BHADMO C[C@H]1CC[C@H](Nc2cc(C3CC3)cc[nH+]2)CS1 ZINC000848551057 588396341 /nfs/dbraw/zinc/39/63/41/588396341.db2.gz CHHUALFLNBWDRI-GWCFXTLKSA-N 1 1 248.395 3.655 20 0 BHADMO C[C@H]1CC[C@@H](Nc2cc(C3CC3)cc[nH+]2)CS1 ZINC000848551058 588396751 /nfs/dbraw/zinc/39/67/51/588396751.db2.gz CHHUALFLNBWDRI-GXFFZTMASA-N 1 1 248.395 3.655 20 0 BHADMO C[C@@H]1CC[C@H](Nc2cc(C3CC3)cc[nH+]2)CS1 ZINC000848551059 588396172 /nfs/dbraw/zinc/39/61/72/588396172.db2.gz CHHUALFLNBWDRI-MFKMUULPSA-N 1 1 248.395 3.655 20 0 BHADMO C[C@@H]1CC[C@@H](Nc2cc(C3CC3)cc[nH+]2)CS1 ZINC000848551060 588396371 /nfs/dbraw/zinc/39/63/71/588396371.db2.gz CHHUALFLNBWDRI-ZWNOBZJWSA-N 1 1 248.395 3.655 20 0 BHADMO C[C@H]1CC[C@@H](Nc2cccc(C3CC3)[nH+]2)CS1 ZINC000848554327 588396767 /nfs/dbraw/zinc/39/67/67/588396767.db2.gz YHLDSLVKYAKPLI-CMPLNLGQSA-N 1 1 248.395 3.655 20 0 BHADMO C[C@H]1CC[C@H](Nc2cccc(C3CC3)[nH+]2)CS1 ZINC000848554328 588396663 /nfs/dbraw/zinc/39/66/63/588396663.db2.gz YHLDSLVKYAKPLI-JQWIXIFHSA-N 1 1 248.395 3.655 20 0 BHADMO C[C@@H]1CC[C@H](Nc2cccc(C3CC3)[nH+]2)CS1 ZINC000848554329 588396609 /nfs/dbraw/zinc/39/66/09/588396609.db2.gz YHLDSLVKYAKPLI-PWSUYJOCSA-N 1 1 248.395 3.655 20 0 BHADMO C[C@@H]1CC[C@@H](Nc2cccc(C3CC3)[nH+]2)CS1 ZINC000848554330 588396440 /nfs/dbraw/zinc/39/64/40/588396440.db2.gz YHLDSLVKYAKPLI-ZYHUDNBSSA-N 1 1 248.395 3.655 20 0 BHADMO COCCCC[N@@H+](C)Cc1ccccc1C(C)C ZINC000848918007 588421087 /nfs/dbraw/zinc/42/10/87/588421087.db2.gz MRGALVIPUMUTER-UHFFFAOYSA-N 1 1 249.398 3.668 20 0 BHADMO CCC[N@@H+](Cc1cnc(Cl)c(C)c1)C(C)C ZINC000848923455 588420747 /nfs/dbraw/zinc/42/07/47/588420747.db2.gz KDDKGDHBAHKSCB-UHFFFAOYSA-N 1 1 240.778 3.664 20 0 BHADMO CCC[N@@H+](Cc1cc(C)oc1C)C(C)C ZINC000848923508 588421391 /nfs/dbraw/zinc/42/13/91/588421391.db2.gz MAFGEOWKSKJZDU-UHFFFAOYSA-N 1 1 209.333 3.517 20 0 BHADMO c1cc(C2CC2)cc(N[C@@H]2CCCSCC2)[nH+]1 ZINC000850471312 588549277 /nfs/dbraw/zinc/54/92/77/588549277.db2.gz PKIKLUYSZXWNFO-CYBMUJFWSA-N 1 1 248.395 3.657 20 0 BHADMO c1cc(C2CC2)cc(N[C@H]2CCCSCC2)[nH+]1 ZINC000850471313 588548880 /nfs/dbraw/zinc/54/88/80/588548880.db2.gz PKIKLUYSZXWNFO-ZDUSSCGKSA-N 1 1 248.395 3.657 20 0 BHADMO CC(C)c1nc([C@@H](C)[NH2+][C@@H]2C=CCC2)cs1 ZINC000850507336 588553128 /nfs/dbraw/zinc/55/31/28/588553128.db2.gz FJKUEJYYVWGSNU-GHMZBOCLSA-N 1 1 236.384 3.636 20 0 BHADMO CC(C)c1nc([C@@H](C)[NH2+][C@H]2C=CCC2)cs1 ZINC000850507338 588553222 /nfs/dbraw/zinc/55/32/22/588553222.db2.gz FJKUEJYYVWGSNU-MNOVXSKESA-N 1 1 236.384 3.636 20 0 BHADMO CC(C)c1nc([C@H](C)[NH2+][C@H]2C=CCC2)cs1 ZINC000850507358 588553124 /nfs/dbraw/zinc/55/31/24/588553124.db2.gz FJKUEJYYVWGSNU-QWRGUYRKSA-N 1 1 236.384 3.636 20 0 BHADMO CC(C)c1nc([C@H](C)[NH2+][C@@H]2C=CCC2)cs1 ZINC000850507360 711677433 /nfs/dbraw/zinc/67/74/33/711677433.db2.gz FJKUEJYYVWGSNU-WDEREUQCSA-N 1 1 236.384 3.636 20 0 BHADMO Cc1cc([C@@H]2CCC[N@H+]2CCCC2CCC2)no1 ZINC000851716662 588616081 /nfs/dbraw/zinc/61/60/81/588616081.db2.gz PCPBKWSPKFPQMX-HNNXBMFYSA-N 1 1 248.370 3.700 20 0 BHADMO Cc1cc([C@H]2CCC[N@H+]2CCCC2CCC2)no1 ZINC000851716663 588616254 /nfs/dbraw/zinc/61/62/54/588616254.db2.gz PCPBKWSPKFPQMX-OAHLLOKOSA-N 1 1 248.370 3.700 20 0 BHADMO C[N@@H+](CC=C(Cl)Cl)C1CCCCC1 ZINC000851718593 588616517 /nfs/dbraw/zinc/61/65/17/588616517.db2.gz MEOZGQGATCJTBV-UHFFFAOYSA-N 1 1 222.159 3.570 20 0 BHADMO CCCCC[N@@H+](Cc1cccc(F)n1)C(C)C ZINC000851725862 588617619 /nfs/dbraw/zinc/61/76/19/588617619.db2.gz HFOSIFITKFHOEX-UHFFFAOYSA-N 1 1 238.350 3.621 20 0 BHADMO CC[N@@H+](CC=C(Cl)Cl)C1CCCC1 ZINC000851727201 588618361 /nfs/dbraw/zinc/61/83/61/588618361.db2.gz GJAUEWFUSSLUSM-UHFFFAOYSA-N 1 1 222.159 3.570 20 0 BHADMO Fc1cccc(C[N@@H+](C2CC2)C2CCCCC2)n1 ZINC000851727566 588618333 /nfs/dbraw/zinc/61/83/33/588618333.db2.gz QWSPTHJZAJMIES-UHFFFAOYSA-N 1 1 248.345 3.518 20 0 BHADMO C[C@H](C1CC1)[N@@H+](CC=C(Cl)Cl)C1CC1 ZINC000851727672 588618308 /nfs/dbraw/zinc/61/83/08/588618308.db2.gz UZKGLQLOULFUPR-MRVPVSSYSA-N 1 1 234.170 3.568 20 0 BHADMO C[C@@H](C1CC1)[N@@H+](CC=C(Cl)Cl)C1CC1 ZINC000851727673 588618556 /nfs/dbraw/zinc/61/85/56/588618556.db2.gz UZKGLQLOULFUPR-QMMMGPOBSA-N 1 1 234.170 3.568 20 0 BHADMO CC[N@@H+](CCc1nsc2ccccc21)C(C)C ZINC000851732919 588620138 /nfs/dbraw/zinc/62/01/38/588620138.db2.gz DIJMXUNIEJWFSK-UHFFFAOYSA-N 1 1 248.395 3.569 20 0 BHADMO CC[N@@H+](Cc1nsc2ccccc21)C(C)C ZINC000851733201 633175071 /nfs/dbraw/zinc/17/50/71/633175071.db2.gz MZYYDVGAEKVFIH-UHFFFAOYSA-N 1 1 234.368 3.527 20 0 BHADMO CC[N@@H+](Cc1cccc(OC)c1Cl)C(C)C ZINC000851733229 588620171 /nfs/dbraw/zinc/62/01/71/588620171.db2.gz OEURWIDHMHCGPD-UHFFFAOYSA-N 1 1 241.762 3.579 20 0 BHADMO CC[N@@H+](Cc1cccc(SC)c1)C(C)C ZINC000851733495 588620075 /nfs/dbraw/zinc/62/00/75/588620075.db2.gz XKNXXQOFMQKQFF-UHFFFAOYSA-N 1 1 223.385 3.639 20 0 BHADMO ClC(Cl)=CC[N@@H+](C1CC1)C1CCCC1 ZINC000851763532 588624668 /nfs/dbraw/zinc/62/46/68/588624668.db2.gz SRIRWZUFRVXUTH-UHFFFAOYSA-N 1 1 234.170 3.712 20 0 BHADMO CC[C@H](CC(F)F)C[N@H+]1CCC2(CCCC2)C1 ZINC000851789512 588628964 /nfs/dbraw/zinc/62/89/64/588628964.db2.gz BALXCLATBJQLDG-GFCCVEGCSA-N 1 1 245.357 3.934 20 0 BHADMO CC[C@@H](CC(F)F)C[N@H+]1CCC2(CCCC2)C1 ZINC000851789513 588628613 /nfs/dbraw/zinc/62/86/13/588628613.db2.gz BALXCLATBJQLDG-LBPRGKRZSA-N 1 1 245.357 3.934 20 0 BHADMO CC(C)=CCC[N@H+](C)Cc1ccc(Cl)nc1 ZINC000851799035 588630107 /nfs/dbraw/zinc/63/01/07/588630107.db2.gz LADWQTZSBSIBDG-UHFFFAOYSA-N 1 1 238.762 3.523 20 0 BHADMO CC[N@@H+](CCCC1CCC1)CCc1ccccn1 ZINC000851824808 588633867 /nfs/dbraw/zinc/63/38/67/588633867.db2.gz MPCLRJCNKVVRGF-UHFFFAOYSA-N 1 1 246.398 3.526 20 0 BHADMO CC(C)[N@@H+](CC=C(Cl)Cl)C1CCC1 ZINC000851848714 588634609 /nfs/dbraw/zinc/63/46/09/588634609.db2.gz NSYOTDIFNYNILQ-UHFFFAOYSA-N 1 1 222.159 3.568 20 0 BHADMO Fc1cccc(C[N@H+]2CCCC23CCCCC3)n1 ZINC000851871275 588637037 /nfs/dbraw/zinc/63/70/37/588637037.db2.gz OUUFSZGXKAUMBU-UHFFFAOYSA-N 1 1 248.345 3.519 20 0 BHADMO ClC(Cl)=CC[NH2+]C1(c2ccccc2)CC1 ZINC000851896330 588641714 /nfs/dbraw/zinc/64/17/14/588641714.db2.gz CSOPXPBFRKLQFC-UHFFFAOYSA-N 1 1 242.149 3.584 20 0 BHADMO CC[C@H](CC(F)F)C[N@H+]1CCCC12CCC2 ZINC000851988699 588652650 /nfs/dbraw/zinc/65/26/50/588652650.db2.gz CGHYMGHFMXOJFG-LLVKDONJSA-N 1 1 231.330 3.686 20 0 BHADMO CC[C@@H](CC(F)F)C[N@H+]1CCCC12CCC2 ZINC000851988700 588652594 /nfs/dbraw/zinc/65/25/94/588652594.db2.gz CGHYMGHFMXOJFG-NSHDSACASA-N 1 1 231.330 3.686 20 0 BHADMO C[N@@H+](CC=C(Cl)Cl)C1(C)CCCC1 ZINC000851993705 588652910 /nfs/dbraw/zinc/65/29/10/588652910.db2.gz KUPYUGKGIYSSIQ-UHFFFAOYSA-N 1 1 222.159 3.570 20 0 BHADMO ClC(Cl)=CC[N@@H+](CC1CC1)C1CCC1 ZINC000852002988 588654393 /nfs/dbraw/zinc/65/43/93/588654393.db2.gz HKUZOKOHHVIIJE-UHFFFAOYSA-N 1 1 234.170 3.570 20 0 BHADMO Clc1cccc2c1C[N@@H+](CC1CC=CC1)C2 ZINC000852050168 588657939 /nfs/dbraw/zinc/65/79/39/588657939.db2.gz JEFLYUFJDVLXPH-UHFFFAOYSA-N 1 1 233.742 3.622 20 0 BHADMO C[C@H]1CCC(C)(C)[N@H+]1Cc1ccsc1 ZINC000852147860 588667148 /nfs/dbraw/zinc/66/71/48/588667148.db2.gz LVMKHBIKIBUPRY-JTQLQIEISA-N 1 1 209.358 3.511 20 0 BHADMO C[C@@H]1CCC(C)(C)[N@H+]1Cc1ccsc1 ZINC000852147862 588667208 /nfs/dbraw/zinc/66/72/08/588667208.db2.gz LVMKHBIKIBUPRY-SNVBAGLBSA-N 1 1 209.358 3.511 20 0 BHADMO FC1(F)C[C@@]12CCC[N@@H+](CCCC1CCC1)C2 ZINC000852212607 588672486 /nfs/dbraw/zinc/67/24/86/588672486.db2.gz DCMBXGQARWGGHD-CYBMUJFWSA-N 1 1 243.341 3.688 20 0 BHADMO FC1(F)C[C@]12CCC[N@@H+](CCCC1CCC1)C2 ZINC000852212608 588672537 /nfs/dbraw/zinc/67/25/37/588672537.db2.gz DCMBXGQARWGGHD-ZDUSSCGKSA-N 1 1 243.341 3.688 20 0 BHADMO FCc1ccc(C[N@H+]2C[C@@H]3CCCC[C@@H]32)cc1 ZINC000852219722 588673626 /nfs/dbraw/zinc/67/36/26/588673626.db2.gz CKVCCQSJBCQUOH-GJZGRUSLSA-N 1 1 233.330 3.531 20 0 BHADMO CC[C@@H](C)[N@@H+](CC)Cc1ccc(CF)cc1 ZINC000852289968 588676284 /nfs/dbraw/zinc/67/62/84/588676284.db2.gz BXPYFDSDGDGFDN-GFCCVEGCSA-N 1 1 223.335 3.777 20 0 BHADMO CC[C@H](C)[N@@H+](CC)Cc1ccc(CF)cc1 ZINC000852289969 588676603 /nfs/dbraw/zinc/67/66/03/588676603.db2.gz BXPYFDSDGDGFDN-LBPRGKRZSA-N 1 1 223.335 3.777 20 0 BHADMO CC[C@@H](C)[N@@H+](CC)CC[C@@H]1CC1(Cl)Cl ZINC000852291300 588676343 /nfs/dbraw/zinc/67/63/43/588676343.db2.gz SQCJRTFXRMAIJU-NXEZZACHSA-N 1 1 238.202 3.691 20 0 BHADMO CC[C@H](C)[N@@H+](CC)CC[C@H]1CC1(Cl)Cl ZINC000852291305 588676517 /nfs/dbraw/zinc/67/65/17/588676517.db2.gz SQCJRTFXRMAIJU-UWVGGRQHSA-N 1 1 238.202 3.691 20 0 BHADMO CC[C@H](C)[N@@H+](CC)CC[C@@H]1CC1(Cl)Cl ZINC000852291307 588676365 /nfs/dbraw/zinc/67/63/65/588676365.db2.gz SQCJRTFXRMAIJU-VHSXEESVSA-N 1 1 238.202 3.691 20 0 BHADMO CC[C@@H](C)[N@@H+](CC)CC[C@H]1CC1(Cl)Cl ZINC000852291309 588676469 /nfs/dbraw/zinc/67/64/69/588676469.db2.gz SQCJRTFXRMAIJU-ZJUUUORDSA-N 1 1 238.202 3.691 20 0 BHADMO CC[C@@H](C)[N@@H+](CC)C[C@@]1(C)CC1(Cl)Cl ZINC000852291472 588676525 /nfs/dbraw/zinc/67/65/25/588676525.db2.gz WOAZORNDCDBZEP-NXEZZACHSA-N 1 1 238.202 3.691 20 0 BHADMO CC[C@H](C)[N@@H+](CC)C[C@]1(C)CC1(Cl)Cl ZINC000852291474 588676506 /nfs/dbraw/zinc/67/65/06/588676506.db2.gz WOAZORNDCDBZEP-UWVGGRQHSA-N 1 1 238.202 3.691 20 0 BHADMO CC[C@H](C)[N@@H+](CC)C[C@@]1(C)CC1(Cl)Cl ZINC000852291475 588676417 /nfs/dbraw/zinc/67/64/17/588676417.db2.gz WOAZORNDCDBZEP-VHSXEESVSA-N 1 1 238.202 3.691 20 0 BHADMO CC[C@@H](C)[N@@H+](CC)C[C@]1(C)CC1(Cl)Cl ZINC000852291477 588676396 /nfs/dbraw/zinc/67/63/96/588676396.db2.gz WOAZORNDCDBZEP-ZJUUUORDSA-N 1 1 238.202 3.691 20 0 BHADMO Fc1ccc([C@@H]2CC[N@H+]2Cc2ccsc2)cc1 ZINC000852469223 645485671 /nfs/dbraw/zinc/48/56/71/645485671.db2.gz UPIKKQQLDYWEMM-AWEZNQCLSA-N 1 1 247.338 3.834 20 0 BHADMO Fc1ccc([C@@H]2CC[N@@H+]2Cc2ccsc2)cc1 ZINC000852469223 645485666 /nfs/dbraw/zinc/48/56/66/645485666.db2.gz UPIKKQQLDYWEMM-AWEZNQCLSA-N 1 1 247.338 3.834 20 0 BHADMO Fc1ccc([C@H]2CC[N@H+]2Cc2ccsc2)cc1 ZINC000852469401 645485238 /nfs/dbraw/zinc/48/52/38/645485238.db2.gz UPIKKQQLDYWEMM-CQSZACIVSA-N 1 1 247.338 3.834 20 0 BHADMO Fc1ccc([C@H]2CC[N@@H+]2Cc2ccsc2)cc1 ZINC000852469401 645485232 /nfs/dbraw/zinc/48/52/32/645485232.db2.gz UPIKKQQLDYWEMM-CQSZACIVSA-N 1 1 247.338 3.834 20 0 BHADMO CC(C)(C)SCC[N@H+]1CCC[C@H](CCF)C1 ZINC000852531602 588688291 /nfs/dbraw/zinc/68/82/91/588688291.db2.gz RFGVLAMGRIBHCO-GFCCVEGCSA-N 1 1 247.423 3.590 20 0 BHADMO CC(C)(C)SCC[N@H+]1CCC[C@@H](CCF)C1 ZINC000852531603 588688074 /nfs/dbraw/zinc/68/80/74/588688074.db2.gz RFGVLAMGRIBHCO-LBPRGKRZSA-N 1 1 247.423 3.590 20 0 BHADMO CC[C@@H]1CC[C@@H](C)[N@@H+](CC2CC(F)(F)C2)C1 ZINC000852592648 588692546 /nfs/dbraw/zinc/69/25/46/588692546.db2.gz UKLKYAZTVAKKBG-GHMZBOCLSA-N 1 1 231.330 3.542 20 0 BHADMO Clc1ccc2c(c1)CC[C@@H]2[N@H+]1CC[C@@H]2C[C@@H]2C1 ZINC000852634644 588693370 /nfs/dbraw/zinc/69/33/70/588693370.db2.gz PRBIFAFHRRLWSJ-HCKVZZMMSA-N 1 1 247.769 3.669 20 0 BHADMO Clc1ccc2c(c1)CC[C@@H]2[N@H+]1CC[C@H]2C[C@H]2C1 ZINC000852634648 588693204 /nfs/dbraw/zinc/69/32/04/588693204.db2.gz PRBIFAFHRRLWSJ-WBIUFABUSA-N 1 1 247.769 3.669 20 0 BHADMO CCC(CC)CCC[N@@H+](C)Cc1cnoc1C ZINC000852671213 588695093 /nfs/dbraw/zinc/69/50/93/588695093.db2.gz KFWDTNVOOSDLAN-UHFFFAOYSA-N 1 1 238.375 3.631 20 0 BHADMO FC1(F)CC(C[N@H+]2CCC[C@@H](C3CCC3)C2)C1 ZINC000852672789 588695104 /nfs/dbraw/zinc/69/51/04/588695104.db2.gz JLGURDHUKLDFTK-CYBMUJFWSA-N 1 1 243.341 3.544 20 0 BHADMO FC1(F)CC(C[N@H+]2CCC[C@H](C3CCC3)C2)C1 ZINC000852672790 588695193 /nfs/dbraw/zinc/69/51/93/588695193.db2.gz JLGURDHUKLDFTK-ZDUSSCGKSA-N 1 1 243.341 3.544 20 0 BHADMO CC[C@H](O)C[N@@H+](C(C)C)[C@@H](CC)c1ccccc1 ZINC000852690997 588696458 /nfs/dbraw/zinc/69/64/58/588696458.db2.gz VHGCEVSXFYJKTP-HOTGVXAUSA-N 1 1 249.398 3.619 20 0 BHADMO CC[C@H](c1ccccc1)[N@@H+](C[C@@H](O)CC)C(C)C ZINC000852690999 588696095 /nfs/dbraw/zinc/69/60/95/588696095.db2.gz VHGCEVSXFYJKTP-JKSUJKDBSA-N 1 1 249.398 3.619 20 0 BHADMO CC[C@@H](c1ccccc1)[N@@H+](CCF)C(C)C ZINC000852691019 588696272 /nfs/dbraw/zinc/69/62/72/588696272.db2.gz VUSDRMMNLZFHPK-AWEZNQCLSA-N 1 1 223.335 3.818 20 0 BHADMO CC[C@H](c1ccccc1)[N@@H+](CCF)C(C)C ZINC000852691021 588696148 /nfs/dbraw/zinc/69/61/48/588696148.db2.gz VUSDRMMNLZFHPK-CQSZACIVSA-N 1 1 223.335 3.818 20 0 BHADMO CC1C[C@H]2CC[C@@H](C1)[N@@H+]2CC=C(Cl)Cl ZINC000852699818 588696800 /nfs/dbraw/zinc/69/68/00/588696800.db2.gz CGRBLPXHPMKPOL-PBINXNQUSA-N 1 1 234.170 3.568 20 0 BHADMO CC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccsc1 ZINC000852699936 588696786 /nfs/dbraw/zinc/69/67/86/588696786.db2.gz HCPWITFUIUFJNX-VGPLMAKISA-N 1 1 221.369 3.511 20 0 BHADMO CC1C[C@H]2CC[C@@H](C1)[N@@H+]2C/C(Cl)=C/Cl ZINC000852699953 588696534 /nfs/dbraw/zinc/69/65/34/588696534.db2.gz HXQBPENNGDLPIZ-CFENNBTNSA-N 1 1 234.170 3.568 20 0 BHADMO CC1C[C@H]2CC[C@@H](C1)[N@@H+]2C/C(Cl)=C\Cl ZINC000852699954 588696886 /nfs/dbraw/zinc/69/68/86/588696886.db2.gz HXQBPENNGDLPIZ-HUAVFSDTSA-N 1 1 234.170 3.568 20 0 BHADMO CC(C)c1cnc(C[N@@H+]2[C@@H]3CC[C@H]2CC(C)C3)o1 ZINC000852700952 588696610 /nfs/dbraw/zinc/69/66/10/588696610.db2.gz LCQMIWKQYUUCHS-YHWZYXNKSA-N 1 1 248.370 3.561 20 0 BHADMO CC1C[C@H]2CC[C@@H](C1)[N@@H+]2CCc1cccs1 ZINC000852702503 588697225 /nfs/dbraw/zinc/69/72/25/588697225.db2.gz YUMYBIIYPWLQCC-YHWZYXNKSA-N 1 1 235.396 3.554 20 0 BHADMO CC[C@@H]1CCC[C@H](C)[N@H+]1CC1CC(F)(F)C1 ZINC000852711211 588696932 /nfs/dbraw/zinc/69/69/32/588696932.db2.gz CVRVNFKGMYYLHJ-CMPLNLGQSA-N 1 1 231.330 3.685 20 0 BHADMO CC[C@@H]1CCC[C@H](C)[N@H+]1CCCCCCCO ZINC000852712280 588697160 /nfs/dbraw/zinc/69/71/60/588697160.db2.gz NCGLJRVCYHXSOT-LSDHHAIUSA-N 1 1 241.419 3.582 20 0 BHADMO CC[C@@H]1CCC[C@H](C)[N@H+]1Cc1ncc(C)s1 ZINC000852712628 588697488 /nfs/dbraw/zinc/69/74/88/588697488.db2.gz SKTWVIHFTSCHKW-CMPLNLGQSA-N 1 1 238.400 3.605 20 0 BHADMO FC1(F)CC(C[N@@H+](CCC2CC2)CC2CC2)C1 ZINC000852715998 588697559 /nfs/dbraw/zinc/69/75/59/588697559.db2.gz FSEUJBPIPHEDTB-UHFFFAOYSA-N 1 1 243.341 3.544 20 0 BHADMO CC12CC(C1)C[N@H+]2[C@@H]1CCc2cc(Cl)ccc21 ZINC000852786427 588702660 /nfs/dbraw/zinc/70/26/60/588702660.db2.gz MKDQJMVVKUXCPR-CIQACWJJSA-N 1 1 247.769 3.812 20 0 BHADMO CC12CC(C1)C[N@H+]2[C@H]1CCc2cc(Cl)ccc21 ZINC000852786433 588702697 /nfs/dbraw/zinc/70/26/97/588702697.db2.gz MKDQJMVVKUXCPR-CUMGRINNSA-N 1 1 247.769 3.812 20 0 BHADMO Cc1cc([NH2+]C[C@H](C)CC(C)C)ccc1N ZINC000853248212 588729070 /nfs/dbraw/zinc/72/90/70/588729070.db2.gz OECQTYWNLSNHEJ-LLVKDONJSA-N 1 1 220.360 3.671 20 0 BHADMO Cc1cc([NH2+]C[C@@H](C)CC(C)C)ccc1N ZINC000853248213 588728789 /nfs/dbraw/zinc/72/87/89/588728789.db2.gz OECQTYWNLSNHEJ-NSHDSACASA-N 1 1 220.360 3.671 20 0 BHADMO Cc1ccc2cc[nH+]c(N[C@@H]3C=CCC3)c2c1 ZINC000853798389 588763722 /nfs/dbraw/zinc/76/37/22/588763722.db2.gz NKMBDCGOCSVNOW-CYBMUJFWSA-N 1 1 224.307 3.674 20 0 BHADMO Cc1ccc2cc[nH+]c(N[C@H]3C=CCC3)c2c1 ZINC000853798392 588763829 /nfs/dbraw/zinc/76/38/29/588763829.db2.gz NKMBDCGOCSVNOW-ZDUSSCGKSA-N 1 1 224.307 3.674 20 0 BHADMO Cc1cc(C(F)(F)F)cc(N[C@H]2C=CCC2)[nH+]1 ZINC000853798567 588763946 /nfs/dbraw/zinc/76/39/46/588763946.db2.gz OWDTUKQVKGWVBS-JTQLQIEISA-N 1 1 242.244 3.539 20 0 BHADMO Cc1cc(C(F)(F)F)cc(N[C@@H]2C=CCC2)[nH+]1 ZINC000853798568 588763905 /nfs/dbraw/zinc/76/39/05/588763905.db2.gz OWDTUKQVKGWVBS-SNVBAGLBSA-N 1 1 242.244 3.539 20 0 BHADMO Clc1oc2ccccc2c1C[N@H+]1CC[C@H]2C[C@H]21 ZINC000856731929 588875277 /nfs/dbraw/zinc/87/52/77/588875277.db2.gz BYDYHSBHCQDTNK-JOYOIKCWSA-N 1 1 247.725 3.680 20 0 BHADMO Clc1oc2ccccc2c1C[N@H+]1CC[C@@H]2C[C@@H]21 ZINC000856731932 588875343 /nfs/dbraw/zinc/87/53/43/588875343.db2.gz BYDYHSBHCQDTNK-SKDRFNHKSA-N 1 1 247.725 3.680 20 0 BHADMO Cc1cc(C[N@H+]2CCCC3(CCCC3)C2)ccn1 ZINC000856738367 588875348 /nfs/dbraw/zinc/87/53/48/588875348.db2.gz BERABJLPHPBATC-UHFFFAOYSA-N 1 1 244.382 3.546 20 0 BHADMO CCCC[C@H](CC)C[NH2+][C@@H]1CCCc2c[nH]nc21 ZINC000857845168 588911826 /nfs/dbraw/zinc/91/18/26/588911826.db2.gz CCHKZCYDTDZGGP-GXTWGEPZSA-N 1 1 249.402 3.593 20 0 BHADMO CCCC[C@H](CC)C[NH2+][C@H]1CCCc2c[nH]nc21 ZINC000857845169 588911936 /nfs/dbraw/zinc/91/19/36/588911936.db2.gz CCHKZCYDTDZGGP-JSGCOSHPSA-N 1 1 249.402 3.593 20 0 BHADMO CCCC[C@@H](CC)C[NH2+][C@H]1CCCc2c[nH]nc21 ZINC000857845170 588911885 /nfs/dbraw/zinc/91/18/85/588911885.db2.gz CCHKZCYDTDZGGP-OCCSQVGLSA-N 1 1 249.402 3.593 20 0 BHADMO CCCC[C@@H](CC)C[NH2+][C@@H]1CCCc2c[nH]nc21 ZINC000857845171 588911913 /nfs/dbraw/zinc/91/19/13/588911913.db2.gz CCHKZCYDTDZGGP-TZMCWYRMSA-N 1 1 249.402 3.593 20 0 BHADMO CC(C)(C)CCCC[NH2+][C@@H]1CCCc2c[nH]nc21 ZINC000857853642 588913645 /nfs/dbraw/zinc/91/36/45/588913645.db2.gz TVFMTJSQRWLKCA-CYBMUJFWSA-N 1 1 249.402 3.593 20 0 BHADMO CC(C)(C)CCCC[NH2+][C@H]1CCCc2c[nH]nc21 ZINC000857853643 588912961 /nfs/dbraw/zinc/91/29/61/588912961.db2.gz TVFMTJSQRWLKCA-ZDUSSCGKSA-N 1 1 249.402 3.593 20 0 BHADMO CCC(CC)(CC)C[NH2+][C@@H]1CCCc2c[nH]nc21 ZINC000857857561 588913849 /nfs/dbraw/zinc/91/38/49/588913849.db2.gz FFGXSRWYSJKBID-CYBMUJFWSA-N 1 1 249.402 3.593 20 0 BHADMO CCC(CC)(CC)C[NH2+][C@H]1CCCc2c[nH]nc21 ZINC000857857562 588913894 /nfs/dbraw/zinc/91/38/94/588913894.db2.gz FFGXSRWYSJKBID-ZDUSSCGKSA-N 1 1 249.402 3.593 20 0 BHADMO CCC[C@@H]([NH2+][C@@H]1CCCc2c[nH]nc21)C(C)(C)C ZINC000857868041 588916042 /nfs/dbraw/zinc/91/60/42/588916042.db2.gz NUOTUFIMUGYJFS-CHWSQXEVSA-N 1 1 249.402 3.592 20 0 BHADMO CCC[C@H]([NH2+][C@@H]1CCCc2c[nH]nc21)C(C)(C)C ZINC000857868042 588915546 /nfs/dbraw/zinc/91/55/46/588915546.db2.gz NUOTUFIMUGYJFS-OLZOCXBDSA-N 1 1 249.402 3.592 20 0 BHADMO CCC[C@@H]([NH2+][C@H]1CCCc2c[nH]nc21)C(C)(C)C ZINC000857868043 588915643 /nfs/dbraw/zinc/91/56/43/588915643.db2.gz NUOTUFIMUGYJFS-QWHCGFSZSA-N 1 1 249.402 3.592 20 0 BHADMO CCC[C@H]([NH2+][C@H]1CCCc2c[nH]nc21)C(C)(C)C ZINC000857868044 588915424 /nfs/dbraw/zinc/91/54/24/588915424.db2.gz NUOTUFIMUGYJFS-STQMWFEESA-N 1 1 249.402 3.592 20 0 BHADMO C[C@H]1CCC[C@@H](CC[N@H+]2Cc3ccncc3C2)C1 ZINC000857876693 588918887 /nfs/dbraw/zinc/91/88/87/588918887.db2.gz SJORTDWXQTYXSI-KBPBESRZSA-N 1 1 244.382 3.614 20 0 BHADMO C[C@H]1CCC[C@@H](CC[N@@H+]2Cc3ccncc3C2)C1 ZINC000857876693 588918885 /nfs/dbraw/zinc/91/88/85/588918885.db2.gz SJORTDWXQTYXSI-KBPBESRZSA-N 1 1 244.382 3.614 20 0 BHADMO C[C@@H]1CCC[C@@H](CC[N@H+]2Cc3ccncc3C2)C1 ZINC000857876704 588918578 /nfs/dbraw/zinc/91/85/78/588918578.db2.gz SJORTDWXQTYXSI-KGLIPLIRSA-N 1 1 244.382 3.614 20 0 BHADMO C[C@@H]1CCC[C@@H](CC[N@@H+]2Cc3ccncc3C2)C1 ZINC000857876704 588918577 /nfs/dbraw/zinc/91/85/77/588918577.db2.gz SJORTDWXQTYXSI-KGLIPLIRSA-N 1 1 244.382 3.614 20 0 BHADMO C[C@H]1CCC[C@H](CC[N@H+]2Cc3ccncc3C2)C1 ZINC000857876705 588918769 /nfs/dbraw/zinc/91/87/69/588918769.db2.gz SJORTDWXQTYXSI-UONOGXRCSA-N 1 1 244.382 3.614 20 0 BHADMO C[C@H]1CCC[C@H](CC[N@@H+]2Cc3ccncc3C2)C1 ZINC000857876705 588918767 /nfs/dbraw/zinc/91/87/67/588918767.db2.gz SJORTDWXQTYXSI-UONOGXRCSA-N 1 1 244.382 3.614 20 0 BHADMO C[C@@H]1CCC[C@H](CC[N@H+]2Cc3ccncc3C2)C1 ZINC000857876706 588918701 /nfs/dbraw/zinc/91/87/01/588918701.db2.gz SJORTDWXQTYXSI-ZIAGYGMSSA-N 1 1 244.382 3.614 20 0 BHADMO C[C@@H]1CCC[C@H](CC[N@@H+]2Cc3ccncc3C2)C1 ZINC000857876706 588918699 /nfs/dbraw/zinc/91/86/99/588918699.db2.gz SJORTDWXQTYXSI-ZIAGYGMSSA-N 1 1 244.382 3.614 20 0 BHADMO CCCC[C@@H](CC)C[N@H+]1Cc2ccncc2C1 ZINC000857879168 588919467 /nfs/dbraw/zinc/91/94/67/588919467.db2.gz URCUQAWFEWWOAU-CYBMUJFWSA-N 1 1 232.371 3.614 20 0 BHADMO CCCC[C@H](CC)C[N@H+]1Cc2ccncc2C1 ZINC000857879169 588919603 /nfs/dbraw/zinc/91/96/03/588919603.db2.gz URCUQAWFEWWOAU-ZDUSSCGKSA-N 1 1 232.371 3.614 20 0 BHADMO c1cc2c(cn1)C[N@@H+](CCC1CCCCCC1)C2 ZINC000857881089 588920025 /nfs/dbraw/zinc/92/00/25/588920025.db2.gz BKDYOUPYYCYFKB-UHFFFAOYSA-N 1 1 244.382 3.758 20 0 BHADMO c1cc2c(cn1)C[N@H+](CCC1CCCCCC1)C2 ZINC000857881089 588920024 /nfs/dbraw/zinc/92/00/24/588920024.db2.gz BKDYOUPYYCYFKB-UHFFFAOYSA-N 1 1 244.382 3.758 20 0 BHADMO CC1(C)CCCC[C@H]1C[N@H+]1Cc2ccncc2C1 ZINC000857881098 588920242 /nfs/dbraw/zinc/92/02/42/588920242.db2.gz BVCFFRDYKYTEOQ-HNNXBMFYSA-N 1 1 244.382 3.614 20 0 BHADMO CC1(C)CCCC[C@@H]1C[N@H+]1Cc2ccncc2C1 ZINC000857881099 588919782 /nfs/dbraw/zinc/91/97/82/588919782.db2.gz BVCFFRDYKYTEOQ-OAHLLOKOSA-N 1 1 244.382 3.614 20 0 BHADMO CCC[C@@H](C)CCC[N@H+]1Cc2ccncc2C1 ZINC000857881427 588920009 /nfs/dbraw/zinc/92/00/09/588920009.db2.gz VELYWXGSGIUFPV-CYBMUJFWSA-N 1 1 232.371 3.614 20 0 BHADMO CCC[C@@H](C)CCC[N@@H+]1Cc2ccncc2C1 ZINC000857881427 588920008 /nfs/dbraw/zinc/92/00/08/588920008.db2.gz VELYWXGSGIUFPV-CYBMUJFWSA-N 1 1 232.371 3.614 20 0 BHADMO CCC[C@H](C)CCC[N@H+]1Cc2ccncc2C1 ZINC000857881429 588920158 /nfs/dbraw/zinc/92/01/58/588920158.db2.gz VELYWXGSGIUFPV-ZDUSSCGKSA-N 1 1 232.371 3.614 20 0 BHADMO CCC[C@H](C)CCC[N@@H+]1Cc2ccncc2C1 ZINC000857881429 588920156 /nfs/dbraw/zinc/92/01/56/588920156.db2.gz VELYWXGSGIUFPV-ZDUSSCGKSA-N 1 1 232.371 3.614 20 0 BHADMO CC(C)c1cccc([C@@H](C)[NH2+]Cc2ccon2)c1 ZINC000858370551 588949416 /nfs/dbraw/zinc/94/94/16/588949416.db2.gz VDUHNNVILONUOY-GFCCVEGCSA-N 1 1 244.338 3.649 20 0 BHADMO CC(C)c1cccc([C@H](C)[NH2+]Cc2ccon2)c1 ZINC000858370552 588949173 /nfs/dbraw/zinc/94/91/73/588949173.db2.gz VDUHNNVILONUOY-LBPRGKRZSA-N 1 1 244.338 3.649 20 0 BHADMO CCC(F)(F)C[NH2+][C@H](C)CSC(C)(C)C ZINC000858509577 582462302 /nfs/dbraw/zinc/46/23/02/582462302.db2.gz XPRVZBDKZCFKSC-SECBINFHSA-N 1 1 239.375 3.542 20 0 BHADMO CCC(F)(F)C[NH2+][C@@H](C)CSC(C)(C)C ZINC000858509578 582462308 /nfs/dbraw/zinc/46/23/08/582462308.db2.gz XPRVZBDKZCFKSC-VIFPVBQESA-N 1 1 239.375 3.542 20 0 BHADMO Cc1cc([C@@H]2CCC[N@H+]2CC2CC(C)(C)C2)no1 ZINC000859060243 588995557 /nfs/dbraw/zinc/99/55/57/588995557.db2.gz PMNDOSAUSGBDPT-AWEZNQCLSA-N 1 1 248.370 3.556 20 0 BHADMO Cc1cc([C@H]2CCC[N@H+]2CC2CC(C)(C)C2)no1 ZINC000859060247 588995407 /nfs/dbraw/zinc/99/54/07/588995407.db2.gz PMNDOSAUSGBDPT-CQSZACIVSA-N 1 1 248.370 3.556 20 0 BHADMO CCCCC[N@@H+](Cc1ccnc(F)c1)C(C)C ZINC000859072441 588997326 /nfs/dbraw/zinc/99/73/26/588997326.db2.gz DTLAFRUMMUNFIZ-UHFFFAOYSA-N 1 1 238.350 3.621 20 0 BHADMO CCC(CC)[N@@H+](CC(C)C)CC1CC(OC)C1 ZINC000859155361 589011050 /nfs/dbraw/zinc/01/10/50/589011050.db2.gz BIZLLJSNHZVITB-UHFFFAOYSA-N 1 1 241.419 3.558 20 0 BHADMO Fc1cc(C[N@H+]2CCCC23CCCCC3)ccn1 ZINC000859209889 589019458 /nfs/dbraw/zinc/01/94/58/589019458.db2.gz OCQGBTQQNLVIHR-UHFFFAOYSA-N 1 1 248.345 3.519 20 0 BHADMO CCC[C@H](C)CCC[N@H+]1CCC[C@H]1c1ncc[nH]1 ZINC000859222918 589021914 /nfs/dbraw/zinc/02/19/14/589021914.db2.gz OYOGBQDUPBNLDM-KBPBESRZSA-N 1 1 249.402 3.763 20 0 BHADMO CCC[C@@H](C)CCC[N@H+]1CCC[C@H]1c1ncc[nH]1 ZINC000859222919 589021649 /nfs/dbraw/zinc/02/16/49/589021649.db2.gz OYOGBQDUPBNLDM-KGLIPLIRSA-N 1 1 249.402 3.763 20 0 BHADMO CCC[C@H](C)CCC[N@H+]1CCC[C@@H]1c1ncc[nH]1 ZINC000859222920 589021926 /nfs/dbraw/zinc/02/19/26/589021926.db2.gz OYOGBQDUPBNLDM-UONOGXRCSA-N 1 1 249.402 3.763 20 0 BHADMO CCC[C@@H](C)CCC[N@H+]1CCC[C@@H]1c1ncc[nH]1 ZINC000859222921 589021758 /nfs/dbraw/zinc/02/17/58/589021758.db2.gz OYOGBQDUPBNLDM-ZIAGYGMSSA-N 1 1 249.402 3.763 20 0 BHADMO FC1(F)C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccsc1 ZINC000859428710 589036647 /nfs/dbraw/zinc/03/66/47/589036647.db2.gz CKRKDSKZLREUBX-PHIMTYICSA-N 1 1 243.322 3.510 20 0 BHADMO Cc1ccc(C[N@@H+](CCF)C(C)(C)C)cc1 ZINC000859437947 589037201 /nfs/dbraw/zinc/03/72/01/589037201.db2.gz IGOUARWWTAIXEC-UHFFFAOYSA-N 1 1 223.335 3.565 20 0 BHADMO CC1(C)CCC(C)(C)[N@@H+](Cc2cscn2)C1 ZINC000859471921 589039530 /nfs/dbraw/zinc/03/95/30/589039530.db2.gz HXRVMPNIZLBIDW-UHFFFAOYSA-N 1 1 238.400 3.544 20 0 BHADMO CCCCCC[N@H+]1CCCC(F)(F)CC1 ZINC000859534715 589043294 /nfs/dbraw/zinc/04/32/94/589043294.db2.gz DSYXIQIBVDIBQN-UHFFFAOYSA-N 1 1 219.319 3.688 20 0 BHADMO CCCCCC[N@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000859543138 589043865 /nfs/dbraw/zinc/04/38/65/589043865.db2.gz UVBVHXCGTGTLLB-OLZOCXBDSA-N 1 1 227.417 3.537 20 0 BHADMO CCCCCC[N@H+]1CCC(F)(F)C[C@H]1C ZINC000859835714 589064728 /nfs/dbraw/zinc/06/47/28/589064728.db2.gz AATBLNIPTGWEMR-LLVKDONJSA-N 1 1 219.319 3.686 20 0 BHADMO CCCCCC[N@H+]1CCC(F)(F)C[C@@H]1C ZINC000859835715 589064691 /nfs/dbraw/zinc/06/46/91/589064691.db2.gz AATBLNIPTGWEMR-NSHDSACASA-N 1 1 219.319 3.686 20 0 BHADMO c1ccc([C@H]2C[C@@H]3C[N@H+](C4CCCC4)C[C@@H]32)cc1 ZINC000859927567 589071712 /nfs/dbraw/zinc/07/17/12/589071712.db2.gz LFONHANBNWXSPL-OIISXLGYSA-N 1 1 241.378 3.665 20 0 BHADMO CC[C@H](C)[N@H+]1C[C@@H]2C[C@@H](c3ccccc3)[C@@H]2C1 ZINC000859928170 589071894 /nfs/dbraw/zinc/07/18/94/589071894.db2.gz FBDYLJRNPGHIHO-QCEMKRCNSA-N 1 1 229.367 3.520 20 0 BHADMO CC[C@@H](C)[N@H+]1C[C@@H]2C[C@@H](c3ccccc3)[C@@H]2C1 ZINC000859928173 589071496 /nfs/dbraw/zinc/07/14/96/589071496.db2.gz FBDYLJRNPGHIHO-SYAUCNOPSA-N 1 1 229.367 3.520 20 0 BHADMO C[C@]12CCCC[C@H]1C[N@H+]2CC=C(Cl)Cl ZINC000860047679 589077019 /nfs/dbraw/zinc/07/70/19/589077019.db2.gz GWTDLLKRJVTBIF-ONGXEEELSA-N 1 1 234.170 3.570 20 0 BHADMO C[C@]12CCCC[C@H]1C[N@H+]2Cc1ccsc1 ZINC000860047844 589077303 /nfs/dbraw/zinc/07/73/03/589077303.db2.gz JFONEXZLYFZCKM-STQMWFEESA-N 1 1 221.369 3.513 20 0 BHADMO CC(C)c1cnc(C[N@H+]2CCCC3(CC3)CC2)o1 ZINC000860069937 589078945 /nfs/dbraw/zinc/07/89/45/589078945.db2.gz PQHKIVTVNPBAGQ-UHFFFAOYSA-N 1 1 248.370 3.564 20 0 BHADMO c1csc(CC[N@H+]2CCCC3(CC3)CC2)c1 ZINC000860071190 589079628 /nfs/dbraw/zinc/07/96/28/589079628.db2.gz ZBISYVIQJSYJTG-UHFFFAOYSA-N 1 1 235.396 3.557 20 0 BHADMO Cl/C=C(/Cl)C[N@H+]1CCCC2(CC2)CC1 ZINC000860072479 589079580 /nfs/dbraw/zinc/07/95/80/589079580.db2.gz DYPHLOQOOHPOLF-CSKARUKUSA-N 1 1 234.170 3.572 20 0 BHADMO Cl/C=C(\Cl)C[N@H+]1CCCC2(CC2)CC1 ZINC000860072480 589079441 /nfs/dbraw/zinc/07/94/41/589079441.db2.gz DYPHLOQOOHPOLF-NTMALXAHSA-N 1 1 234.170 3.572 20 0 BHADMO C/C=C\C[C@H]1CCC[N@@H+](CC2CC(F)(F)C2)C1 ZINC000860184596 589088135 /nfs/dbraw/zinc/08/81/35/589088135.db2.gz HJQDNFWQBCJPJC-DLGQBQFBSA-N 1 1 243.341 3.710 20 0 BHADMO C/C=C/C[C@H]1CCC[N@@H+](CC2CC(F)(F)C2)C1 ZINC000860184597 589087892 /nfs/dbraw/zinc/08/78/92/589087892.db2.gz HJQDNFWQBCJPJC-JDGPPOGSSA-N 1 1 243.341 3.710 20 0 BHADMO C/C=C/C[C@@H]1CCC[N@@H+](CC2CC(F)(F)C2)C1 ZINC000860184598 589088082 /nfs/dbraw/zinc/08/80/82/589088082.db2.gz HJQDNFWQBCJPJC-QAVQXKDTSA-N 1 1 243.341 3.710 20 0 BHADMO C/C=C\C[C@@H]1CCC[N@@H+](CC2CC(F)(F)C2)C1 ZINC000860184599 582513367 /nfs/dbraw/zinc/51/33/67/582513367.db2.gz HJQDNFWQBCJPJC-ZZKXABKFSA-N 1 1 243.341 3.710 20 0 BHADMO Cc1nc(C[N@H+](C)C2CCCCCCC2)[nH]c1C ZINC000862237169 589196416 /nfs/dbraw/zinc/19/64/16/589196416.db2.gz JDHOSVMTVFMNOT-UHFFFAOYSA-N 1 1 249.402 3.571 20 0 BHADMO Cc1ncc(C[N@H+](C)C2CCCCCCC2)o1 ZINC000862237189 589196045 /nfs/dbraw/zinc/19/60/45/589196045.db2.gz JNCAOFZLMDRGHN-UHFFFAOYSA-N 1 1 236.359 3.528 20 0 BHADMO C[C@]1(C[N@H+]2CCC3(CCCC3)C2)CCCS1 ZINC000862242779 589197119 /nfs/dbraw/zinc/19/71/19/589197119.db2.gz QQAJFOFOZWDRAX-CYBMUJFWSA-N 1 1 239.428 3.538 20 0 BHADMO C[C@@]1(C[N@H+]2CCC3(CCCC3)C2)CCCS1 ZINC000862242780 589196732 /nfs/dbraw/zinc/19/67/32/589196732.db2.gz QQAJFOFOZWDRAX-ZDUSSCGKSA-N 1 1 239.428 3.538 20 0 BHADMO CC1(C)CC[N@H+]1Cc1ccsc1C(F)(F)F ZINC000862245996 589197167 /nfs/dbraw/zinc/19/71/67/589197167.db2.gz FITMXFZQNVZQMO-UHFFFAOYSA-N 1 1 249.301 3.751 20 0 BHADMO CC1(C)CC[N@@H+]1Cc1ccsc1C(F)(F)F ZINC000862245996 589197166 /nfs/dbraw/zinc/19/71/66/589197166.db2.gz FITMXFZQNVZQMO-UHFFFAOYSA-N 1 1 249.301 3.751 20 0 BHADMO CC1(C)CC[N@H+]1Cc1csc(C(F)(F)F)c1 ZINC000862246061 589196826 /nfs/dbraw/zinc/19/68/26/589196826.db2.gz HSNUCHPDWOKMQI-UHFFFAOYSA-N 1 1 249.301 3.751 20 0 BHADMO CC1(C)CC[N@@H+]1Cc1csc(C(F)(F)F)c1 ZINC000862246061 589196825 /nfs/dbraw/zinc/19/68/25/589196825.db2.gz HSNUCHPDWOKMQI-UHFFFAOYSA-N 1 1 249.301 3.751 20 0 BHADMO C[C@@]1(CNc2cc(C3CC3)cc[nH+]2)CCCS1 ZINC000862369297 589205165 /nfs/dbraw/zinc/20/51/65/589205165.db2.gz BJWGZKCSQWSOPI-AWEZNQCLSA-N 1 1 248.395 3.657 20 0 BHADMO C[C@]1(CNc2cc(C3CC3)cc[nH+]2)CCCS1 ZINC000862369315 589205000 /nfs/dbraw/zinc/20/50/00/589205000.db2.gz BJWGZKCSQWSOPI-CQSZACIVSA-N 1 1 248.395 3.657 20 0 BHADMO CCCC[C@@H](C)[N@@H+](C)Cc1ccnc(F)c1C ZINC000862372007 589205155 /nfs/dbraw/zinc/20/51/55/589205155.db2.gz LTXDYGBNJPFOBY-LLVKDONJSA-N 1 1 238.350 3.540 20 0 BHADMO CCCC[C@H](C)[N@@H+](C)Cc1ccnc(F)c1C ZINC000862372008 589205288 /nfs/dbraw/zinc/20/52/88/589205288.db2.gz LTXDYGBNJPFOBY-NSHDSACASA-N 1 1 238.350 3.540 20 0 BHADMO CCC(CC)[N@@H+](CC)Cc1ccnc(F)c1C ZINC000862372189 589205215 /nfs/dbraw/zinc/20/52/15/589205215.db2.gz TXYAVMMVXUPUHB-UHFFFAOYSA-N 1 1 238.350 3.540 20 0 BHADMO C[C@@]1(CNc2cccc(C3CC3)[nH+]2)CCCS1 ZINC000862376813 589205870 /nfs/dbraw/zinc/20/58/70/589205870.db2.gz LURWFLNQOFAWDW-AWEZNQCLSA-N 1 1 248.395 3.657 20 0 BHADMO C[C@]1(CNc2cccc(C3CC3)[nH+]2)CCCS1 ZINC000862376814 589205853 /nfs/dbraw/zinc/20/58/53/589205853.db2.gz LURWFLNQOFAWDW-CQSZACIVSA-N 1 1 248.395 3.657 20 0 BHADMO C[C@H](CC(C)(C)C)n1c[nH+]c2c1CCCC2 ZINC000862431568 589212217 /nfs/dbraw/zinc/21/22/17/589212217.db2.gz KLQIWNHOTKKFKO-LLVKDONJSA-N 1 1 220.360 3.759 20 0 BHADMO C[C@@H](CC(C)(C)C)n1c[nH+]c2c1CCCC2 ZINC000862431569 589212387 /nfs/dbraw/zinc/21/23/87/589212387.db2.gz KLQIWNHOTKKFKO-NSHDSACASA-N 1 1 220.360 3.759 20 0 BHADMO c1ccc(-c2ccccc2C[N@H+]2C[C@@H]3C[C@@H]3C2)cc1 ZINC000862441836 589213543 /nfs/dbraw/zinc/21/35/43/589213543.db2.gz WXTVVXTWFDOWLA-CALCHBBNSA-N 1 1 249.357 3.805 20 0 BHADMO Cc1cc(C[N@H+]2CCCC(F)(F)CC2)c(C)o1 ZINC000862466789 589216767 /nfs/dbraw/zinc/21/67/67/589216767.db2.gz KUSMKAJPRNHROZ-UHFFFAOYSA-N 1 1 243.297 3.518 20 0 BHADMO Cc1cc(Cl)ccc1Cn1cc[nH+]c1C1CC1 ZINC000863386812 589286015 /nfs/dbraw/zinc/28/60/15/589286015.db2.gz QNJCPRIUSHANOT-UHFFFAOYSA-N 1 1 246.741 3.771 20 0 BHADMO Cc1[nH+]cc(-c2ccc(C(C)C)cc2)n1C ZINC000863973288 589331002 /nfs/dbraw/zinc/33/10/02/589331002.db2.gz JQZWBSBPANSMDL-UHFFFAOYSA-N 1 1 214.312 3.519 20 0 BHADMO Cc1[nH+]ccn1CCCSCCCC1CC1 ZINC000865282693 589419008 /nfs/dbraw/zinc/41/90/08/589419008.db2.gz BFFLBHBZGGODHR-UHFFFAOYSA-N 1 1 238.400 3.505 20 0 BHADMO CC(C)c1[nH+]ccn1CCCSC(C)(C)C ZINC000865362208 589426324 /nfs/dbraw/zinc/42/63/24/589426324.db2.gz OMIRQYQMLRDVBW-UHFFFAOYSA-N 1 1 240.416 3.928 20 0 BHADMO CC(C)(C)SCCCn1cc[nH+]c1C1CC1 ZINC000865373080 589427810 /nfs/dbraw/zinc/42/78/10/589427810.db2.gz FNSKXMWSSGJFQB-UHFFFAOYSA-N 1 1 238.400 3.682 20 0 BHADMO CCc1[nH+]c(C)cn1Cc1ccc(SC)cc1 ZINC000865392518 636816973 /nfs/dbraw/zinc/81/69/73/636816973.db2.gz AGKVLUMVHKQCLO-UHFFFAOYSA-N 1 1 246.379 3.524 20 0 BHADMO CCc1[nH+]c(C)cn1CCCSCC(C)C ZINC000865392817 589431368 /nfs/dbraw/zinc/43/13/68/589431368.db2.gz AJIXZVHHLRLBLB-UHFFFAOYSA-N 1 1 240.416 3.533 20 0 BHADMO CCc1[nH+]c(C)cn1Cc1ccccc1SC ZINC000865393288 636817122 /nfs/dbraw/zinc/81/71/22/636817122.db2.gz PZHKDIQOMYCGAO-UHFFFAOYSA-N 1 1 246.379 3.524 20 0 BHADMO CCc1[nH+]c(C)cn1Cc1cc2ccccc2o1 ZINC000865393369 589431272 /nfs/dbraw/zinc/43/12/72/589431272.db2.gz SOGIBHSTLLOSQB-UHFFFAOYSA-N 1 1 240.306 3.548 20 0 BHADMO CCc1[nH+]c(C)cn1C[C@@H]1C[C@H]1c1ccccc1 ZINC000865394294 589430928 /nfs/dbraw/zinc/43/09/28/589430928.db2.gz AXAGVOXEXKJAEU-GJZGRUSLSA-N 1 1 240.350 3.558 20 0 BHADMO CCc1[nH+]c(C)cn1Cc1cccc(SC)c1 ZINC000865394312 589431237 /nfs/dbraw/zinc/43/12/37/589431237.db2.gz BSMZLVSKLULWMJ-UHFFFAOYSA-N 1 1 246.379 3.524 20 0 BHADMO CCc1[nH+]c(C)cn1CCCSC(C)(C)C ZINC000865394729 589431449 /nfs/dbraw/zinc/43/14/49/589431449.db2.gz WPQMSLIMWQWIKU-UHFFFAOYSA-N 1 1 240.416 3.676 20 0 BHADMO Cc1ccoc1C[NH2+]Cc1ccc(C(C)(C)C)o1 ZINC000865813992 589462915 /nfs/dbraw/zinc/46/29/15/589462915.db2.gz DTRJDAYJQSXDNR-UHFFFAOYSA-N 1 1 247.338 3.768 20 0 BHADMO Cc1ccc(C[NH2+]Cc2ccc(C(C)(C)C)o2)o1 ZINC000865814291 584031331 /nfs/dbraw/zinc/03/13/31/584031331.db2.gz HZIOZAOOWHTELZ-UHFFFAOYSA-N 1 1 247.338 3.768 20 0 BHADMO Cc1occc1C[NH2+]Cc1ccc(C(C)(C)C)o1 ZINC000865815183 589462800 /nfs/dbraw/zinc/46/28/00/589462800.db2.gz RWNVWLQMKHYTIQ-UHFFFAOYSA-N 1 1 247.338 3.768 20 0 BHADMO CS[C@H]1C[C@H](Nc2[nH+]ccc3ccccc32)C1 ZINC000866102962 589476249 /nfs/dbraw/zinc/47/62/49/589476249.db2.gz UVUBLZCGJIESPU-HAQNSBGRSA-N 1 1 244.363 3.541 20 0 BHADMO Cc1cc[nH+]c(N[C@H](c2ccccn2)C(C)C)c1 ZINC000866314051 589485970 /nfs/dbraw/zinc/48/59/70/589485970.db2.gz CDPMBZAXTRZFHQ-HNNXBMFYSA-N 1 1 241.338 3.594 20 0 BHADMO Cc1cc[nH+]c(N[C@@H](c2ccccn2)C(C)C)c1 ZINC000866314052 589486126 /nfs/dbraw/zinc/48/61/26/589486126.db2.gz CDPMBZAXTRZFHQ-OAHLLOKOSA-N 1 1 241.338 3.594 20 0 BHADMO Cc1[nH+]c2c(n1CSC(C)(C)C)CCCC2 ZINC000871671939 589787311 /nfs/dbraw/zinc/78/73/11/589787311.db2.gz KSRSXHIVUISAGF-UHFFFAOYSA-N 1 1 238.400 3.560 20 0 BHADMO CC[C@@H](C)[N@H+]1CCC[C@@H](c2cc(C(C)C)[nH]n2)C1 ZINC000872093596 589868610 /nfs/dbraw/zinc/86/86/10/589868610.db2.gz CVDRIEAXHWVHEK-CHWSQXEVSA-N 1 1 249.402 3.511 20 0 BHADMO CC[C@@H](C)[N@@H+]1CCC[C@@H](c2cc(C(C)C)[nH]n2)C1 ZINC000872093596 589868608 /nfs/dbraw/zinc/86/86/08/589868608.db2.gz CVDRIEAXHWVHEK-CHWSQXEVSA-N 1 1 249.402 3.511 20 0 BHADMO CC[C@@H](C)[N@H+]1CCC[C@@H](c2cc(C(C)C)n[nH]2)C1 ZINC000872093596 589868607 /nfs/dbraw/zinc/86/86/07/589868607.db2.gz CVDRIEAXHWVHEK-CHWSQXEVSA-N 1 1 249.402 3.511 20 0 BHADMO CC[C@@H](C)[N@H+]1CCC[C@H](c2cc(C(C)C)[nH]n2)C1 ZINC000872093597 589868641 /nfs/dbraw/zinc/86/86/41/589868641.db2.gz CVDRIEAXHWVHEK-OLZOCXBDSA-N 1 1 249.402 3.511 20 0 BHADMO CC[C@@H](C)[N@@H+]1CCC[C@H](c2cc(C(C)C)[nH]n2)C1 ZINC000872093597 589868639 /nfs/dbraw/zinc/86/86/39/589868639.db2.gz CVDRIEAXHWVHEK-OLZOCXBDSA-N 1 1 249.402 3.511 20 0 BHADMO CC[C@@H](C)[N@H+]1CCC[C@H](c2cc(C(C)C)n[nH]2)C1 ZINC000872093597 589868637 /nfs/dbraw/zinc/86/86/37/589868637.db2.gz CVDRIEAXHWVHEK-OLZOCXBDSA-N 1 1 249.402 3.511 20 0 BHADMO CC[C@H](C)[N@H+]1CCC[C@@H](c2cc(C(C)C)[nH]n2)C1 ZINC000872093598 589868419 /nfs/dbraw/zinc/86/84/19/589868419.db2.gz CVDRIEAXHWVHEK-QWHCGFSZSA-N 1 1 249.402 3.511 20 0 BHADMO CC[C@H](C)[N@@H+]1CCC[C@@H](c2cc(C(C)C)[nH]n2)C1 ZINC000872093598 589868417 /nfs/dbraw/zinc/86/84/17/589868417.db2.gz CVDRIEAXHWVHEK-QWHCGFSZSA-N 1 1 249.402 3.511 20 0 BHADMO CC[C@H](C)[N@H+]1CCC[C@@H](c2cc(C(C)C)n[nH]2)C1 ZINC000872093598 589868416 /nfs/dbraw/zinc/86/84/16/589868416.db2.gz CVDRIEAXHWVHEK-QWHCGFSZSA-N 1 1 249.402 3.511 20 0 BHADMO CC[C@H](C)[N@H+]1CCC[C@H](c2cc(C(C)C)[nH]n2)C1 ZINC000872093599 589868320 /nfs/dbraw/zinc/86/83/20/589868320.db2.gz CVDRIEAXHWVHEK-STQMWFEESA-N 1 1 249.402 3.511 20 0 BHADMO CC[C@H](C)[N@@H+]1CCC[C@H](c2cc(C(C)C)[nH]n2)C1 ZINC000872093599 589868318 /nfs/dbraw/zinc/86/83/18/589868318.db2.gz CVDRIEAXHWVHEK-STQMWFEESA-N 1 1 249.402 3.511 20 0 BHADMO CC[C@H](C)[N@H+]1CCC[C@H](c2cc(C(C)C)n[nH]2)C1 ZINC000872093599 589868316 /nfs/dbraw/zinc/86/83/16/589868316.db2.gz 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3.663 20 0 BHADMO CC[N@@H+](Cc1nc(Cl)cs1)[C@@H](C)C(C)C ZINC000876643299 590225867 /nfs/dbraw/zinc/22/58/67/590225867.db2.gz CHWKAPNPBDZDFL-VIFPVBQESA-N 1 1 246.807 3.663 20 0 BHADMO CC1(C[N@H+]2CCCC[C@@H]2c2ncc[nH]2)CCCC1 ZINC000876656094 590226613 /nfs/dbraw/zinc/22/66/13/590226613.db2.gz DSMJBUREODEZJT-CYBMUJFWSA-N 1 1 247.386 3.517 20 0 BHADMO CC1(C[N@H+]2CCCC[C@H]2c2ncc[nH]2)CCCC1 ZINC000876656095 590226530 /nfs/dbraw/zinc/22/65/30/590226530.db2.gz DSMJBUREODEZJT-ZDUSSCGKSA-N 1 1 247.386 3.517 20 0 BHADMO C[N@@H+](CCC[C@H]1CCO1)C1CCCCCCC1 ZINC000876656686 590226693 /nfs/dbraw/zinc/22/66/93/590226693.db2.gz FOEMZIOECHCHTL-HNNXBMFYSA-N 1 1 239.403 3.600 20 0 BHADMO C[N@@H+](CCC[C@@H]1CCO1)C1CCCCCCC1 ZINC000876656687 590226833 /nfs/dbraw/zinc/22/68/33/590226833.db2.gz FOEMZIOECHCHTL-OAHLLOKOSA-N 1 1 239.403 3.600 20 0 BHADMO C[C@@H]1CCCCC[N@H+]1Cc1nc(Cl)cs1 ZINC000876732995 590234448 /nfs/dbraw/zinc/23/44/48/590234448.db2.gz LKVITEJGXOTDOC-SECBINFHSA-N 1 1 244.791 3.561 20 0 BHADMO C[C@@H]1CCCCC[N@@H+]1Cc1nc(Cl)cs1 ZINC000876732995 590234446 /nfs/dbraw/zinc/23/44/46/590234446.db2.gz LKVITEJGXOTDOC-SECBINFHSA-N 1 1 244.791 3.561 20 0 BHADMO C[C@H]1CCCCC[N@H+]1Cc1nc(Cl)cs1 ZINC000876732996 590233957 /nfs/dbraw/zinc/23/39/57/590233957.db2.gz LKVITEJGXOTDOC-VIFPVBQESA-N 1 1 244.791 3.561 20 0 BHADMO C[C@H]1CCCCC[N@@H+]1Cc1nc(Cl)cs1 ZINC000876732996 590233956 /nfs/dbraw/zinc/23/39/56/590233956.db2.gz LKVITEJGXOTDOC-VIFPVBQESA-N 1 1 244.791 3.561 20 0 BHADMO CC(C)[N@@H+](Cc1nc(Cl)cs1)C1CCC1 ZINC000876759946 590238958 /nfs/dbraw/zinc/23/89/58/590238958.db2.gz QZWSBQZRJFSXMS-UHFFFAOYSA-N 1 1 244.791 3.559 20 0 BHADMO C[N@@H+](Cc1nc(Cl)cs1)C1(C)CCCC1 ZINC000877483278 590338165 /nfs/dbraw/zinc/33/81/65/590338165.db2.gz RQFNFFZRHQNZJG-UHFFFAOYSA-N 1 1 244.791 3.561 20 0 BHADMO CC1(C[N@H+]2CCC[C@H]2c2ccncc2)CCCC1 ZINC000877522948 590347189 /nfs/dbraw/zinc/34/71/89/590347189.db2.gz FXWGIMKXHOVTDK-HNNXBMFYSA-N 1 1 244.382 3.799 20 0 BHADMO CC1(C[N@H+]2CCC[C@@H]2c2ccncc2)CCCC1 ZINC000877522949 590347279 /nfs/dbraw/zinc/34/72/79/590347279.db2.gz FXWGIMKXHOVTDK-OAHLLOKOSA-N 1 1 244.382 3.799 20 0 BHADMO CC1(C[N@H+]2CCC[C@H]2c2cccnc2)CCCC1 ZINC000877523708 590347083 /nfs/dbraw/zinc/34/70/83/590347083.db2.gz MCRBZWMHDYZZTR-HNNXBMFYSA-N 1 1 244.382 3.799 20 0 BHADMO CC1(C[N@H+]2CCC[C@@H]2c2cccnc2)CCCC1 ZINC000877523709 590346510 /nfs/dbraw/zinc/34/65/10/590346510.db2.gz MCRBZWMHDYZZTR-OAHLLOKOSA-N 1 1 244.382 3.799 20 0 BHADMO CC[C@H]1CC[C@@H](C)[N@H+]1Cc1nc(Cl)cs1 ZINC000877532235 590348510 /nfs/dbraw/zinc/34/85/10/590348510.db2.gz UCGJPZIKLFROGV-BDAKNGLRSA-N 1 1 244.791 3.559 20 0 BHADMO CC[C@H]1CC[C@@H](C)[N@@H+]1Cc1nc(Cl)cs1 ZINC000877532235 590348507 /nfs/dbraw/zinc/34/85/07/590348507.db2.gz UCGJPZIKLFROGV-BDAKNGLRSA-N 1 1 244.791 3.559 20 0 BHADMO CC[C@@H]1CC[C@H](C)[N@H+]1Cc1nc(Cl)cs1 ZINC000877532236 590348897 /nfs/dbraw/zinc/34/88/97/590348897.db2.gz UCGJPZIKLFROGV-DTWKUNHWSA-N 1 1 244.791 3.559 20 0 BHADMO CC[C@@H]1CC[C@H](C)[N@@H+]1Cc1nc(Cl)cs1 ZINC000877532236 590348895 /nfs/dbraw/zinc/34/88/95/590348895.db2.gz UCGJPZIKLFROGV-DTWKUNHWSA-N 1 1 244.791 3.559 20 0 BHADMO CC[C@H]1CC[C@H](C)[N@H+]1Cc1nc(Cl)cs1 ZINC000877532237 590348741 /nfs/dbraw/zinc/34/87/41/590348741.db2.gz UCGJPZIKLFROGV-IUCAKERBSA-N 1 1 244.791 3.559 20 0 BHADMO CC[C@H]1CC[C@H](C)[N@@H+]1Cc1nc(Cl)cs1 ZINC000877532237 590348738 /nfs/dbraw/zinc/34/87/38/590348738.db2.gz UCGJPZIKLFROGV-IUCAKERBSA-N 1 1 244.791 3.559 20 0 BHADMO CC[C@@H]1CC[C@@H](C)[N@H+]1Cc1nc(Cl)cs1 ZINC000877532238 590349070 /nfs/dbraw/zinc/34/90/70/590349070.db2.gz UCGJPZIKLFROGV-RKDXNWHRSA-N 1 1 244.791 3.559 20 0 BHADMO CC[C@@H]1CC[C@@H](C)[N@@H+]1Cc1nc(Cl)cs1 ZINC000877532238 590349069 /nfs/dbraw/zinc/34/90/69/590349069.db2.gz UCGJPZIKLFROGV-RKDXNWHRSA-N 1 1 244.791 3.559 20 0 BHADMO c1cc(C2CC2)cc(NCC2CCSCC2)[nH+]1 ZINC000877542403 590351580 /nfs/dbraw/zinc/35/15/80/590351580.db2.gz YFZYLBQRLWMVLR-UHFFFAOYSA-N 1 1 248.395 3.514 20 0 BHADMO CC[N@@H+](Cc1nc(Cl)cs1)CC(C)(C)C ZINC000877544015 590352641 /nfs/dbraw/zinc/35/26/41/590352641.db2.gz KCKKHHWZSZRVFN-UHFFFAOYSA-N 1 1 246.807 3.665 20 0 BHADMO C[N@@H+](CCC(C)(C)C)Cc1nc(Cl)cs1 ZINC000877606103 645800985 /nfs/dbraw/zinc/80/09/85/645800985.db2.gz OOBOGXIORCSWTM-UHFFFAOYSA-N 1 1 246.807 3.665 20 0 BHADMO C[N@H+](CCC(C)(C)C)Cc1nc(Cl)cs1 ZINC000877606103 645800983 /nfs/dbraw/zinc/80/09/83/645800983.db2.gz OOBOGXIORCSWTM-UHFFFAOYSA-N 1 1 246.807 3.665 20 0 BHADMO C[C@]1(C(F)(F)F)CC[N@@H+](Cc2ccsc2)C1 ZINC000877813633 590426973 /nfs/dbraw/zinc/42/69/73/590426973.db2.gz IRDKQELJVLDAOY-JTQLQIEISA-N 1 1 249.301 3.522 20 0 BHADMO C[C@@]1(C(F)(F)F)CC[N@@H+](Cc2ccsc2)C1 ZINC000877813635 590427042 /nfs/dbraw/zinc/42/70/42/590427042.db2.gz IRDKQELJVLDAOY-SNVBAGLBSA-N 1 1 249.301 3.522 20 0 BHADMO C[C@]1(C(F)(F)F)CC[N@@H+](Cc2cccs2)C1 ZINC000877814567 590427516 /nfs/dbraw/zinc/42/75/16/590427516.db2.gz UEJVCNKARNAJGF-JTQLQIEISA-N 1 1 249.301 3.522 20 0 BHADMO C[C@@]1(C(F)(F)F)CC[N@@H+](Cc2cccs2)C1 ZINC000877814568 590427138 /nfs/dbraw/zinc/42/71/38/590427138.db2.gz UEJVCNKARNAJGF-SNVBAGLBSA-N 1 1 249.301 3.522 20 0 BHADMO C[N@@H+](CC[C@H]1CCCC1(F)F)Cc1ccco1 ZINC000877906579 590444280 /nfs/dbraw/zinc/44/42/80/590444280.db2.gz SPOFLFRZKZBPLL-LLVKDONJSA-N 1 1 243.297 3.537 20 0 BHADMO C[N@@H+](CC[C@@H]1CCCC1(F)F)Cc1ccco1 ZINC000877906580 590444339 /nfs/dbraw/zinc/44/43/39/590444339.db2.gz SPOFLFRZKZBPLL-NSHDSACASA-N 1 1 243.297 3.537 20 0 BHADMO C[N@@H+](CC[C@H]1CCCC1(F)F)C1CCCC1 ZINC000877925033 590448522 /nfs/dbraw/zinc/44/85/22/590448522.db2.gz OFPDREWTEKMDLM-LLVKDONJSA-N 1 1 231.330 3.686 20 0 BHADMO C[N@@H+](CC[C@@H]1CCCC1(F)F)C1CCCC1 ZINC000877925034 590448089 /nfs/dbraw/zinc/44/80/89/590448089.db2.gz OFPDREWTEKMDLM-NSHDSACASA-N 1 1 231.330 3.686 20 0 BHADMO C[C@H](C1CC1)[N@@H+](C)Cc1cc(C(F)(F)F)co1 ZINC000877929210 590447368 /nfs/dbraw/zinc/44/73/68/590447368.db2.gz AQYMGARESORISZ-MRVPVSSYSA-N 1 1 247.260 3.529 20 0 BHADMO C[C@@H](C1CC1)[N@@H+](C)Cc1cc(C(F)(F)F)co1 ZINC000877929211 590447901 /nfs/dbraw/zinc/44/79/01/590447901.db2.gz AQYMGARESORISZ-QMMMGPOBSA-N 1 1 247.260 3.529 20 0 BHADMO C[C@@H](C1CC1)[N@@H+](C)CC[C@H]1CCCC1(F)F ZINC000877930222 590450032 /nfs/dbraw/zinc/45/00/32/590450032.db2.gz ZYXZORDVGSNNTH-CMPLNLGQSA-N 1 1 231.330 3.542 20 0 BHADMO C[C@@H](C1CC1)[N@@H+](C)CC[C@@H]1CCCC1(F)F ZINC000877930223 590449803 /nfs/dbraw/zinc/44/98/03/590449803.db2.gz ZYXZORDVGSNNTH-JQWIXIFHSA-N 1 1 231.330 3.542 20 0 BHADMO C[C@H](C1CC1)[N@@H+](C)CC[C@@H]1CCCC1(F)F ZINC000877930224 590448613 /nfs/dbraw/zinc/44/86/13/590448613.db2.gz ZYXZORDVGSNNTH-PWSUYJOCSA-N 1 1 231.330 3.542 20 0 BHADMO C[C@H](C1CC1)[N@@H+](C)CC[C@H]1CCCC1(F)F ZINC000877930225 590448124 /nfs/dbraw/zinc/44/81/24/590448124.db2.gz ZYXZORDVGSNNTH-ZYHUDNBSSA-N 1 1 231.330 3.542 20 0 BHADMO C[N@@H+](Cc1scnc1Cl)C1CCCCC1 ZINC000877935039 590452350 /nfs/dbraw/zinc/45/23/50/590452350.db2.gz OCDKFJXBIRNZDB-UHFFFAOYSA-N 1 1 244.791 3.561 20 0 BHADMO CC[C@@H]1CCCC[N@H+]1Cc1scnc1Cl ZINC000877935462 590451938 /nfs/dbraw/zinc/45/19/38/590451938.db2.gz RQKOKZTZTPIFQX-SECBINFHSA-N 1 1 244.791 3.561 20 0 BHADMO CC[C@H]1CCCC[N@H+]1Cc1scnc1Cl ZINC000877935463 590451768 /nfs/dbraw/zinc/45/17/68/590451768.db2.gz RQKOKZTZTPIFQX-VIFPVBQESA-N 1 1 244.791 3.561 20 0 BHADMO C[C@@H]([N@@H+](C)Cc1scnc1Cl)C(C)(C)C ZINC000877953436 590456740 /nfs/dbraw/zinc/45/67/40/590456740.db2.gz MVBVMDODANCFJH-MRVPVSSYSA-N 1 1 246.807 3.663 20 0 BHADMO C[C@H]([N@@H+](C)Cc1scnc1Cl)C(C)(C)C ZINC000877953437 590456759 /nfs/dbraw/zinc/45/67/59/590456759.db2.gz MVBVMDODANCFJH-QMMMGPOBSA-N 1 1 246.807 3.663 20 0 BHADMO CCCC[N@@H+](Cc1scnc1Cl)C1CC1 ZINC000877961348 590458604 /nfs/dbraw/zinc/45/86/04/590458604.db2.gz JNPMWJLFTWDCRA-UHFFFAOYSA-N 1 1 244.791 3.561 20 0 BHADMO CCCC[N@H+](Cc1scnc1Cl)C1CC1 ZINC000877961348 590458602 /nfs/dbraw/zinc/45/86/02/590458602.db2.gz JNPMWJLFTWDCRA-UHFFFAOYSA-N 1 1 244.791 3.561 20 0 BHADMO CC(C)[N@@H+](Cc1cc(C(F)(F)F)co1)C1CC1 ZINC000877964628 590460446 /nfs/dbraw/zinc/46/04/46/590460446.db2.gz IWMIMYSUJGMOKI-UHFFFAOYSA-N 1 1 247.260 3.671 20 0 BHADMO CC(C)[N@@H+](CC[C@H]1CCCC1(F)F)C1CC1 ZINC000877964884 590460658 /nfs/dbraw/zinc/46/06/58/590460658.db2.gz OIKQURODBODHIR-LLVKDONJSA-N 1 1 231.330 3.685 20 0 BHADMO CC(C)[N@@H+](CC[C@@H]1CCCC1(F)F)C1CC1 ZINC000877964885 590460512 /nfs/dbraw/zinc/46/05/12/590460512.db2.gz OIKQURODBODHIR-NSHDSACASA-N 1 1 231.330 3.685 20 0 BHADMO CC(C)C[N@@H+](Cc1scnc1Cl)C(C)C ZINC000877966752 590461374 /nfs/dbraw/zinc/46/13/74/590461374.db2.gz UZAZRHCAQKYJKX-UHFFFAOYSA-N 1 1 246.807 3.663 20 0 BHADMO CC[N@@H+](Cc1scnc1Cl)C1CCCC1 ZINC000877969082 590461122 /nfs/dbraw/zinc/46/11/22/590461122.db2.gz WWMCRNJAOXSKTQ-UHFFFAOYSA-N 1 1 244.791 3.561 20 0 BHADMO Cc1conc1C[N@@H+](C1CC1)C1CCC(C)CC1 ZINC000877973013 590463472 /nfs/dbraw/zinc/46/34/72/590463472.db2.gz SBLIPNODVKBNAP-UHFFFAOYSA-N 1 1 248.370 3.526 20 0 BHADMO Cc1conc1C[N@H+]1CCC[C@H]1C1CCCCC1 ZINC000877975566 590464500 /nfs/dbraw/zinc/46/45/00/590464500.db2.gz KYRCTNPCZKAUIR-HNNXBMFYSA-N 1 1 248.370 3.528 20 0 BHADMO Cc1conc1C[N@H+]1CCC[C@@H]1C1CCCCC1 ZINC000877975567 590464200 /nfs/dbraw/zinc/46/42/00/590464200.db2.gz KYRCTNPCZKAUIR-OAHLLOKOSA-N 1 1 248.370 3.528 20 0 BHADMO Cc1conc1C[N@@H+](CC1CCCCC1)C1CC1 ZINC000877976204 590463759 /nfs/dbraw/zinc/46/37/59/590463759.db2.gz UEEPMPZPIDNQRN-UHFFFAOYSA-N 1 1 248.370 3.528 20 0 BHADMO CC[N@@H+](CC[C@H]1CCCC1(F)F)C(C)C ZINC000877983245 590466062 /nfs/dbraw/zinc/46/60/62/590466062.db2.gz HMDWMZFNSIDQIX-LLVKDONJSA-N 1 1 219.319 3.542 20 0 BHADMO CC[N@@H+](CC[C@@H]1CCCC1(F)F)C(C)C ZINC000877983246 590466017 /nfs/dbraw/zinc/46/60/17/590466017.db2.gz HMDWMZFNSIDQIX-NSHDSACASA-N 1 1 219.319 3.542 20 0 BHADMO C[N@@H+](CC[C@H]1CCCC1(F)F)Cc1ccoc1 ZINC000877988898 590466974 /nfs/dbraw/zinc/46/69/74/590466974.db2.gz PRPCSNBOUJBRHT-GFCCVEGCSA-N 1 1 243.297 3.537 20 0 BHADMO C[N@@H+](CC[C@@H]1CCCC1(F)F)Cc1ccoc1 ZINC000877988899 590466864 /nfs/dbraw/zinc/46/68/64/590466864.db2.gz PRPCSNBOUJBRHT-LBPRGKRZSA-N 1 1 243.297 3.537 20 0 BHADMO CC[N@@H+](Cc1scnc1Cl)[C@H](C)C(C)C ZINC000878001419 590468583 /nfs/dbraw/zinc/46/85/83/590468583.db2.gz XWCBLPVRERXKLX-SECBINFHSA-N 1 1 246.807 3.663 20 0 BHADMO CC[N@@H+](Cc1scnc1Cl)[C@@H](C)C(C)C ZINC000878001421 590468938 /nfs/dbraw/zinc/46/89/38/590468938.db2.gz XWCBLPVRERXKLX-VIFPVBQESA-N 1 1 246.807 3.663 20 0 BHADMO Cc1conc1C[N@H+](C)C1CCCCCCC1 ZINC000878020590 590472796 /nfs/dbraw/zinc/47/27/96/590472796.db2.gz RWGLMEXGYUVCPE-UHFFFAOYSA-N 1 1 236.359 3.528 20 0 BHADMO Cc1conc1C[N@@H+](CC1CC1)C1CCCCC1 ZINC000878046273 590480290 /nfs/dbraw/zinc/48/02/90/590480290.db2.gz VGYPSFOYEHJNCS-UHFFFAOYSA-N 1 1 248.370 3.528 20 0 BHADMO C[C@@H]1CCC[C@H](C)[N@@H+]1Cc1scnc1Cl ZINC000878087851 590490883 /nfs/dbraw/zinc/49/08/83/590490883.db2.gz ABSDEYHZOFCKKL-DTORHVGOSA-N 1 1 244.791 3.559 20 0 BHADMO Cc1conc1C[N@H+]1CCCC2(CCCCC2)C1 ZINC000878097623 590492395 /nfs/dbraw/zinc/49/23/95/590492395.db2.gz JNZPXVSRXLZALZ-UHFFFAOYSA-N 1 1 248.370 3.529 20 0 BHADMO C[C@@H]1CCCCC[N@H+]1Cc1scnc1Cl ZINC000878107247 590496387 /nfs/dbraw/zinc/49/63/87/590496387.db2.gz VYEXNVRSSSXCSI-SECBINFHSA-N 1 1 244.791 3.561 20 0 BHADMO C[C@H]1CCCCC[N@H+]1Cc1scnc1Cl ZINC000878107248 590495901 /nfs/dbraw/zinc/49/59/01/590495901.db2.gz VYEXNVRSSSXCSI-VIFPVBQESA-N 1 1 244.791 3.561 20 0 BHADMO CC[N@@H+](CC[C@H]1CCCC1(F)F)C1CCC1 ZINC000878116385 590498254 /nfs/dbraw/zinc/49/82/54/590498254.db2.gz NAYKKLACSJWLDQ-LLVKDONJSA-N 1 1 231.330 3.686 20 0 BHADMO CC[N@@H+](CC[C@@H]1CCCC1(F)F)C1CCC1 ZINC000878116386 590498344 /nfs/dbraw/zinc/49/83/44/590498344.db2.gz NAYKKLACSJWLDQ-NSHDSACASA-N 1 1 231.330 3.686 20 0 BHADMO CC[N@@H+](Cc1cc(C(F)(F)F)co1)C1CCC1 ZINC000878116417 590497775 /nfs/dbraw/zinc/49/77/75/590497775.db2.gz OBFHMDMUXHYEGV-UHFFFAOYSA-N 1 1 247.260 3.673 20 0 BHADMO C=C/C=C\CC[N@H+](CCC(F)(F)F)CC1CC1 ZINC000878178244 590515972 /nfs/dbraw/zinc/51/59/72/590515972.db2.gz LHQCRYMHLAKFQK-ARJAWSKDSA-N 1 1 247.304 3.783 20 0 BHADMO C=C/C=C/CC[N@H+](CCC(F)(F)F)CC1CC1 ZINC000878178353 590516071 /nfs/dbraw/zinc/51/60/71/590516071.db2.gz LHQCRYMHLAKFQK-ONEGZZNKSA-N 1 1 247.304 3.783 20 0 BHADMO C=C/C=C/CC[N@@H+]1CCC[C@H]1c1cccc(C)n1 ZINC000878198692 590522950 /nfs/dbraw/zinc/52/29/50/590522950.db2.gz PNTCGWFTLROBMC-APHBUQMISA-N 1 1 242.366 3.659 20 0 BHADMO C=C/C=C\CC[N@@H+]1CCC[C@H]1c1cccc(C)n1 ZINC000878198693 590522803 /nfs/dbraw/zinc/52/28/03/590522803.db2.gz PNTCGWFTLROBMC-AWFCHZOYSA-N 1 1 242.366 3.659 20 0 BHADMO C=C/C=C/CC[N@@H+]1CCC[C@@H]1c1cccc(C)n1 ZINC000878198694 590522743 /nfs/dbraw/zinc/52/27/43/590522743.db2.gz PNTCGWFTLROBMC-DWTRPJMMSA-N 1 1 242.366 3.659 20 0 BHADMO C=C/C=C\CC[N@@H+]1CCC[C@@H]1c1cccc(C)n1 ZINC000878198695 590522610 /nfs/dbraw/zinc/52/26/10/590522610.db2.gz PNTCGWFTLROBMC-YIEVGGLXSA-N 1 1 242.366 3.659 20 0 BHADMO CCCCC[C@@H]1CCC[N@H+]1Cc1nocc1C ZINC000878200608 583366888 /nfs/dbraw/zinc/36/68/88/583366888.db2.gz SJYAFFWKCOEJFT-CYBMUJFWSA-N 1 1 236.359 3.528 20 0 BHADMO CCCCC[C@H]1CCC[N@H+]1Cc1nocc1C ZINC000878200609 583367616 /nfs/dbraw/zinc/36/76/16/583367616.db2.gz SJYAFFWKCOEJFT-ZDUSSCGKSA-N 1 1 236.359 3.528 20 0 BHADMO Cc1conc1C[N@H+](C(C)C)C1CCCCC1 ZINC000878229982 590527568 /nfs/dbraw/zinc/52/75/68/590527568.db2.gz BZJMDCSUYYFPEC-UHFFFAOYSA-N 1 1 236.359 3.526 20 0 BHADMO C=C/C=C\CC[N@H+](C)[C@H](C)c1cccc(O)c1 ZINC000878242245 590528682 /nfs/dbraw/zinc/52/86/82/590528682.db2.gz IJVHNJMWSKLFKA-CFHLNLSMSA-N 1 1 231.339 3.517 20 0 BHADMO C=C/C=C/CC[N@H+](C)[C@@H](C)c1cccc(O)c1 ZINC000878242246 590528409 /nfs/dbraw/zinc/52/84/09/590528409.db2.gz IJVHNJMWSKLFKA-GFUIURDCSA-N 1 1 231.339 3.517 20 0 BHADMO C=C/C=C\CC[N@H+](C)[C@@H](C)c1cccc(O)c1 ZINC000878242247 590528797 /nfs/dbraw/zinc/52/87/97/590528797.db2.gz IJVHNJMWSKLFKA-SZZPACECSA-N 1 1 231.339 3.517 20 0 BHADMO C=C/C=C/CC[N@H+](C)[C@H](C)c1cccc(O)c1 ZINC000878242248 590527918 /nfs/dbraw/zinc/52/79/18/590527918.db2.gz IJVHNJMWSKLFKA-URWSZGRFSA-N 1 1 231.339 3.517 20 0 BHADMO CC(C)[N@@H+](Cc1scnc1Cl)C1CCC1 ZINC000878255341 590529830 /nfs/dbraw/zinc/52/98/30/590529830.db2.gz OYOWZYKMAKZFNS-UHFFFAOYSA-N 1 1 244.791 3.559 20 0 BHADMO CC(C)[N@H+](Cc1scnc1Cl)C1CCC1 ZINC000878255341 590529829 /nfs/dbraw/zinc/52/98/29/590529829.db2.gz OYOWZYKMAKZFNS-UHFFFAOYSA-N 1 1 244.791 3.559 20 0 BHADMO C[C@H](c1cccnc1)[N@@H+](C)CC1CC2(CCC2)C1 ZINC000878312901 590540546 /nfs/dbraw/zinc/54/05/46/590540546.db2.gz CHSDTPKZJQTZHE-CYBMUJFWSA-N 1 1 244.382 3.655 20 0 BHADMO C[C@@H](c1cccnc1)[N@@H+](C)CC1CC2(CCC2)C1 ZINC000878312902 590541232 /nfs/dbraw/zinc/54/12/32/590541232.db2.gz CHSDTPKZJQTZHE-ZDUSSCGKSA-N 1 1 244.382 3.655 20 0 BHADMO C[C@H](c1ccccn1)[N@@H+](C)CC1CC2(CCC2)C1 ZINC000878313973 590541067 /nfs/dbraw/zinc/54/10/67/590541067.db2.gz OKAQJWIYLUKEQI-CYBMUJFWSA-N 1 1 244.382 3.655 20 0 BHADMO C[C@@H](c1ccccn1)[N@@H+](C)CC1CC2(CCC2)C1 ZINC000878313974 590540505 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/nfs/dbraw/zinc/54/39/91/590543991.db2.gz URIHJSCXGVVFCF-LFAOLKIESA-N 1 1 230.355 3.597 20 0 BHADMO C=C/C=C/CC[N@H+](C)[C@H](CC)c1ccncc1 ZINC000878318124 590543947 /nfs/dbraw/zinc/54/39/47/590543947.db2.gz URIHJSCXGVVFCF-LQYUOIDQSA-N 1 1 230.355 3.597 20 0 BHADMO C=C/C=C\CC[N@H+](C)[C@@H](CC)c1ccncc1 ZINC000878318126 590543914 /nfs/dbraw/zinc/54/39/14/590543914.db2.gz URIHJSCXGVVFCF-XHPSBEMXSA-N 1 1 230.355 3.597 20 0 BHADMO CC[C@H]1CC[C@@H](C)[N@H+]1Cc1scnc1Cl ZINC000878339986 590551259 /nfs/dbraw/zinc/55/12/59/590551259.db2.gz HEHMVRLDUFPIJT-BDAKNGLRSA-N 1 1 244.791 3.559 20 0 BHADMO CC[C@@H]1CC[C@H](C)[N@H+]1Cc1scnc1Cl ZINC000878339988 590550951 /nfs/dbraw/zinc/55/09/51/590550951.db2.gz HEHMVRLDUFPIJT-DTWKUNHWSA-N 1 1 244.791 3.559 20 0 BHADMO CC[C@H]1CC[C@H](C)[N@H+]1Cc1scnc1Cl ZINC000878339989 590551220 /nfs/dbraw/zinc/55/12/20/590551220.db2.gz HEHMVRLDUFPIJT-IUCAKERBSA-N 1 1 244.791 3.559 20 0 BHADMO CC[C@@H]1CC[C@@H](C)[N@H+]1Cc1scnc1Cl ZINC000878339991 590550902 /nfs/dbraw/zinc/55/09/02/590550902.db2.gz HEHMVRLDUFPIJT-RKDXNWHRSA-N 1 1 244.791 3.559 20 0 BHADMO C=C/C=C/CC[N@H+]1C[C@H](C)C[C@@H]1c1cccnc1 ZINC000878428602 590565986 /nfs/dbraw/zinc/56/59/86/590565986.db2.gz PPMPUVMZAYJITN-ATQQARJTSA-N 1 1 242.366 3.597 20 0 BHADMO C=C/C=C\CC[N@H+]1C[C@H](C)C[C@H]1c1cccnc1 ZINC000878428604 590566438 /nfs/dbraw/zinc/56/64/38/590566438.db2.gz PPMPUVMZAYJITN-PJFORWJISA-N 1 1 242.366 3.597 20 0 BHADMO C=C/C=C\CC[N@H+]1C[C@H](C)C[C@@H]1c1cccnc1 ZINC000878428606 590566184 /nfs/dbraw/zinc/56/61/84/590566184.db2.gz PPMPUVMZAYJITN-RCELQXLSSA-N 1 1 242.366 3.597 20 0 BHADMO C=C/C=C/CC[N@H+]1C[C@H](C)C[C@H]1c1cccnc1 ZINC000878428608 590566116 /nfs/dbraw/zinc/56/61/16/590566116.db2.gz PPMPUVMZAYJITN-SBAHZNLJSA-N 1 1 242.366 3.597 20 0 BHADMO C=C/C=C/CC[N@@H+]1CCC[C@@H]1c1csc(C)n1 ZINC000878452162 590569349 /nfs/dbraw/zinc/56/93/49/590569349.db2.gz VWGINQDWXKGNPM-ISZGNANSSA-N 1 1 248.395 3.721 20 0 BHADMO C=C/C=C\CC[N@@H+]1CCC[C@@H]1c1csc(C)n1 ZINC000878452163 590569200 /nfs/dbraw/zinc/56/92/00/590569200.db2.gz VWGINQDWXKGNPM-ZRUQZJFASA-N 1 1 248.395 3.721 20 0 BHADMO Cc1cc(C)c(C[N@H+]2CCCC23CCC3)c(C)n1 ZINC000878517225 590585365 /nfs/dbraw/zinc/58/53/65/590585365.db2.gz BJZDCHISJNKQBV-UHFFFAOYSA-N 1 1 244.382 3.525 20 0 BHADMO C[N@@H+](Cc1scnc1Cl)C1(C)CCCC1 ZINC000878527058 590587028 /nfs/dbraw/zinc/58/70/28/590587028.db2.gz VXEWQABQQNSGHL-UHFFFAOYSA-N 1 1 244.791 3.561 20 0 BHADMO C=C/C=C\CC[N@H+](C)C1CCC(F)(F)CC1 ZINC000878620427 590596850 /nfs/dbraw/zinc/59/68/50/590596850.db2.gz QLYOBWMZSVWVHS-PLNGDYQASA-N 1 1 229.314 3.628 20 0 BHADMO C=C/C=C/CC[N@H+](C)C1CCC(F)(F)CC1 ZINC000878620428 590597377 /nfs/dbraw/zinc/59/73/77/590597377.db2.gz QLYOBWMZSVWVHS-SNAWJCMRSA-N 1 1 229.314 3.628 20 0 BHADMO C[N@@H+](CCCC1CC1)C1CCC(F)(F)CC1 ZINC000878620704 590597344 /nfs/dbraw/zinc/59/73/44/590597344.db2.gz UQZYWLASIBEXOB-UHFFFAOYSA-N 1 1 231.330 3.686 20 0 BHADMO CC[N@@H+](Cc1scnc1Cl)CC(C)(C)C ZINC000878637513 590598956 /nfs/dbraw/zinc/59/89/56/590598956.db2.gz UADKSETZPAEHGB-UHFFFAOYSA-N 1 1 246.807 3.665 20 0 BHADMO C[C@@H]1CCC(C)(C)[N@H+]1Cc1scnc1Cl ZINC000878691173 590610419 /nfs/dbraw/zinc/61/04/19/590610419.db2.gz XKKKCRLXWFNCPH-MRVPVSSYSA-N 1 1 244.791 3.559 20 0 BHADMO C[C@H]1CCC(C)(C)[N@H+]1Cc1scnc1Cl ZINC000878691175 590610393 /nfs/dbraw/zinc/61/03/93/590610393.db2.gz XKKKCRLXWFNCPH-QMMMGPOBSA-N 1 1 244.791 3.559 20 0 BHADMO C[N@@H+](CCC(C)(C)C)Cc1scnc1Cl ZINC000878762053 645823471 /nfs/dbraw/zinc/82/34/71/645823471.db2.gz SKHCUYORDWXJBS-UHFFFAOYSA-N 1 1 246.807 3.665 20 0 BHADMO C[N@H+](CCC(C)(C)C)Cc1scnc1Cl ZINC000878762053 645823467 /nfs/dbraw/zinc/82/34/67/645823467.db2.gz SKHCUYORDWXJBS-UHFFFAOYSA-N 1 1 246.807 3.665 20 0 BHADMO C[N@@H+](Cc1cc(C(F)(F)F)co1)C(C)(C)C ZINC000878768291 590620086 /nfs/dbraw/zinc/62/00/86/590620086.db2.gz FHPCTOQAUHHMGR-UHFFFAOYSA-N 1 1 235.249 3.529 20 0 BHADMO FC(F)(F)CCCC[N@H+]1CCC=C(Cl)C1 ZINC000878792285 590622846 /nfs/dbraw/zinc/62/28/46/590622846.db2.gz YYSFYELOMAQILP-UHFFFAOYSA-N 1 1 241.684 3.547 20 0 BHADMO FC(F)(F)CCCC[N@@H+]1CCC=C(Cl)C1 ZINC000878792285 590622845 /nfs/dbraw/zinc/62/28/45/590622845.db2.gz YYSFYELOMAQILP-UHFFFAOYSA-N 1 1 241.684 3.547 20 0 BHADMO Cc1conc1C[N@H+]1CCC[C@H]1CC1CCCC1 ZINC000878849024 590632939 /nfs/dbraw/zinc/63/29/39/590632939.db2.gz DGVRFYFIEZPEFH-AWEZNQCLSA-N 1 1 248.370 3.528 20 0 BHADMO Cc1conc1C[N@H+]1CCC[C@@H]1CC1CCCC1 ZINC000878849025 590632874 /nfs/dbraw/zinc/63/28/74/590632874.db2.gz DGVRFYFIEZPEFH-CQSZACIVSA-N 1 1 248.370 3.528 20 0 BHADMO Cc1conc1C[N@H+]1CCCC2(CCCC2)CC1 ZINC000878887331 590640838 /nfs/dbraw/zinc/64/08/38/590640838.db2.gz FKCAYUIVFKHSMD-UHFFFAOYSA-N 1 1 248.370 3.529 20 0 BHADMO CC[C@@H]1CC[C@@H](C)[N@@H+](Cc2coc(C3CC3)n2)C1 ZINC000878954398 590660286 /nfs/dbraw/zinc/66/02/86/590660286.db2.gz VPMBNIYXICGNKT-VXGBXAGGSA-N 1 1 248.370 3.563 20 0 BHADMO CC[C@@H]1CCC[C@H](C)[N@H+]1Cc1coc(C2CC2)n1 ZINC000878995206 590673061 /nfs/dbraw/zinc/67/30/61/590673061.db2.gz NOCKMOUWWGOWNH-SMDDNHRTSA-N 1 1 248.370 3.705 20 0 BHADMO Cc1conc1C[N@H+]1CCCC[C@H]1CC1CCC1 ZINC000878996005 590673207 /nfs/dbraw/zinc/67/32/07/590673207.db2.gz XJAOQHXQRUNXLN-AWEZNQCLSA-N 1 1 248.370 3.528 20 0 BHADMO Cc1conc1C[N@H+]1CCCC[C@@H]1CC1CCC1 ZINC000878996006 590673011 /nfs/dbraw/zinc/67/30/11/590673011.db2.gz XJAOQHXQRUNXLN-CQSZACIVSA-N 1 1 248.370 3.528 20 0 BHADMO C=C/C=C\CC[N@@H+]1CC(C)(C)[C@H]1c1cccnc1 ZINC000879009603 590676728 /nfs/dbraw/zinc/67/67/28/590676728.db2.gz BFCUTMRSKWBVFU-IYKSTZQJSA-N 1 1 242.366 3.597 20 0 BHADMO C=C/C=C/CC[N@@H+]1CC(C)(C)[C@H]1c1cccnc1 ZINC000879009604 590676419 /nfs/dbraw/zinc/67/64/19/590676419.db2.gz BFCUTMRSKWBVFU-LLYBFZRZSA-N 1 1 242.366 3.597 20 0 BHADMO C=C/C=C/CC[N@@H+]1CC(C)(C)[C@@H]1c1cccnc1 ZINC000879009605 590677463 /nfs/dbraw/zinc/67/74/63/590677463.db2.gz BFCUTMRSKWBVFU-NFAHFFEMSA-N 1 1 242.366 3.597 20 0 BHADMO C=C/C=C\CC[N@@H+]1CC(C)(C)[C@@H]1c1cccnc1 ZINC000879009606 590677239 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ZINC000879725158 590856811 /nfs/dbraw/zinc/85/68/11/590856811.db2.gz ULJBTOHKNGQYGR-UHFFFAOYSA-N 1 1 248.345 3.740 20 0 BHADMO Cc1cncc([C@@H]2CCC[N@H+]2[C@@H]2C=CCCC2)c1 ZINC000879747202 590861508 /nfs/dbraw/zinc/86/15/08/590861508.db2.gz KITZEUUFTRLYSU-CVEARBPZSA-N 1 1 242.366 3.636 20 0 BHADMO Cc1cncc([C@@H]2CCC[N@H+]2[C@H]2C=CCCC2)c1 ZINC000879747203 590860989 /nfs/dbraw/zinc/86/09/89/590860989.db2.gz KITZEUUFTRLYSU-HOTGVXAUSA-N 1 1 242.366 3.636 20 0 BHADMO Cc1cncc([C@H]2CCC[N@H+]2[C@@H]2C=CCCC2)c1 ZINC000879747204 590861404 /nfs/dbraw/zinc/86/14/04/590861404.db2.gz KITZEUUFTRLYSU-HZPDHXFCSA-N 1 1 242.366 3.636 20 0 BHADMO Cc1cncc([C@H]2CCC[N@H+]2[C@H]2C=CCCC2)c1 ZINC000879747205 590861141 /nfs/dbraw/zinc/86/11/41/590861141.db2.gz KITZEUUFTRLYSU-JKSUJKDBSA-N 1 1 242.366 3.636 20 0 BHADMO Cc1cncc([C@@H]2CCC[N@@H+]2CCC(C)C)c1 ZINC000879749016 590861546 /nfs/dbraw/zinc/86/15/46/590861546.db2.gz RTWVSENCFXGOAX-HNNXBMFYSA-N 1 1 232.371 3.573 20 0 BHADMO Cc1cncc([C@H]2CCC[N@@H+]2CCC(C)C)c1 ZINC000879749017 590861276 /nfs/dbraw/zinc/86/12/76/590861276.db2.gz RTWVSENCFXGOAX-OAHLLOKOSA-N 1 1 232.371 3.573 20 0 BHADMO CC[C@@H](C)C[N@H+]1CCC[C@H]1c1cncc(C)c1 ZINC000879749632 590862212 /nfs/dbraw/zinc/86/22/12/590862212.db2.gz GMLAVLYVRSYFGQ-DOMZBBRYSA-N 1 1 232.371 3.573 20 0 BHADMO CC[C@@H](C)C[N@H+]1CCC[C@@H]1c1cncc(C)c1 ZINC000879749633 590862289 /nfs/dbraw/zinc/86/22/89/590862289.db2.gz GMLAVLYVRSYFGQ-IUODEOHRSA-N 1 1 232.371 3.573 20 0 BHADMO CC[C@H](C)C[N@H+]1CCC[C@@H]1c1cncc(C)c1 ZINC000879749634 590863277 /nfs/dbraw/zinc/86/32/77/590863277.db2.gz GMLAVLYVRSYFGQ-SWLSCSKDSA-N 1 1 232.371 3.573 20 0 BHADMO CC[C@H](C)C[N@H+]1CCC[C@H]1c1cncc(C)c1 ZINC000879749635 590863316 /nfs/dbraw/zinc/86/33/16/590863316.db2.gz GMLAVLYVRSYFGQ-WFASDCNBSA-N 1 1 232.371 3.573 20 0 BHADMO CCCCC[N@H+]1CCC[C@H]1c1cncc(C)c1 ZINC000879750920 590862264 /nfs/dbraw/zinc/86/22/64/590862264.db2.gz YBAGVGUMQOSAMR-HNNXBMFYSA-N 1 1 232.371 3.717 20 0 BHADMO CCCCC[N@H+]1CCC[C@@H]1c1cncc(C)c1 ZINC000879750922 590862902 /nfs/dbraw/zinc/86/29/02/590862902.db2.gz YBAGVGUMQOSAMR-OAHLLOKOSA-N 1 1 232.371 3.717 20 0 BHADMO CC(C)=CCC[N@H+]1CCC[C@H]1c1cncc(C)c1 ZINC000879751904 590863504 /nfs/dbraw/zinc/86/35/04/590863504.db2.gz JNFNPDUQOUPJSO-INIZCTEOSA-N 1 1 244.382 3.883 20 0 BHADMO CC(C)=CCC[N@H+]1CCC[C@@H]1c1cncc(C)c1 ZINC000879751905 590863124 /nfs/dbraw/zinc/86/31/24/590863124.db2.gz JNFNPDUQOUPJSO-MRXNPFEDSA-N 1 1 244.382 3.883 20 0 BHADMO C=C/C=C/CC[N@@H+]1CCC[C@H]1c1cncc(C)c1 ZINC000879752696 590862577 /nfs/dbraw/zinc/86/25/77/590862577.db2.gz SZIGHHUZGUPCKJ-APHBUQMISA-N 1 1 242.366 3.659 20 0 BHADMO C=C/C=C\CC[N@@H+]1CCC[C@H]1c1cncc(C)c1 ZINC000879752697 590863180 /nfs/dbraw/zinc/86/31/80/590863180.db2.gz SZIGHHUZGUPCKJ-AWFCHZOYSA-N 1 1 242.366 3.659 20 0 BHADMO C=C/C=C/CC[N@@H+]1CCC[C@@H]1c1cncc(C)c1 ZINC000879752698 590862895 /nfs/dbraw/zinc/86/28/95/590862895.db2.gz SZIGHHUZGUPCKJ-DWTRPJMMSA-N 1 1 242.366 3.659 20 0 BHADMO C=C/C=C\CC[N@@H+]1CCC[C@@H]1c1cncc(C)c1 ZINC000879752699 590865088 /nfs/dbraw/zinc/86/50/88/590865088.db2.gz SZIGHHUZGUPCKJ-YIEVGGLXSA-N 1 1 242.366 3.659 20 0 BHADMO Cc1cncc([C@@H]2CCC[N@H+]2CC2=CCCC2)c1 ZINC000879752874 590864939 /nfs/dbraw/zinc/86/49/39/590864939.db2.gz VIUWAPVZBWVERY-INIZCTEOSA-N 1 1 242.366 3.637 20 0 BHADMO Cc1cncc([C@H]2CCC[N@H+]2CC2=CCCC2)c1 ZINC000879752875 590864466 /nfs/dbraw/zinc/86/44/66/590864466.db2.gz VIUWAPVZBWVERY-MRXNPFEDSA-N 1 1 242.366 3.637 20 0 BHADMO CCC1(CC)CCC[N@H+]1Cc1cc(C2CC2)no1 ZINC000880093959 590923640 /nfs/dbraw/zinc/92/36/40/590923640.db2.gz QQOBNTREJDFGRU-UHFFFAOYSA-N 1 1 248.370 3.707 20 0 BHADMO CCC1(CC)CCC[N@H+]1Cc1coc(C2CC2)n1 ZINC000880094163 590924356 /nfs/dbraw/zinc/92/43/56/590924356.db2.gz VMIMFDUTOQIPFV-UHFFFAOYSA-N 1 1 248.370 3.707 20 0 BHADMO CCC1(CC)CCC[N@H+]1Cc1scnc1C ZINC000880094567 590925141 /nfs/dbraw/zinc/92/51/41/590925141.db2.gz LPVVMPYICKNANG-UHFFFAOYSA-N 1 1 238.400 3.606 20 0 BHADMO CCCCCC[N@H+]1CC[C@@H](c2nccs2)C1 ZINC000880318135 591003512 /nfs/dbraw/zinc/00/35/12/591003512.db2.gz VRKLYNZQFNKMKP-GFCCVEGCSA-N 1 1 238.400 3.513 20 0 BHADMO CCCCCC[N@H+]1CC[C@H](c2nccs2)C1 ZINC000880318136 591004605 /nfs/dbraw/zinc/00/46/05/591004605.db2.gz VRKLYNZQFNKMKP-LBPRGKRZSA-N 1 1 238.400 3.513 20 0 BHADMO C[C@@H]1c2sccc2CC[N@@H+]1CCC(F)(F)F ZINC000880376896 583530434 /nfs/dbraw/zinc/53/04/34/583530434.db2.gz LEHRPGIEDGIBBN-MRVPVSSYSA-N 1 1 249.301 3.620 20 0 BHADMO C[C@H]1c2sccc2CC[N@@H+]1CCC(F)(F)F ZINC000880376897 583530684 /nfs/dbraw/zinc/53/06/84/583530684.db2.gz LEHRPGIEDGIBBN-QMMMGPOBSA-N 1 1 249.301 3.620 20 0 BHADMO FCCCC[N@H+]1C[C@@H]2CC[C@H]1c1ccccc12 ZINC000880536503 591086390 /nfs/dbraw/zinc/08/63/90/591086390.db2.gz MFMNDIXYRKQDOP-WFASDCNBSA-N 1 1 233.330 3.670 20 0 BHADMO CSCCC[N@H+]1C[C@@H]2CC[C@H]1c1ccccc12 ZINC000880537996 645836784 /nfs/dbraw/zinc/83/67/84/645836784.db2.gz ICZSTPWFKZXVJC-WFASDCNBSA-N 1 1 247.407 3.674 20 0 BHADMO C[C@@H](Nc1cc(C(C)(C)C)cc[nH+]1)c1ccc[nH]1 ZINC000882138617 591304517 /nfs/dbraw/zinc/30/45/17/591304517.db2.gz KRVUMFKLWHBLPK-LLVKDONJSA-N 1 1 243.354 3.880 20 0 BHADMO C[C@H](Nc1cc(C(C)(C)C)cc[nH+]1)c1ccc[nH]1 ZINC000882138618 591304837 /nfs/dbraw/zinc/30/48/37/591304837.db2.gz KRVUMFKLWHBLPK-NSHDSACASA-N 1 1 243.354 3.880 20 0 BHADMO CCCc1[nH+]ccn1CC[C@H]1CCCC1(F)F ZINC000882144160 591305303 /nfs/dbraw/zinc/30/53/03/591305303.db2.gz CGYPFYLHIICRPJ-LLVKDONJSA-N 1 1 242.313 3.661 20 0 BHADMO CCCc1[nH+]ccn1CC[C@@H]1CCCC1(F)F ZINC000882144163 591305245 /nfs/dbraw/zinc/30/52/45/591305245.db2.gz CGYPFYLHIICRPJ-NSHDSACASA-N 1 1 242.313 3.661 20 0 BHADMO CC(C)c1[nH+]ccn1CC[C@H]1CCCC1(F)F ZINC000882150676 591306744 /nfs/dbraw/zinc/30/67/44/591306744.db2.gz RRGJUWIBCONELZ-LLVKDONJSA-N 1 1 242.313 3.832 20 0 BHADMO CC(C)c1[nH+]ccn1CC[C@@H]1CCCC1(F)F ZINC000882150677 591307240 /nfs/dbraw/zinc/30/72/40/591307240.db2.gz RRGJUWIBCONELZ-NSHDSACASA-N 1 1 242.313 3.832 20 0 BHADMO FC1(F)CCC[C@@H]1CCn1cc[nH+]c1C1CC1 ZINC000882271119 583602691 /nfs/dbraw/zinc/60/26/91/583602691.db2.gz LYTDNBDVFAIFSX-LLVKDONJSA-N 1 1 240.297 3.586 20 0 BHADMO FC1(F)CCC[C@H]1CCn1cc[nH+]c1C1CC1 ZINC000882271120 583602676 /nfs/dbraw/zinc/60/26/76/583602676.db2.gz LYTDNBDVFAIFSX-NSHDSACASA-N 1 1 240.297 3.586 20 0 BHADMO CCc1[nH+]c(C)cn1CC[C@H]1CCCC1(F)F ZINC000882282053 591325901 /nfs/dbraw/zinc/32/59/01/591325901.db2.gz CUJKAQVKUIADHB-LLVKDONJSA-N 1 1 242.313 3.579 20 0 BHADMO CCc1[nH+]c(C)cn1CC[C@@H]1CCCC1(F)F ZINC000882282059 591325985 /nfs/dbraw/zinc/32/59/85/591325985.db2.gz CUJKAQVKUIADHB-NSHDSACASA-N 1 1 242.313 3.579 20 0 BHADMO Cc1cccc(N2CCc3ccsc3[C@@H]2C)[nH+]1 ZINC000882912203 591474666 /nfs/dbraw/zinc/47/46/66/591474666.db2.gz NCUPILIUIOGMJM-NSHDSACASA-N 1 1 244.363 3.575 20 0 BHADMO Cc1cc[nH+]c(N2CCc3ccsc3[C@H]2C)c1 ZINC000882912422 591474820 /nfs/dbraw/zinc/47/48/20/591474820.db2.gz TWSAYWZGVYDALK-LLVKDONJSA-N 1 1 244.363 3.575 20 0 BHADMO Cc1cc[nH+]c(N2CCc3ccsc3[C@@H]2C)c1 ZINC000882912423 591474843 /nfs/dbraw/zinc/47/48/43/591474843.db2.gz TWSAYWZGVYDALK-NSHDSACASA-N 1 1 244.363 3.575 20 0 BHADMO CCc1ccc(NCc2ccc(SC)o2)[nH+]c1 ZINC000883384122 591639300 /nfs/dbraw/zinc/63/93/00/591639300.db2.gz LTQXSFMIUDIDMX-UHFFFAOYSA-N 1 1 248.351 3.571 20 0 BHADMO CCc1ccc(NCc2ccc(Cl)o2)[nH+]c1 ZINC000883385895 591640315 /nfs/dbraw/zinc/64/03/15/591640315.db2.gz VIZYDSHODJAOLS-UHFFFAOYSA-N 1 1 236.702 3.503 20 0 BHADMO Cc1coc(C[NH2+]Cc2ccc([C@@H]3C[C@H]3C)o2)c1 ZINC000885927341 592108561 /nfs/dbraw/zinc/10/85/61/592108561.db2.gz QCYWPMOIZURYQO-BXUZGUMPSA-N 1 1 245.322 3.594 20 0 BHADMO Cc1coc(C[NH2+]Cc2ccc([C@H]3C[C@@H]3C)o2)c1 ZINC000885927342 592108425 /nfs/dbraw/zinc/10/84/25/592108425.db2.gz QCYWPMOIZURYQO-FZMZJTMJSA-N 1 1 245.322 3.594 20 0 BHADMO Cc1coc(C[NH2+]Cc2ccc([C@H]3C[C@H]3C)o2)c1 ZINC000885927343 592109102 /nfs/dbraw/zinc/10/91/02/592109102.db2.gz QCYWPMOIZURYQO-RISCZKNCSA-N 1 1 245.322 3.594 20 0 BHADMO Cc1coc(C[NH2+]Cc2ccc([C@@H]3C[C@@H]3C)o2)c1 ZINC000885927344 592108566 /nfs/dbraw/zinc/10/85/66/592108566.db2.gz QCYWPMOIZURYQO-SMDDNHRTSA-N 1 1 245.322 3.594 20 0 BHADMO CCC[C@H]([NH2+]Cc1cc(C)co1)c1ccccn1 ZINC000885969325 592118765 /nfs/dbraw/zinc/11/87/65/592118765.db2.gz OMMBQTBLHUIILO-AWEZNQCLSA-N 1 1 244.338 3.614 20 0 BHADMO CCC[C@@H]([NH2+]Cc1cc(C)co1)c1ccccn1 ZINC000885969326 592118654 /nfs/dbraw/zinc/11/86/54/592118654.db2.gz OMMBQTBLHUIILO-CQSZACIVSA-N 1 1 244.338 3.614 20 0 BHADMO Cc1coc(C[NH2+]C2(c3ccc(F)cc3)CC2)c1 ZINC000885971411 592119228 /nfs/dbraw/zinc/11/92/28/592119228.db2.gz ZHEDGEPDRNXGHO-UHFFFAOYSA-N 1 1 245.297 3.506 20 0 BHADMO Cc1coc(C[NH2+][C@@H]2CSc3ccccc32)c1 ZINC000885993096 592124249 /nfs/dbraw/zinc/12/42/49/592124249.db2.gz ZBHCKQJBIHPHTJ-CYBMUJFWSA-N 1 1 245.347 3.525 20 0 BHADMO Cc1coc(C[NH2+][C@H]2CSc3ccccc32)c1 ZINC000885993097 592124354 /nfs/dbraw/zinc/12/43/54/592124354.db2.gz ZBHCKQJBIHPHTJ-ZDUSSCGKSA-N 1 1 245.347 3.525 20 0 BHADMO Cc1coc(C[NH2+]C2(c3cccc(F)c3)CC2)c1 ZINC000885994428 592124153 /nfs/dbraw/zinc/12/41/53/592124153.db2.gz KVKCFNSCXIUUKS-UHFFFAOYSA-N 1 1 245.297 3.506 20 0 BHADMO C[C@@H](c1ccncc1)[N@@H+](C)CC[C@@H]1C[C@H]1C1CC1 ZINC000886091557 592146939 /nfs/dbraw/zinc/14/69/39/592146939.db2.gz CPHWTPLRULMMOY-MAZHCROVSA-N 1 1 244.382 3.511 20 0 BHADMO C[C@H](c1ccncc1)[N@@H+](C)CC[C@@H]1C[C@H]1C1CC1 ZINC000886091558 592146082 /nfs/dbraw/zinc/14/60/82/592146082.db2.gz CPHWTPLRULMMOY-WQVCFCJDSA-N 1 1 244.382 3.511 20 0 BHADMO C[C@@H](c1ccccn1)[N@@H+](C)CC[C@@H]1C[C@H]1C1CC1 ZINC000886092083 592146878 /nfs/dbraw/zinc/14/68/78/592146878.db2.gz NIZIVGIRVCJPEX-CFVMTHIKSA-N 1 1 244.382 3.511 20 0 BHADMO C[C@H](c1ccccn1)[N@@H+](C)CC[C@@H]1C[C@H]1C1CC1 ZINC000886092084 592146246 /nfs/dbraw/zinc/14/62/46/592146246.db2.gz NIZIVGIRVCJPEX-YUELXQCFSA-N 1 1 244.382 3.511 20 0 BHADMO C[C@@H](c1cccnc1)[N@@H+](C)CC[C@@H]1C[C@H]1C1CC1 ZINC000886092372 592146582 /nfs/dbraw/zinc/14/65/82/592146582.db2.gz VFXVZDNOEHYXMX-BJJXKVORSA-N 1 1 244.382 3.511 20 0 BHADMO C[C@H](c1cccnc1)[N@@H+](C)CC[C@@H]1C[C@H]1C1CC1 ZINC000886092373 592146490 /nfs/dbraw/zinc/14/64/90/592146490.db2.gz VFXVZDNOEHYXMX-XPKDYRNWSA-N 1 1 244.382 3.511 20 0 BHADMO Cc1coc(C[NH2+]C(C)(C)c2ccccc2F)c1 ZINC000886125234 585106769 /nfs/dbraw/zinc/10/67/69/585106769.db2.gz MAIDXLGPUFKWID-UHFFFAOYSA-N 1 1 247.313 3.752 20 0 BHADMO CC[C@H]([NH2+]Cc1cc(C)co1)c1ccccc1F ZINC000886153886 592164426 /nfs/dbraw/zinc/16/44/26/592164426.db2.gz UAJQALUAKXWOER-HNNXBMFYSA-N 1 1 247.313 3.968 20 0 BHADMO CC[C@@H]([NH2+]Cc1cc(C)co1)c1ccccc1F ZINC000886153887 592164255 /nfs/dbraw/zinc/16/42/55/592164255.db2.gz UAJQALUAKXWOER-OAHLLOKOSA-N 1 1 247.313 3.968 20 0 BHADMO Cc1coc(C[NH2+]Cc2ccc(C(C)(C)C)o2)c1 ZINC000886179485 592170854 /nfs/dbraw/zinc/17/08/54/592170854.db2.gz WQIHBJKPHSZXOS-UHFFFAOYSA-N 1 1 247.338 3.768 20 0 BHADMO Cc1coc(C[NH2+]Cc2cscc2Cl)c1 ZINC000886198051 592174406 /nfs/dbraw/zinc/17/44/06/592174406.db2.gz VOHHMSBPWQDGNY-UHFFFAOYSA-N 1 1 241.743 3.593 20 0 BHADMO C[C@@H]1CC(F)(F)CC[N@H+]1CC[C@@H]1C[C@H]1C1CC1 ZINC000886300591 592202765 /nfs/dbraw/zinc/20/27/65/592202765.db2.gz LKZPVGSSSFDABE-RTXFEEFZSA-N 1 1 243.341 3.542 20 0 BHADMO C[C@H]1CC(F)(F)CC[N@H+]1CC[C@@H]1C[C@H]1C1CC1 ZINC000886300592 585120122 /nfs/dbraw/zinc/12/01/22/585120122.db2.gz LKZPVGSSSFDABE-UHTWSYAYSA-N 1 1 243.341 3.542 20 0 BHADMO FC(F)(F)[C@]12CCC[C@H]1C[N@H+](C1CCCC1)C2 ZINC000886617258 592275728 /nfs/dbraw/zinc/27/57/28/592275728.db2.gz IRGJGAGDNGMNDW-JQWIXIFHSA-N 1 1 247.304 3.593 20 0 BHADMO C[N@@H+](CCCF)Cc1cc2ccccc2s1 ZINC000887141323 592457874 /nfs/dbraw/zinc/45/78/74/592457874.db2.gz OKVFKXNNYMEGBY-UHFFFAOYSA-N 1 1 237.343 3.693 20 0 BHADMO CC(C)[N@@H+](C)Cc1ccc(C(F)F)c(F)c1 ZINC000891452489 631364864 /nfs/dbraw/zinc/36/48/64/631364864.db2.gz ZJMXERZMBORJIH-UHFFFAOYSA-N 1 1 231.261 3.604 20 0 BHADMO CCCC[N@@H+](CC)Cc1nc(C(C)(C)C)co1 ZINC000891457787 631369984 /nfs/dbraw/zinc/36/99/84/631369984.db2.gz 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/nfs/dbraw/zinc/74/16/33/584741633.db2.gz KSEFWXXUXZOYDE-SECBINFHSA-N 1 1 245.351 3.589 20 0 BHADMO C[C@H](Nc1cccc(C2CC2)[nH+]1)c1ccns1 ZINC000903267398 584741502 /nfs/dbraw/zinc/74/15/02/584741502.db2.gz KSEFWXXUXZOYDE-VIFPVBQESA-N 1 1 245.351 3.589 20 0 BHADMO C[C@@H](Nc1cccc(C2CC2)[nH+]1)c1cscn1 ZINC000903267568 584741838 /nfs/dbraw/zinc/74/18/38/584741838.db2.gz DBHGJDXIBPZLJD-SECBINFHSA-N 1 1 245.351 3.589 20 0 BHADMO C[C@H](Nc1cccc(C2CC2)[nH+]1)c1cscn1 ZINC000903267569 584741766 /nfs/dbraw/zinc/74/17/66/584741766.db2.gz DBHGJDXIBPZLJD-VIFPVBQESA-N 1 1 245.351 3.589 20 0 BHADMO C[C@@H](Nc1cccc(C2CC2)[nH+]1)c1ccccn1 ZINC000903267570 584741829 /nfs/dbraw/zinc/74/18/29/584741829.db2.gz DBJJOFFYFWYURE-LLVKDONJSA-N 1 1 239.322 3.527 20 0 BHADMO C[C@H](Nc1cccc(C2CC2)[nH+]1)c1ccccn1 ZINC000903267571 584741726 /nfs/dbraw/zinc/74/17/26/584741726.db2.gz DBJJOFFYFWYURE-NSHDSACASA-N 1 1 239.322 3.527 20 0 BHADMO C[C@H](Nc1cccc(C2CC2)[nH+]1)c1ccco1 ZINC000903268234 584741756 /nfs/dbraw/zinc/74/17/56/584741756.db2.gz IHXFINHACOSOFN-JTQLQIEISA-N 1 1 228.295 3.725 20 0 BHADMO C[C@@H](Nc1cccc(C2CC2)[nH+]1)c1ccco1 ZINC000903268235 584741659 /nfs/dbraw/zinc/74/16/59/584741659.db2.gz IHXFINHACOSOFN-SNVBAGLBSA-N 1 1 228.295 3.725 20 0 BHADMO C[C@@H](Nc1cccc(C2CC2)[nH+]1)c1cccnc1 ZINC000903268254 584741918 /nfs/dbraw/zinc/74/19/18/584741918.db2.gz IVFCPYPDIYLKQA-LLVKDONJSA-N 1 1 239.322 3.527 20 0 BHADMO C[C@H](Nc1cccc(C2CC2)[nH+]1)c1cccnc1 ZINC000903268255 584741903 /nfs/dbraw/zinc/74/19/03/584741903.db2.gz IVFCPYPDIYLKQA-NSHDSACASA-N 1 1 239.322 3.527 20 0 BHADMO C[C@@H](Nc1cccc(C2CC2)[nH+]1)c1nccs1 ZINC000903269020 584741779 /nfs/dbraw/zinc/74/17/79/584741779.db2.gz PPWUHZFCWFFOGC-SECBINFHSA-N 1 1 245.351 3.589 20 0 BHADMO C[C@H](Nc1cccc(C2CC2)[nH+]1)c1nccs1 ZINC000903269021 584741289 /nfs/dbraw/zinc/74/12/89/584741289.db2.gz PPWUHZFCWFFOGC-VIFPVBQESA-N 1 1 245.351 3.589 20 0 BHADMO C[C@@H](Nc1cccc(C2CC2)[nH+]1)c1ccncc1 ZINC000903269245 584741612 /nfs/dbraw/zinc/74/16/12/584741612.db2.gz QLGQMWXUVOYRMZ-LLVKDONJSA-N 1 1 239.322 3.527 20 0 BHADMO C[C@H](Nc1cccc(C2CC2)[nH+]1)c1ccncc1 ZINC000903269246 584741809 /nfs/dbraw/zinc/74/18/09/584741809.db2.gz QLGQMWXUVOYRMZ-NSHDSACASA-N 1 1 239.322 3.527 20 0 BHADMO C[C@H](Nc1cccc(C2CC2)[nH+]1)c1ccoc1 ZINC000903269297 584741967 /nfs/dbraw/zinc/74/19/67/584741967.db2.gz RMXQTISAPRMWSA-JTQLQIEISA-N 1 1 228.295 3.725 20 0 BHADMO C[C@@H](Nc1cccc(C2CC2)[nH+]1)c1ccoc1 ZINC000903269298 584742175 /nfs/dbraw/zinc/74/21/75/584742175.db2.gz RMXQTISAPRMWSA-SNVBAGLBSA-N 1 1 228.295 3.725 20 0 BHADMO C[C@@H](Nc1cccc(C2CC2)[nH+]1)c1cncs1 ZINC000903270028 584742036 /nfs/dbraw/zinc/74/20/36/584742036.db2.gz UNNLPLBFPTWDNB-SECBINFHSA-N 1 1 245.351 3.589 20 0 BHADMO C[C@H](Nc1cccc(C2CC2)[nH+]1)c1cncs1 ZINC000903270029 584742190 /nfs/dbraw/zinc/74/21/90/584742190.db2.gz UNNLPLBFPTWDNB-VIFPVBQESA-N 1 1 245.351 3.589 20 0 BHADMO Cc1[nH]ncc1[C@H](C)[NH2+]C[C@@H]1CCC=CCCC1 ZINC000903346127 584753222 /nfs/dbraw/zinc/75/32/22/584753222.db2.gz RGUMDYWNJVCCPQ-GXTWGEPZSA-N 1 1 247.386 3.505 20 0 BHADMO Cc1[nH]ncc1[C@H](C)[NH2+]C[C@H]1CCC=CCCC1 ZINC000903346129 584753238 /nfs/dbraw/zinc/75/32/38/584753238.db2.gz RGUMDYWNJVCCPQ-JSGCOSHPSA-N 1 1 247.386 3.505 20 0 BHADMO Cc1[nH]ncc1[C@@H](C)[NH2+]C[C@H]1CCC=CCCC1 ZINC000903346130 584753162 /nfs/dbraw/zinc/75/31/62/584753162.db2.gz RGUMDYWNJVCCPQ-OCCSQVGLSA-N 1 1 247.386 3.505 20 0 BHADMO Cc1[nH]ncc1[C@@H](C)[NH2+]C[C@@H]1CCC=CCCC1 ZINC000903346132 584753002 /nfs/dbraw/zinc/75/30/02/584753002.db2.gz RGUMDYWNJVCCPQ-TZMCWYRMSA-N 1 1 247.386 3.505 20 0 BHADMO Cc1[nH+]c(N)ccc1-c1cccc(C2CC2)c1 ZINC000904767789 637477647 /nfs/dbraw/zinc/47/76/47/637477647.db2.gz CPVURMBUWACSOY-UHFFFAOYSA-N 1 1 224.307 3.517 20 0 BHADMO CCC[N@@H+](C/C=C/Cl)Cc1ccc(C)cc1 ZINC000913395655 640366319 /nfs/dbraw/zinc/36/63/19/640366319.db2.gz NXMCHQQABGDEHT-RUDMXATFSA-N 1 1 237.774 3.960 20 0 BHADMO CCC[N@@H+](C/C=C\Cl)Cc1ccc(C)cc1 ZINC000913395656 640366019 /nfs/dbraw/zinc/36/60/19/640366019.db2.gz NXMCHQQABGDEHT-WTKPLQERSA-N 1 1 237.774 3.960 20 0 BHADMO CC(C)CC[N@@H+](CCc1ccccc1)C1CC1 ZINC000914573659 641736199 /nfs/dbraw/zinc/73/61/99/641736199.db2.gz OGZKZMUGKGWEST-UHFFFAOYSA-N 1 1 231.383 3.740 20 0 BHADMO C[C@@H]([N@@H+](C)C[C@@H]1CC1(Cl)Cl)C(C)(C)C ZINC000914584237 641738755 /nfs/dbraw/zinc/73/87/55/641738755.db2.gz PTDZXHLINWHWEX-BDAKNGLRSA-N 1 1 238.202 3.547 20 0 BHADMO C[C@H]([N@@H+](C)C[C@H]1CC1(Cl)Cl)C(C)(C)C ZINC000914584243 641738230 /nfs/dbraw/zinc/73/82/30/641738230.db2.gz PTDZXHLINWHWEX-DTWKUNHWSA-N 1 1 238.202 3.547 20 0 BHADMO C[C@H]([N@@H+](C)C[C@@H]1CC1(Cl)Cl)C(C)(C)C ZINC000914584245 641739125 /nfs/dbraw/zinc/73/91/25/641739125.db2.gz PTDZXHLINWHWEX-IUCAKERBSA-N 1 1 238.202 3.547 20 0 BHADMO C[C@@H]([N@@H+](C)C[C@H]1CC1(Cl)Cl)C(C)(C)C ZINC000914584246 641739712 /nfs/dbraw/zinc/73/97/12/641739712.db2.gz PTDZXHLINWHWEX-RKDXNWHRSA-N 1 1 238.202 3.547 20 0 BHADMO Cc1ccccc1OCC[N@H+](C)[C@@H](C)C(C)(C)C ZINC000914584319 641739409 /nfs/dbraw/zinc/73/94/09/641739409.db2.gz SOHZOLQNIVXDMK-AWEZNQCLSA-N 1 1 249.398 3.740 20 0 BHADMO Cc1ccccc1OCC[N@H+](C)[C@H](C)C(C)(C)C ZINC000914584321 641739299 /nfs/dbraw/zinc/73/92/99/641739299.db2.gz SOHZOLQNIVXDMK-CQSZACIVSA-N 1 1 249.398 3.740 20 0 BHADMO CCCC[N@@H+](CCOc1ccc(C)cc1)C1CC1 ZINC000914788992 641765657 /nfs/dbraw/zinc/76/56/57/641765657.db2.gz RWNFDPCTFGGTDR-UHFFFAOYSA-N 1 1 247.382 3.638 20 0 BHADMO CC(C)[N@@H+](C/C=C/Cl)Cc1ccccc1 ZINC000914816211 641769928 /nfs/dbraw/zinc/76/99/28/641769928.db2.gz LTQQREUTALTENE-RMKNXTFCSA-N 1 1 223.747 3.650 20 0 BHADMO CC(C)[N@@H+](C/C=C\Cl)Cc1ccccc1 ZINC000914816212 641770462 /nfs/dbraw/zinc/77/04/62/641770462.db2.gz LTQQREUTALTENE-TWGQIWQCSA-N 1 1 223.747 3.650 20 0 BHADMO CCC(CC)[N@@H+](C/C=C/Cl)C/C=C\Cl ZINC000914866145 641777709 /nfs/dbraw/zinc/77/77/09/641777709.db2.gz GVWVMFCRDOVDHS-CGXWXWIYSA-N 1 1 236.186 3.982 20 0 BHADMO CC(C)[C@H](C)[N@@H+](C/C=C/Cl)C/C=C\Cl ZINC000914867476 641777512 /nfs/dbraw/zinc/77/75/12/641777512.db2.gz WIZRDMWXMMQLFA-QNEWNFPGSA-N 1 1 236.186 3.838 20 0 BHADMO CCCCC[N@@H+](C/C=C/Cl)C/C=C\Cl ZINC000914867575 641777747 /nfs/dbraw/zinc/77/77/47/641777747.db2.gz GNTHXRZCYSMZNJ-CGXWXWIYSA-N 1 1 236.186 3.984 20 0 BHADMO CCCCC[N@H+](C/C=C/Cl)C/C=C\Cl ZINC000914867575 641777743 /nfs/dbraw/zinc/77/77/43/641777743.db2.gz GNTHXRZCYSMZNJ-CGXWXWIYSA-N 1 1 236.186 3.984 20 0 BHADMO CCCCC[NH+](C/C=C/Cl)C/C=C/Cl ZINC000914867576 641777392 /nfs/dbraw/zinc/77/73/92/641777392.db2.gz GNTHXRZCYSMZNJ-KQQUZDAGSA-N 1 1 236.186 3.984 20 0 BHADMO CCCCC[NH+](C/C=C\Cl)C/C=C\Cl ZINC000914867577 641776720 /nfs/dbraw/zinc/77/67/20/641776720.db2.gz GNTHXRZCYSMZNJ-SFECMWDFSA-N 1 1 236.186 3.984 20 0 BHADMO Cl/C=C/C[N@@H+](C/C=C\Cl)CC1CCCC1 ZINC000914875231 641777542 /nfs/dbraw/zinc/77/75/42/641777542.db2.gz ZSIMFCIBMHGWHD-KYPMKJFLSA-N 1 1 248.197 3.984 20 0 BHADMO Cc1[nH]c(CSCc2ccccc2C)c(C)[nH+]1 ZINC000915476693 641827751 /nfs/dbraw/zinc/82/77/51/641827751.db2.gz DRMLOADZXJRVEW-UHFFFAOYSA-N 1 1 246.379 3.768 20 0 BHADMO Cc1[nH]c(CSC2CCCCC2)c(C)[nH+]1 ZINC000915643453 641849297 /nfs/dbraw/zinc/84/92/97/641849297.db2.gz RXSGHCAGNDVTAS-UHFFFAOYSA-N 1 1 224.373 3.592 20 0 BHADMO CCCCNc1[nH+]c2ccccc2n1CCC ZINC000915669594 641851749 /nfs/dbraw/zinc/85/17/49/641851749.db2.gz METFCOYOUFMCFS-UHFFFAOYSA-N 1 1 231.343 3.658 20 0 BHADMO CCCC[N@@H+]1CC=C(c2ccc(C)cc2)CC1 ZINC000915676684 641851355 /nfs/dbraw/zinc/85/13/55/641851355.db2.gz QVXFJUKEBFIXEX-UHFFFAOYSA-N 1 1 229.367 3.884 20 0 BHADMO CCC[N@@H+](C)Cc1ccccc1N1CCCCC1 ZINC000915678909 641850107 /nfs/dbraw/zinc/85/01/07/641850107.db2.gz ZQKQEZPGDQPZNR-UHFFFAOYSA-N 1 1 246.398 3.519 20 0 BHADMO CCCC[N@H+]1CCCCC[C@H]1c1ccncc1 ZINC000915680058 641853309 /nfs/dbraw/zinc/85/33/09/641853309.db2.gz AZNUCFSHYXXTTR-HNNXBMFYSA-N 1 1 232.371 3.799 20 0 BHADMO CCCC[N@H+]1CCCCC[C@@H]1c1ccncc1 ZINC000915680059 641852865 /nfs/dbraw/zinc/85/28/65/641852865.db2.gz AZNUCFSHYXXTTR-OAHLLOKOSA-N 1 1 232.371 3.799 20 0 BHADMO Cl/C=C\C[N@@H+](C1CC1)C1CCCCC1 ZINC000915685528 641852743 /nfs/dbraw/zinc/85/27/43/641852743.db2.gz BEYDJGUSUGQPML-WTKPLQERSA-N 1 1 213.752 3.536 20 0 BHADMO Cc1ccc([C@H](C)[N@@H+](C)C/C=C\Cl)cc1 ZINC000915689219 641852630 /nfs/dbraw/zinc/85/26/30/641852630.db2.gz JHOCQRRYVYMAAP-REPPVQDKSA-N 1 1 223.747 3.740 20 0 BHADMO Cc1ccc([C@@H](C)[N@@H+](C)C/C=C\Cl)cc1 ZINC000915689220 641852905 /nfs/dbraw/zinc/85/29/05/641852905.db2.gz JHOCQRRYVYMAAP-TWLAMCEISA-N 1 1 223.747 3.740 20 0 BHADMO CC[N@@H+](C/C=C\Cl)Cc1cccc(Cl)c1 ZINC000915689972 641853330 /nfs/dbraw/zinc/85/33/30/641853330.db2.gz MAHWVPGOCLGIKD-DAXSKMNVSA-N 1 1 244.165 3.914 20 0 BHADMO Cc1ccc(NCc2ccc3ncccc3c2)[nH+]c1 ZINC000916840180 641980994 /nfs/dbraw/zinc/98/09/94/641980994.db2.gz YEBPJYOWMYAMKV-UHFFFAOYSA-N 1 1 249.317 3.550 20 0 BHADMO C[C@@H]1CC[N@@H+](C/C=C\Cl)[C@@H]2CCCC[C@@H]12 ZINC000917053258 641996571 /nfs/dbraw/zinc/99/65/71/641996571.db2.gz VVMLZCPVQKWWSU-DWYHGGRPSA-N 1 1 227.779 3.640 20 0 BHADMO C[C@@H]1CC[N@@H+](C/C=C/Cl)[C@@H]2CCCC[C@H]12 ZINC000917053259 641997795 /nfs/dbraw/zinc/99/77/95/641997795.db2.gz VVMLZCPVQKWWSU-NLJIYFGUSA-N 1 1 227.779 3.640 20 0 BHADMO C[C@@H]1CC[N@@H+](C/C=C/Cl)[C@@H]2CCCC[C@@H]12 ZINC000917053260 641996690 /nfs/dbraw/zinc/99/66/90/641996690.db2.gz VVMLZCPVQKWWSU-PIXJVXROSA-N 1 1 227.779 3.640 20 0 BHADMO C[C@@H]1CC[N@@H+](C/C=C\Cl)[C@@H]2CCCC[C@H]12 ZINC000917053261 641997878 /nfs/dbraw/zinc/99/78/78/641997878.db2.gz VVMLZCPVQKWWSU-ZXTJVADRSA-N 1 1 227.779 3.640 20 0 BHADMO Cl/C=C\C[N@@H+](Cc1ccco1)C1CCCC1 ZINC000917063373 641999088 /nfs/dbraw/zinc/99/90/88/641999088.db2.gz IPYQVOZKNDTYKH-YWEYNIOJSA-N 1 1 239.746 3.777 20 0 BHADMO C[N@H+](C/C=C\Cl)CCCCc1ccccc1 ZINC000917063804 641999252 /nfs/dbraw/zinc/99/92/52/641999252.db2.gz JVSYWXOTQRDYAL-XFFZJAGNSA-N 1 1 237.774 3.694 20 0 BHADMO C[C@H](c1ccccc1F)[N@@H+](C)C/C=C\Cl ZINC000917064424 641998520 /nfs/dbraw/zinc/99/85/20/641998520.db2.gz SYPIZLCJBXZKJC-DAGBOUIGSA-N 1 1 227.710 3.571 20 0 BHADMO C[C@H](c1ccccc1F)[N@H+](C)C/C=C\Cl ZINC000917064424 641998515 /nfs/dbraw/zinc/99/85/15/641998515.db2.gz SYPIZLCJBXZKJC-DAGBOUIGSA-N 1 1 227.710 3.571 20 0 BHADMO C[C@@H](c1ccccc1F)[N@@H+](C)C/C=C\Cl ZINC000917064425 641999976 /nfs/dbraw/zinc/99/99/76/641999976.db2.gz SYPIZLCJBXZKJC-NVDWLVSRSA-N 1 1 227.710 3.571 20 0 BHADMO C[C@@H](c1ccccc1F)[N@H+](C)C/C=C\Cl ZINC000917064425 641999973 /nfs/dbraw/zinc/99/99/73/641999973.db2.gz SYPIZLCJBXZKJC-NVDWLVSRSA-N 1 1 227.710 3.571 20 0 BHADMO CC1CCC([N@@H+](C/C=C\Cl)C2CC2)CC1 ZINC000917065292 642000321 /nfs/dbraw/zinc/00/03/21/642000321.db2.gz USACVCBPPBPSGN-MBXJOHMKSA-N 1 1 227.779 3.782 20 0 BHADMO CC1CCC([N@@H+](C/C=C/Cl)C2CC2)CC1 ZINC000917065293 641999122 /nfs/dbraw/zinc/99/91/22/641999122.db2.gz USACVCBPPBPSGN-XNWCZRBMSA-N 1 1 227.779 3.782 20 0 BHADMO Cl/C=C\C[N@H+]1CCC[C@H]1CCc1ccccc1 ZINC000917066118 641999495 /nfs/dbraw/zinc/99/94/95/641999495.db2.gz VGRSPGDSHDAXFE-GHAIFCDISA-N 1 1 249.785 3.836 20 0 BHADMO Cl/C=C/C[N@H+]1CCC[C@@H]1CCc1ccccc1 ZINC000917066119 641999043 /nfs/dbraw/zinc/99/90/43/641999043.db2.gz VGRSPGDSHDAXFE-IWOOQVRJSA-N 1 1 249.785 3.836 20 0 BHADMO Cl/C=C\C[N@H+]1CCC[C@@H]1CCc1ccccc1 ZINC000917066120 641999381 /nfs/dbraw/zinc/99/93/81/641999381.db2.gz VGRSPGDSHDAXFE-NVWZYQMFSA-N 1 1 249.785 3.836 20 0 BHADMO Cl/C=C/C[N@H+]1CCC[C@H]1CCc1ccccc1 ZINC000917066121 641999009 /nfs/dbraw/zinc/99/90/09/641999009.db2.gz VGRSPGDSHDAXFE-RILDOFPPSA-N 1 1 249.785 3.836 20 0 BHADMO Fc1cccc(C[N@@H+](C/C=C\Cl)C2CC2)c1 ZINC000917066624 641999081 /nfs/dbraw/zinc/99/90/81/641999081.db2.gz MEMLHWXTEUOCMW-UQCOIBPSSA-N 1 1 239.721 3.543 20 0 BHADMO Fc1cccc(C[N@H+](C/C=C\Cl)C2CC2)c1 ZINC000917066624 641999078 /nfs/dbraw/zinc/99/90/78/641999078.db2.gz MEMLHWXTEUOCMW-UQCOIBPSSA-N 1 1 239.721 3.543 20 0 BHADMO Cl/C=C/C[N@H+]1CCC[C@H]1C1CCCCC1 ZINC000917067529 642002454 /nfs/dbraw/zinc/00/24/54/642002454.db2.gz LOVCJFBTHHRMNS-NEXMIYJRSA-N 1 1 227.779 3.784 20 0 BHADMO Cl/C=C/C[N@H+]1CCC[C@@H]1C1CCCCC1 ZINC000917067530 642002334 /nfs/dbraw/zinc/00/23/34/642002334.db2.gz LOVCJFBTHHRMNS-OMDQHUAHSA-N 1 1 227.779 3.784 20 0 BHADMO Cl/C=C\C[N@H+]1CCC[C@H]1C1CCCCC1 ZINC000917067531 642000969 /nfs/dbraw/zinc/00/09/69/642000969.db2.gz LOVCJFBTHHRMNS-QGOGUYACSA-N 1 1 227.779 3.784 20 0 BHADMO Cl/C=C\C[N@H+]1CCC[C@@H]1C1CCCCC1 ZINC000917067532 642001604 /nfs/dbraw/zinc/00/16/04/642001604.db2.gz LOVCJFBTHHRMNS-WYOARUQKSA-N 1 1 227.779 3.784 20 0 BHADMO Cc1ccccc1[C@@H]1CCC[N@H+]1C/C=C/Cl ZINC000917069591 642000678 /nfs/dbraw/zinc/00/06/78/642000678.db2.gz BNWDVRVBFQCEBB-KVEVGEHQSA-N 1 1 235.758 3.884 20 0 BHADMO Cc1ccccc1[C@@H]1CCC[N@H+]1C/C=C\Cl ZINC000917069592 642001217 /nfs/dbraw/zinc/00/12/17/642001217.db2.gz BNWDVRVBFQCEBB-UQYHUFHVSA-N 1 1 235.758 3.884 20 0 BHADMO Cc1ccccc1[C@H]1CCC[N@H+]1C/C=C\Cl ZINC000917069593 642003071 /nfs/dbraw/zinc/00/30/71/642003071.db2.gz BNWDVRVBFQCEBB-VYLZPFMQSA-N 1 1 235.758 3.884 20 0 BHADMO Cc1ccccc1[C@H]1CCC[N@H+]1C/C=C/Cl 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ZDMXKWCMADNZHE-QPJJXVBHSA-N 1 1 241.737 3.789 20 0 BHADMO CC(C)[N@@H+](C/C=C/Cl)Cc1cccs1 ZINC000920208794 642447431 /nfs/dbraw/zinc/44/74/31/642447431.db2.gz OKXSLQJANLZORH-GQCTYLIASA-N 1 1 229.776 3.711 20 0 BHADMO CC(C)[N@@H+](C/C=C\Cl)Cc1cccs1 ZINC000920208795 642448887 /nfs/dbraw/zinc/44/88/87/642448887.db2.gz OKXSLQJANLZORH-XQRVVYSFSA-N 1 1 229.776 3.711 20 0 BHADMO CC[N@@H+](CCc1ccccn1)CC1CCCCC1 ZINC000920257804 642460308 /nfs/dbraw/zinc/46/03/08/642460308.db2.gz LKYAUDYGXHDRLY-UHFFFAOYSA-N 1 1 246.398 3.526 20 0 BHADMO CCCCC(N)=[NH+]OCc1cc(C)sc1C ZINC000920401800 642488582 /nfs/dbraw/zinc/48/85/82/642488582.db2.gz ORLVHMBPJLNIBI-UHFFFAOYSA-N 1 1 240.372 3.554 20 0 BHADMO CC(C)CCC(N)=[NH+]OC/C=C/c1ccccc1 ZINC000921190369 642583495 /nfs/dbraw/zinc/58/34/95/642583495.db2.gz PVPIPBWCTWBCHC-RMKNXTFCSA-N 1 1 246.354 3.634 20 0 BHADMO CC(C)CCC(N)=[NH+]OC/C=C\c1ccccc1 ZINC000921190370 642583367 /nfs/dbraw/zinc/58/33/67/642583367.db2.gz PVPIPBWCTWBCHC-TWGQIWQCSA-N 1 1 246.354 3.634 20 0 BHADMO CC(C)(/C=C/Cl)[NH2+]Cc1ccc(Cl)o1 ZINC000922650681 644057267 /nfs/dbraw/zinc/05/72/67/644057267.db2.gz QZKHLEWEXALCQX-AATRIKPKSA-N 1 1 234.126 3.554 20 0 BHADMO CC(C)(/C=C\Cl)[NH2+]Cc1ccc(Cl)o1 ZINC000922650682 644057529 /nfs/dbraw/zinc/05/75/29/644057529.db2.gz QZKHLEWEXALCQX-WAYWQWQTSA-N 1 1 234.126 3.554 20 0 BHADMO CC[C@@H]([NH2+][C@@H](C)c1ncco1)c1ccc(C)cc1 ZINC000924547461 632808473 /nfs/dbraw/zinc/80/84/73/632808473.db2.gz QKKUFKYNAUIBSB-GXTWGEPZSA-N 1 1 244.338 3.785 20 0 BHADMO CC[C@H]([NH2+][C@@H](C)c1ncco1)c1ccc(C)cc1 ZINC000924547462 632808801 /nfs/dbraw/zinc/80/88/01/632808801.db2.gz QKKUFKYNAUIBSB-JSGCOSHPSA-N 1 1 244.338 3.785 20 0 BHADMO CC[C@H]([NH2+][C@H](C)c1ncco1)c1ccc(C)cc1 ZINC000924547463 632809398 /nfs/dbraw/zinc/80/93/98/632809398.db2.gz QKKUFKYNAUIBSB-OCCSQVGLSA-N 1 1 244.338 3.785 20 0 BHADMO CC[C@@H]([NH2+][C@H](C)c1ncco1)c1ccc(C)cc1 ZINC000924547465 632809106 /nfs/dbraw/zinc/80/91/06/632809106.db2.gz QKKUFKYNAUIBSB-TZMCWYRMSA-N 1 1 244.338 3.785 20 0 BHADMO CCC[C@@H]([NH2+][C@@H](C)c1ncco1)c1ccccc1 ZINC000924567288 632894009 /nfs/dbraw/zinc/89/40/09/632894009.db2.gz LGZXTKZIXNMGFI-GXTWGEPZSA-N 1 1 244.338 3.867 20 0 BHADMO CCC[C@H]([NH2+][C@@H](C)c1ncco1)c1ccccc1 ZINC000924567289 632893418 /nfs/dbraw/zinc/89/34/18/632893418.db2.gz LGZXTKZIXNMGFI-JSGCOSHPSA-N 1 1 244.338 3.867 20 0 BHADMO CCC[C@H]([NH2+][C@H](C)c1ncco1)c1ccccc1 ZINC000924567290 632893529 /nfs/dbraw/zinc/89/35/29/632893529.db2.gz LGZXTKZIXNMGFI-OCCSQVGLSA-N 1 1 244.338 3.867 20 0 BHADMO CCC[C@@H]([NH2+][C@H](C)c1ncco1)c1ccccc1 ZINC000924567291 632893907 /nfs/dbraw/zinc/89/39/07/632893907.db2.gz LGZXTKZIXNMGFI-TZMCWYRMSA-N 1 1 244.338 3.867 20 0 BHADMO CC(C)[C@@H]([NH2+][C@@H](C)c1ncco1)c1ccccc1 ZINC000924579828 646072493 /nfs/dbraw/zinc/07/24/93/646072493.db2.gz FZIQBZVMNSZECL-GXTWGEPZSA-N 1 1 244.338 3.723 20 0 BHADMO C[C@@H]([NH2+][C@@H](c1cccs1)C1CC1)c1ncco1 ZINC000924590722 646075407 /nfs/dbraw/zinc/07/54/07/646075407.db2.gz IMKBYZOLQJURFO-BXKDBHETSA-N 1 1 248.351 3.538 20 0 BHADMO C[C@H]([NH2+][C@H](c1cccs1)C1CC1)c1ncco1 ZINC000924590724 646074509 /nfs/dbraw/zinc/07/45/09/646074509.db2.gz IMKBYZOLQJURFO-CABZTGNLSA-N 1 1 248.351 3.538 20 0 BHADMO C[C@H]([NH2+][C@@H](c1cccs1)C1CC1)c1ncco1 ZINC000924590726 646075470 /nfs/dbraw/zinc/07/54/70/646075470.db2.gz IMKBYZOLQJURFO-JOYOIKCWSA-N 1 1 248.351 3.538 20 0 BHADMO C[C@@H]([NH2+][C@H](c1cccs1)C1CC1)c1ncco1 ZINC000924590727 646074972 /nfs/dbraw/zinc/07/49/72/646074972.db2.gz IMKBYZOLQJURFO-SKDRFNHKSA-N 1 1 248.351 3.538 20 0 BHADMO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2ncco2)c(C)c1 ZINC000924721592 637033593 /nfs/dbraw/zinc/03/35/93/637033593.db2.gz DGPNSWWUBSJTKH-CHWSQXEVSA-N 1 1 244.338 3.703 20 0 BHADMO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2ncco2)c(C)c1 ZINC000924721594 637034282 /nfs/dbraw/zinc/03/42/82/637034282.db2.gz DGPNSWWUBSJTKH-OLZOCXBDSA-N 1 1 244.338 3.703 20 0 BHADMO Cc1ccc([C@H](C)[NH2+][C@H](C)c2ncco2)c(C)c1 ZINC000924721597 637034429 /nfs/dbraw/zinc/03/44/29/637034429.db2.gz DGPNSWWUBSJTKH-QWHCGFSZSA-N 1 1 244.338 3.703 20 0 BHADMO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2ncco2)c(C)c1 ZINC000924721599 637034126 /nfs/dbraw/zinc/03/41/26/637034126.db2.gz DGPNSWWUBSJTKH-STQMWFEESA-N 1 1 244.338 3.703 20 0 BHADMO C[C@@H](Nc1cc(C2CC2)cc[nH+]1)c1ccns1 ZINC000926456878 632080029 /nfs/dbraw/zinc/08/00/29/632080029.db2.gz NYCFVQDMOBGYLA-SECBINFHSA-N 1 1 245.351 3.589 20 0 BHADMO C[C@H](Nc1cc(C2CC2)cc[nH+]1)c1ccns1 ZINC000926456883 632079401 /nfs/dbraw/zinc/07/94/01/632079401.db2.gz NYCFVQDMOBGYLA-VIFPVBQESA-N 1 1 245.351 3.589 20 0 BHADMO C[C@@H]([NH2+]CCCCF)C(F)(F)c1ccccc1 ZINC000926463634 646649849 /nfs/dbraw/zinc/64/98/49/646649849.db2.gz NFYWFOOAKJYVHM-LLVKDONJSA-N 1 1 245.288 3.506 20 0 BHADMO C[C@H]([NH2+]CCCCF)C(F)(F)c1ccccc1 ZINC000926463635 646649168 /nfs/dbraw/zinc/64/91/68/646649168.db2.gz NFYWFOOAKJYVHM-NSHDSACASA-N 1 1 245.288 3.506 20 0 BHADMO C[C@@H](F)CC[NH2+][C@H](C)C(F)(F)c1ccccc1 ZINC000926485080 646656582 /nfs/dbraw/zinc/65/65/82/646656582.db2.gz HDDDQQXIHCRTNP-GHMZBOCLSA-N 1 1 245.288 3.505 20 0 BHADMO C[C@@H](F)CC[NH2+][C@@H](C)C(F)(F)c1ccccc1 ZINC000926485081 646655900 /nfs/dbraw/zinc/65/59/00/646655900.db2.gz HDDDQQXIHCRTNP-MNOVXSKESA-N 1 1 245.288 3.505 20 0 BHADMO C[C@H](F)CC[NH2+][C@@H](C)C(F)(F)c1ccccc1 ZINC000926485082 646656215 /nfs/dbraw/zinc/65/62/15/646656215.db2.gz HDDDQQXIHCRTNP-QWRGUYRKSA-N 1 1 245.288 3.505 20 0 BHADMO C[C@@H]([NH2+]CC[C@H](C)F)C(F)(F)c1ccccc1 ZINC000926485083 646656729 /nfs/dbraw/zinc/65/67/29/646656729.db2.gz HDDDQQXIHCRTNP-WDEREUQCSA-N 1 1 245.288 3.505 20 0 BHADMO C[N@@H+](CCCC(C)(F)F)Cc1ccccc1F ZINC000929120979 645954928 /nfs/dbraw/zinc/95/49/28/645954928.db2.gz DXPYVHCVCLKOFV-UHFFFAOYSA-N 1 1 245.288 3.693 20 0 BHADMO CCCC[N@@H+](C)Cc1cnc(-c2ccccc2)o1 ZINC000929126286 645958092 /nfs/dbraw/zinc/95/80/92/645958092.db2.gz VTIDOGOCFALCEW-UHFFFAOYSA-N 1 1 244.338 3.574 20 0 BHADMO C[C@@H](C1CC1)[N@H+]1CCC[C@@H]1c1cccs1 ZINC000929131423 645950140 /nfs/dbraw/zinc/95/01/40/645950140.db2.gz 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